AMS 2021.101 r94406 2021-05-14 2025-06-27T15:42:21.000 GEOMETRY OPTIMIZATION DFT PBEc PBEx PBEc PBEx 7993.860257 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Restricted Restricted 0.00000 1.0E-08 1000 conjugate-gradient 78.39000 1.93000 1 3 5930.04324826 22566.99952198 Water DFT PW92 == Not Default == Restricted Restricted Point Charge Nuclei Frozen Orbital(s) Task GeometryOptimization System Atoms Mo -7.919706420690217 -6.028778437468693 -0.2244757170038244 adf.R=1.992 Mo -4.885465902363156 -5.628934307952024 -0.1918185727488644 adf.R=1.992 Mo -6.577670247578746 -2.993229130152914 -0.07634845108406439 adf.R=1.992 Mo -1.783091675148756 -5.648486468186775 -0.2117419299350144 adf.R=1.992 Mo -3.376282427772536 -2.812867993924124 -0.0737591564516944 adf.R=1.992 Mo 1.495348369399234 -5.479641798386434 -0.0856184076139344 adf.R=1.992 Mo -0.1891151794238959 -2.745847199890584 -0.04524392839676439 adf.R=1.992 Mo -5.045931120695366 -0.1248964680379943 -0.02299557397203439 adf.R=1.992 Mo -1.839977544405786 0.003823184581465799 0.009208009342065608 adf.R=1.992 Mo -3.416901071196396 2.762939224716936 0.06086231523090561 adf.R=1.992 Mo 4.550392146603913 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0.909683426619506 1.608352172450486 adf.R=2.16 S -1.844840895845146 3.699263669673556 1.636006753697426 adf.R=2.16 S 6.142594222734715 -4.709525176454144 1.572238987594286 adf.R=2.16 S 4.583512367521575 -1.852416206807504 1.619328527777656 adf.R=2.16 S 2.990166005198474 0.9075426831914259 1.649572671716686 adf.R=2.16 S 1.365090107323284 3.715710814066216 1.674120350261466 adf.R=2.16 S -0.2343857990997162 6.507035563932225 1.699124841618906 adf.R=2.16 S -1.807927279894216 9.293171594529365 1.770040753671966 adf.R=2.16 S 9.335528531347215 -4.659042096276794 1.676240721396496 adf.R=2.16 S 7.797636346546495 -1.905180018941734 1.751988631452356 adf.R=2.16 S 6.316419175859865 0.9526712208847659 1.657261358960736 adf.R=2.16 S 4.582009280079394 3.687309505919046 1.827828272982156 adf.R=2.16 S 3.058940716697804 6.552167523316576 1.713531387885406 adf.R=2.16 S 1.419624957852684 9.363362869605716 1.825967043045326 adf.R=2.16 S -6.533866050622426 -4.789842186718394 -1.734485376248674 adf.R=2.16 S 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3.761006349657756 -1.448188507398114 adf.R=2.16 S -0.1717625736287061 6.547845726702256 -1.464810903081414 adf.R=2.16 S 9.445115726008074 -4.725790080657684 -1.389059966252524 adf.R=2.16 S 7.875855046953635 -1.864514974038745 -1.551965964560944 adf.R=2.16 S 6.360697309788995 1.010028092988736 -1.397543526632844 adf.R=2.16 S 4.630288924252953 3.748500637222456 -1.507891459828634 adf.R=2.16 S 3.115232857052354 6.591467440886436 -1.347496399374594 adf.R=2.16 S 1.503649371703554 9.358431560552866 -1.496523049630124 adf.R=2.16 S 0.3807883872406839 12.63493970117308 -1.562024452220434 adf.R=2.16 S -8.167043320781715 -7.944459170874044 -1.336117715492074 adf.R=2.16 S -4.700706894059836 -7.716284966153834 1.036401964981236 adf.R=2.16 S -1.806789481182476 -7.528979095006914 -1.501807881287944 adf.R=2.16 S 1.307773581492684 -7.614075278577284 0.06104027465946561 adf.R=2.16 S 4.656298954863914 -7.638847155321354 -0.5148952040671244 adf.R=2.16 S 7.954020103460344 -7.644236413742474 1.131928148200786 adf.R=2.16 S 11.46891563561215 -7.483855023656064 -0.9064770608838644 adf.R=2.16 S 12.89459037127692 -5.124660616651254 1.490332634296986 adf.R=2.16 S 11.30248236575238 -1.958761701292985 0.1142756338601356 adf.R=2.16 S 9.738233360252154 0.929199186510026 0.1981235061758456 adf.R=2.16 S 8.019674457276244 3.851318826992346 0.2091695028227856 adf.R=2.16 S 6.422125881902854 6.588566173154866 0.2338596430174556 adf.R=2.16 S 4.800138382992865 9.555697630873626 0.2833470574212656 adf.R=2.16 S 3.306160154874434 12.14502154489926 0.2201167467867956 adf.R=2.16 O 12.31088919699952 -4.540339873340864 -1.402648986069074 adf.R=1.72 H 13.24637268074905 -4.656406237402834 -1.125540035553744 adf.R=1.30 H -6.016829539123366 3.051148886981406 -1.843097408941184 adf.R=1.30 H -6.440895021672166 1.608376010039926 2.278776442338376 adf.R=1.30 H -3.136053163149396 7.545865986781856 2.238352412476626 adf.R=1.30 H -4.542751909939306 7.022848221885575 0.9807297914770156 adf.R=1.30 H -0.9493347539254859 12.33695672686152 -1.576083615712444 adf.R=1.30 H -1.025044002286746 9.666745310301597 -2.613309959585164 adf.R=1.30 H -1.177880601554416 10.02962826162065 2.727013807186366 adf.R=1.30 H -2.444325027867086 10.37570911351287 1.241880820382836 adf.R=1.30 H -5.913087912567576 4.484045510936306 1.292085109471456 adf.R=1.30 H -3.167968897546726 6.048445613565995 -2.774011576634094 adf.R=1.30 H -4.551889990920016 4.234003175074196 2.702517190125896 adf.R=1.30 H -6.486064130884076 0.3106639546163357 -2.864342241053904 adf.R=1.30 O 10.71693942037465 -7.112349679754184 1.984722434668996 adf.R=1.72 H 11.23856622668462 -7.914421859261955 1.767452718841366 adf.R=1.30 O 7.521539284382435 -7.228960360999563 -1.687278583239094 adf.R=1.72 H 7.941268980279615 -7.939112661310855 -1.130647407678024 adf.R=1.30 H -0.07585834906748623 13.61572220829663 1.313287073753296 adf.R=1.30 H -10.84991580482519 -6.262750104092063 0.8690952189796656 adf.R=1.30 H -7.717443723922996 -1.795648507031084 -2.766319411503534 adf.R=1.30 H -9.167792040178186 -2.881746922723734 -2.023304494241224 adf.R=1.30 O -1.762806560799116 -7.348137001916173 1.461466222045356 adf.R=1.72 H -2.746054383880536 -7.631863275959134 1.386550052931906 adf.R=1.30 O -4.787677531642356 -7.260662410157893 -1.811869864921444 adf.R=1.72 H -4.987107365597496 -7.965902948894454 -1.127569167561094 adf.R=1.30 O -7.570120713440176 -7.616698761346363 1.447023046024456 adf.R=1.72 H -7.822307180320555 -8.393634951186414 0.8842031856120456 adf.R=1.30 H -6.526262534044806 -7.707893691814505 1.466213232816666 adf.R=1.30 H -3.772680930849206 -7.373579542967475 -1.883029059280324 adf.R=1.30 H -1.723729828519236 -6.908307467661364 2.338394417357826 adf.R=1.30 H 0.9779444375159541 12.73874733034722 2.733124711460216 adf.R=1.30 H -9.547270495499196 -6.638002620404654 2.289928521269156 adf.R=1.30 H 6.548213101127914 -7.439473710129834 -1.540622109119314 adf.R=1.30 H 9.731368015039894 -7.399460097452044 1.818073988535226 adf.R=1.30 H 12.12472091846809 -3.586803687694804 -1.177139499281614 adf.R=1.30 H -7.808527025921405 1.262418488785656 0.9297108933027856 adf.R=1.30 H -4.474858828754236 3.953168727311546 -2.658802841633594 adf.R=1.30 H -2.655295797247876 8.923885203559205 -1.814980287886474 adf.R=1.30 H 0.5842782082411841 12.03417260115464 -2.765973708086524 adf.R=1.30 H -4.572654076668006 6.386991381954566 -1.426471488495284 adf.R=1.30 H -7.901890178585196 0.5671004612453159 -1.497012137598314 adf.R=1.30 S -9.576681315183166 -5.109627008276944 -1.889236941258284 adf.R=2.16 S 0.04069558727005385 12.36074670756313 1.826089125892076 adf.R=2.16 S -1.625522745394356 9.729541836311386 -1.395130019491664 adf.R=2.16 S -3.578747509842566 6.369702320018996 1.686729966555676 adf.R=2.16 S -5.068500544244475 3.963571986073666 -1.435274053553704 adf.R=2.16 S -6.886286872034816 0.509362949844036 1.591761801379166 adf.R=2.16 S -8.327148361000235 -1.903632401622584 -1.554183763373754 adf.R=2.16 S -9.807355166134865 -5.603993499361975 1.445129421078226 adf.R=2.16 H -9.466970204716606 -5.975993314048473 -2.935696794627194 adf.R=1.30 H -10.7908146513958 -5.609963730383994 -1.529970752091304 adf.R=1.30 H -7.823251163377765 -1.701465112755284 2.570735534540426 adf.R=1.30 H -9.182979756060096 -1.509249083117784 1.176196701315296 adf.R=1.30 W 3.624227561920742 -3.057833714263213 -4.435037125070989 adf.R=1.992 W 1.203489749040391 1.33049372464888 -4.044205164271611 adf.R=1.992 W 1.083036678119368 1.659724243409882 -9.088790577218996 adf.R=1.992 W 1.138368883980686 -4.105090677428141 -6.980701421519468 adf.R=1.992 W -1.084013677087193 0.3731670063316869 -6.40542418417446 adf.R=1.992 W 3.365036535269301 2.665691864116404 -6.746602270473014 adf.R=1.992 W 5.611141742521741 -1.832156505701241 -6.93996890508779 adf.R=1.992 W 4.687538191958586 0.1845156277883388 -4.328246935697972 adf.R=1.992 W 4.356762709083577 0.659116991462703 -9.327833831125032 adf.R=1.992 W -0.1486311376776538 -1.835602670724711 -9.186612075145449 adf.R=1.992 W 0.1389777167163437 -1.911024920933296 -4.163211342181086 adf.R=1.992 O 1.787325894312377 -1.864994212164256 -7.69136524419067 adf.R=1.72 O 3.503042866150382 -1.167998284898127 -5.963669151435561 adf.R=1.72 O 1.12326962995814 -0.3790390245294866 -5.773728658960545 adf.R=1.72 O 2.618852028003295 0.512741693064756 -7.612214398498527 adf.R=1.72 O 5.403011550943786 -0.3704539572708861 -8.030424059491661 adf.R=1.72 O 0.217974990960494 -3.13413826102342 -5.583009108644823 adf.R=1.72 O 4.442902470175818 1.554448056397176 -5.585142806792183 adf.R=1.72 O -1.018511804903243 -0.9602386534871737 -7.664788387653109 adf.R=1.72 O 1.939309974327898 -2.401310727695538 -3.82823317738401 adf.R=1.72 O 0.5238440865664855 -0.02655587234088313 -9.572691954749567 adf.R=1.72 O 2.945089090883565 0.62306406895207 -3.722477885303659 adf.R=1.72 O 3.628470268974653 -1.100780269461873 -9.823030754449793 adf.R=1.72 O 2.027999025104598 2.342692694178547 -5.383515435406388 adf.R=1.72 O 4.511926922557116 -2.816878227141424 -8.081803069226369 adf.R=1.72 O -0.1277859495646095 1.484736206752973 -7.56022916173209 adf.R=1.72 O 2.635218315403845 -3.922195127589466 -5.766757939640128 adf.R=1.72 O -0.1417546543209084 -3.538778055482312 -8.176466963969597 adf.R=1.72 O 5.960988135600915 -0.637108147999959 -5.455704693397425 adf.R=1.72 O -1.258064411826466 -0.9798914772507594 -5.029395793572632 adf.R=1.72 O 4.48556852218343 2.241074475507626 -8.144358424669209 adf.R=1.72 O 1.424276423309968 -2.593961805921675 -10.14107664926587 adf.R=1.72 O 0.5180781957479362 -0.2705834442118572 -3.258321711038154 adf.R=1.72 O 2.6831815064558 1.505778234061415 -9.99286489167206 adf.R=1.72 O 4.410503271896748 -1.54765239109103 -3.568484858243646 adf.R=1.72 O 5.145044469842373 -3.103960178445532 -5.535012445194876 adf.R=1.72 O 1.952101868278065 2.989627483489953 -7.932231451631841 adf.R=1.72 O 2.393738195636825 -4.288216777787439 -8.358626565755912 adf.R=1.72 O -0.4409019627528624 1.486659000316634 -4.938113517438373 adf.R=1.72 O 3.944284023528784 -4.294058990737114 -3.329606056396916 adf.R=1.72 O 1.028428726691064 2.436915184376029 -2.780216198770231 adf.R=1.72 O 0.1893047907483063 2.671789306206957 -10.10339952645095 adf.R=1.72 O 0.672273094097686 -5.699945321940609 -6.682577883316775 adf.R=1.72 O -2.671482175081786 0.9366293743112615 -6.534068657999446 adf.R=1.72 O 3.875143102502914 4.221540328849748 -6.336542223709167 adf.R=1.72 O 7.166940041866241 -2.368796132882103 -7.321444686882459 adf.R=1.72 O 5.672500069518141 0.9127634436151391 -3.166760405514397 adf.R=1.72 O 5.459590664027738 1.006940731788356 -10.54899379118706 adf.R=1.72 O -1.397181423054154 -2.055475374028429 -10.29180249594544 adf.R=1.72 O -0.7004546276751812 -2.768421785057734 -2.975811939629763 adf.R=1.72 W 3.12197918538338 -2.833648797681759 -9.460605236104978 adf.R=1.992 O 3.879772569372083 -3.722631952686922 -10.68043372790203 adf.R=1.72 P 2.257970045004493 -0.7249716260842736 -6.761684052627265 adf.R=2.13 End Charge -3 BondOrders 1 29 1.0 1 53 1.0 1 77 1.0 1 117 1.0 1 133 1.0 1 140 1.0 2 29 1.0 2 31 1.0 2 53 1.0 2 54 1.0 2 78 1.0 2 115 1.0 3 29 1.0 3 30 1.0 3 32 1.0 3 53 1.0 3 55 1.0 3 139 1.0 4 31 1.0 4 33 1.0 4 54 1.0 4 56 1.0 4 79 1.0 4 113 1.0 5 31 1.0 5 32 1.0 5 34 1.0 5 54 1.0 5 55 1.0 5 57 1.0 6 33 1.0 6 37 1.0 6 56 1.0 6 60 1.0 6 80 1.0 7 33 1.0 7 34 1.0 7 38 1.0 7 56 1.0 7 57 1.0 7 61 1.0 8 32 1.0 8 35 1.0 8 55 1.0 8 58 1.0 8 59 1.0 8 138 1.0 9 34 1.0 9 35 1.0 9 39 1.0 9 57 1.0 9 59 1.0 9 62 1.0 10 35 1.0 10 36 1.0 10 40 1.0 10 59 1.0 10 63 1.0 10 137 1.0 11 37 1.0 11 41 1.0 11 60 1.0 11 65 1.0 11 81 1.0 12 37 1.0 12 38 1.0 12 42 1.0 12 60 1.0 12 61 1.0 12 66 1.0 13 38 1.0 13 39 1.0 13 43 1.0 13 61 1.0 13 62 1.0 13 67 1.0 14 39 1.0 14 40 1.0 14 44 1.0 14 62 1.0 14 63 1.0 14 68 1.0 15 40 1.0 15 45 1.0 15 63 1.0 15 64 1.0 15 69 1.0 15 136 1.0 16 41 1.0 16 47 1.0 16 65 1.0 16 70 1.0 16 82 1.0 16 107 1.0 17 41 1.0 17 42 1.0 17 48 1.0 17 65 1.0 17 66 1.0 17 71 1.0 18 42 1.0 18 43 1.0 18 49 1.0 18 66 1.0 18 67 1.0 18 72 1.0 19 43 1.0 19 44 1.0 19 50 1.0 19 67 1.0 19 68 1.0 19 73 1.0 20 44 1.0 20 45 1.0 20 51 1.0 20 68 1.0 20 69 1.0 20 74 1.0 21 45 1.0 21 46 1.0 21 52 1.0 21 69 1.0 21 75 1.0 21 135 1.0 22 47 1.0 22 70 1.0 22 83 1.0 22 84 1.0 22 91 1.0 22 105 1.0 23 47 1.0 23 48 1.0 23 70 1.0 23 71 1.0 23 85 1.0 24 48 1.0 24 49 1.0 24 71 1.0 24 72 1.0 24 86 1.0 25 49 1.0 25 50 1.0 25 72 1.0 25 73 1.0 25 87 1.0 26 50 1.0 26 51 1.0 26 73 1.0 26 74 1.0 26 88 1.0 27 51 1.0 27 52 1.0 27 74 1.0 27 75 1.0 27 89 1.0 28 52 1.0 28 75 1.0 28 76 1.0 28 90 1.0 28 134 1.0 30 143 1.0 30 144 1.0 36 101 1.0 36 103 1.0 46 99 1.0 46 100 1.0 58 104 1.0 58 132 1.0 64 102 1.0 64 131 1.0 76 97 1.0 76 130 1.0 91 92 1.0 91 126 1.0 93 137 1.0 94 138 1.0 95 136 1.0 96 136 1.0 98 135 1.0 105 106 1.0 105 125 1.0 107 108 1.0 107 124 1.0 109 134 1.0 110 140 1.0 111 139 1.0 112 139 1.0 113 114 1.0 113 121 1.0 115 116 1.0 115 120 1.0 117 118 1.0 117 119 1.0 122 134 1.0 123 140 1.0 127 138 1.0 128 137 1.0 129 135 1.0 133 141 1.0 133 142 1.0 145 164 1.0 145 171 1.0 145 179 1.0 145 180 1.0 145 184 1.0 146 166 1.0 146 168 1.0 146 177 1.0 146 183 1.0 146 185 1.0 147 159 1.0 147 165 1.0 147 170 1.0 147 178 1.0 147 181 1.0 147 186 1.0 148 161 1.0 148 171 1.0 148 172 1.0 148 182 1.0 148 187 1.0 149 158 1.0 149 163 1.0 149 170 1.0 149 174 1.0 149 183 1.0 149 188 1.0 150 162 1.0 150 168 1.0 150 175 1.0 150 181 1.0 150 189 1.0 151 157 1.0 151 160 1.0 151 169 1.0 151 173 1.0 151 180 1.0 151 190 1.0 152 162 1.0 152 166 1.0 152 173 1.0 152 179 1.0 152 191 1.0 153 160 1.0 153 167 1.0 153 175 1.0 153 178 1.0 153 192 1.0 154 163 1.0 154 165 1.0 154 172 1.0 154 176 1.0 154 193 1.0 155 161 1.0 155 164 1.0 155 174 1.0 155 177 1.0 155 194 1.0 156 197 2.0 157 197 2.0 158 197 2.0 159 197 2.0 195 156 1.0 195 167 1.0 195 169 1.0 195 176 1.0 195 182 1.0 195 196 1.0 End End Engine ADF Basis Type TZP Core Small End XC GGA PBE End Solvation Surf Delley Solv name=Water cav0=0.0 cav1=0.0067639 Charged method=CONJ C-Mat POT SCF VAR ALL CSMRSP End NumericalQuality Good SCF Iterations 1000 End EndEngine NOSYM -3 SCF CONVERGED 7993.860257 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A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A -47.10396560 -1281.764802 -3 GEOMETRY CONVERGED 0.00000001575500 0.00135927462859 0.00312155466193 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 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2 1 2 1 2 P:z S P:x S P:z S S P:x P:x P:x P:x D:z2 P:y S P:y S S S D:z2 P:z S S S P:y -7.014 -6.493 -7.014 -6.493 -7.014 -6.493 -6.493 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -6.493 -7.014 -6.493 -6.493 -6.493 3.575 -7.014 -6.493 2.471 -6.493 -7.014 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.00 0.00 1.33 1.00 0.00 1.00 1.33 58 157 58 180 96 175 147 96 95 93 64 8 58 146 95 179 176 177 8 46 151 157 154 36 S H S H S H H S S S S Mo S H S H H H Mo S H H H S -12.488 2.00 662 A 16.49 11.79 9.18 7.97 5.98 4.75 4.32 2.63 2.13 1.96 1.49 1.37 1.25 1.23 1.22 1.22 1.20 1.13 2 1 1 2 2 1 2 2 2 1 2 1 1 2 2 1 2 1 P:z S S P:x P:z S P:x P:z P:y S P:x D:z2 S P:z D:z2 S P:z S -7.014 -6.493 -6.493 -7.014 -7.014 -6.493 -7.014 -7.014 -7.014 -6.493 -7.014 -3.733 -6.493 -7.014 3.575 -6.493 -7.014 -6.493 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 0.00 1.00 1.33 1.00 46 152 153 46 93 151 93 92 92 160 95 21 177 76 21 146 58 170 S H H S S H S S S H S Mo H S Mo H S H -12.343 2.00 663 A 9.37 8.36 7.80 7.12 6.52 6.22 5.66 4.84 2.25 2.22 1.91 1.90 1.59 1.57 1.31 1.11 2 1 2 1 2 2 1 1 2 2 1 2 2 2 2 2 P:z S P:x S P:x P:y S S P:y P:y S P:z P:z P:z P:y P:y -7.014 -6.493 -7.014 -6.493 -7.014 -7.014 -6.493 -6.493 -7.014 -7.014 -6.493 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 36 156 97 163 36 97 162 154 91 94 148 95 30 97 46 58 S H S H S S H H S S H S S S S S -12.313 2.00 664 A 7.74 7.66 6.98 6.02 5.88 5.39 5.31 5.29 5.08 3.66 3.24 2.95 2.80 2.69 2.55 2.22 1.80 1.66 1.63 1.07 1.04 2 2 2 1 2 1 1 1 1 2 1 2 2 2 2 1 1 2 1 2 2 P:z P:x P:x S P:z S S S S P:z S P:y P:x P:y P:x S S P:y S P:y P:z -7.014 -7.014 -7.014 -6.493 -7.014 -6.493 -6.493 -6.493 -6.493 -7.014 -6.493 -7.014 -7.014 -7.014 -7.014 -6.493 -6.493 -7.014 -6.493 -7.014 -7.014 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 92 76 93 177 76 178 160 150 170 36 156 93 92 92 36 151 154 64 148 94 64 S S S H S H H H H S H S S S S H H S H S S -12.216 2.00 665 A 3.95 3.75 3.53 3.18 3.11 2.88 2.76 2.76 2.75 2.49 2.42 2.36 2.36 2.30 2.16 2.08 2.02 2.02 2.01 1.99 1.97 1.91 1.83 1.61 1.60 1.58 1.53 1.49 1.47 1.41 1.40 1.32 1.21 1.21 1.17 1.14 1.08 1.03 2 1 2 2 1 1 1 1 2 2 1 1 2 2 2 1 1 1 2 2 2 2 2 1 2 2 2 2 2 2 1 1 2 2 2 1 1 2 P:x S P:z P:z S S S S P:x P:z S S P:z P:z P:y S S S P:y P:y P:z P:x P:x S P:x P:x P:x P:z P:z P:y S S P:x P:z P:x S S P:y -7.014 -6.493 -7.014 -7.014 -6.493 -6.493 -6.493 -6.493 -7.014 -7.014 -6.493 -6.493 -7.014 -7.014 -7.014 -6.493 -6.493 -6.493 -7.014 -7.014 -7.014 -7.014 -7.014 -6.493 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -6.493 -6.493 -7.014 -7.014 -7.014 -6.493 -6.493 -7.014 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 97 162 92 30 146 148 163 170 95 91 152 183 76 46 97 156 178 181 95 94 97 76 64 160 92 30 46 98 36 91 179 184 94 94 36 150 171 96 S H S S H H H H S S H H S S S H H H S S S S S H S S S S S S H H S S S H H S -12.203 2.00 666 A 12.39 12.07 9.98 9.15 8.60 8.31 7.69 6.22 2.16 1.70 1.58 1.30 2 2 1 2 1 1 2 1 1 1 2 1 P:z P:x S P:z S S P:x S D:z2 P:x P:y P:y -7.014 -7.014 -6.493 -7.014 -6.493 -6.493 -7.014 -6.493 -3.733 -9.089 -7.014 -9.089 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 98 91 182 91 171 161 98 181 1 104 98 104 S S H S H H S H Mo O S O -12.199 2.00 667 A 4.84 4.66 4.19 3.43 2.67 2.60 2.50 2.49 2.47 2.39 2.16 2.16 1.92 1.85 1.83 1.78 1.66 1.61 1.58 1.55 1.53 1.50 1.46 1.42 1.37 1.33 1.32 1.21 1.16 1.16 1.14 1.11 1.08 1.08 1.06 1.02 1.01 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:x P:x P:y P:x D:xy P:y D:xy P:y P:y P:x D:xy D:xy P:x P:x D:xy D:yz D:xy D:yz D:xz D:xz P:y D:xy P:z P:x D:xy P:z P:z P:z D:xz P:z P:y P:y P:x D:xz D:yz P:z P:y -9.089 -9.089 -9.089 -9.089 -9.089 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-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 188 190 110 111 117 110 120 111 120 117 190 124 188 131 121 130 124 113 130 121 127 131 115 125 195 193 113 192 W W O O O O O O O O W O W O O O O O O O O O O O W W O W -12.114 2.00 670 A 7.02 6.03 5.70 5.66 5.45 5.24 4.31 3.29 2.87 2.67 2.52 2.32 2.16 2.10 2.07 1.93 1.83 1.79 1.59 1.37 1.36 1.29 1.26 1.13 1 2 1 1 2 2 2 2 2 2 2 2 1 1 2 1 1 1 1 2 2 1 1 2 S P:x S S P:z P:y P:z P:x P:y P:y P:x P:y S S P:z S S S S P:x P:x S S P:y -6.493 -7.014 -6.493 -6.493 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -6.493 -6.493 -7.014 -6.493 -6.493 -6.493 -6.493 -7.014 -7.014 -6.493 -6.493 -7.014 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 153 93 155 177 64 46 46 46 64 36 64 93 154 179 92 160 148 152 170 94 58 147 151 92 H S H H S S S S S S S S H H S H H H H S S H H S -12.095 2.00 671 A 3.21 3.08 2.77 2.77 2.74 2.54 2.37 2.36 2.35 2.25 2.13 2.10 1.94 1.93 1.93 1.82 1.82 1.81 1.78 1.74 1.72 1.66 1.53 1.49 1.41 1.40 1.34 1.27 1.26 1.16 1.08 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:y P:y P:x P:x P:y P:x P:y P:x P:z P:x P:x P:y P:y P:z P:y P:y D:xy P:z D:xy P:z P:z P:z P:z D:xy D:xy P:z P:z P:z P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 119 118 109 112 117 120 110 129 111 132 118 131 130 123 122 119 124 121 191 132 189 120 129 117 130 188 190 131 109 112 123 122 O O O O O O O O O O O O O O O O O O W O W O O O O W W O O O O O -12.091 2.00 672 A 3.74 3.53 3.35 3.23 2.86 2.78 2.72 2.68 2.15 2.12 2.10 1.96 1.89 1.78 1.76 1.67 1.66 1.65 1.65 1.62 1.39 1.39 1.34 1.29 1.28 1.28 1.25 1.25 1.25 1.24 1.23 1.18 1.15 1.14 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:y P:y P:x P:y P:x P:y P:x P:z P:x P:z P:z P:y P:z P:x P:y P:x D:xz D:xz P:z P:y P:z P:y P:z P:z P:z D:yz D:xz P:z D:xz D:yz P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 115 113 114 116 125 128 127 126 114 111 116 110 112 115 109 128 113 126 194 193 121 125 122 127 123 124 117 186 195 120 192 185 118 119 O O O O O O O O O O O O O O O O O O W W O O O O O O O W W O W W O O -12.061 2.00 673 A 6.84 5.04 4.94 4.85 4.61 4.02 3.97 3.34 2.55 2.46 2.38 2.19 2.01 1.97 1.88 1.83 1.76 1.75 1.68 1.52 1.40 1.39 1.38 1.36 1.30 1.20 1.18 1.11 1.10 1.03 2 1 2 1 2 1 1 2 2 1 2 1 2 2 1 1 1 2 2 2 1 2 2 2 1 2 2 2 2 1 P:x S P:x S P:x S S P:x P:y S P:z S P:z P:z S S S P:x P:y P:y S P:y P:z P:z S P:z P:x P:z P:x S -7.014 -6.493 -7.014 -6.493 -7.014 -6.493 -6.493 -7.014 -7.014 -6.493 -7.014 -6.493 -7.014 -7.014 -6.493 -6.493 -6.493 -7.014 -7.014 -7.014 -6.493 -7.014 -7.014 -7.014 -6.493 -7.014 -7.014 -7.014 -7.014 -6.493 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 64 146 95 154 93 179 177 36 36 176 36 152 58 46 157 148 155 94 58 93 156 95 94 64 151 92 46 30 97 170 S H S H S H H S S H S H S S H H H S S S H S S S H S S S S H -12.046 2.00 674 A 6.33 6.23 4.51 4.08 3.55 3.35 2.78 2.59 2.53 2.33 2.29 1.97 1.84 1.78 1.59 1.43 1.42 1.40 1.38 1.34 1.29 1.19 1.18 1.16 1.12 1.09 1.06 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:x P:x P:y P:y P:x P:x P:z P:x P:z P:y P:x P:y P:x D:xz P:y P:z P:y P:z D:xz P:x P:y P:z P:z P:z D:yz P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 0.80 1.33 113 115 127 125 113 115 117 129 119 119 117 125 131 127 132 190 122 112 110 131 188 120 112 118 120 110 186 124 O O O O O O O O O O O O O O O W O O O O W O O O O O W O -12.046 2.00 675 A 6.54 6.46 4.64 4.48 3.62 3.44 2.25 2.22 2.05 2.04 2.02 1.90 1.80 1.78 1.71 1.61 1.45 1.44 1.35 1.30 1.28 1.26 1.24 1.24 1.09 1.08 1.06 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:y P:y P:y P:x P:x P:z P:y P:x P:x P:y P:y P:y P:z P:z P:y P:z P:y P:y D:yz D:yz P:z P:x P:y P:x D:xz D:xz -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 116 114 126 128 116 114 110 124 126 128 112 121 110 111 112 109 109 122 111 189 191 120 130 123 131 193 194 O O O O O O O O O O O O O O O O O O O W W O O O O W W -12.044 2.00 676 A 3.45 3.41 3.36 3.28 3.27 3.21 3.03 3.03 2.88 2.78 2.68 2.57 2.15 2.12 2.07 2.04 2.04 2.03 2.00 1.99 1.95 1.77 1.72 1.66 1.63 1.55 1.39 1.31 1.27 1.24 1.24 1.08 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:y P:z P:z P:z P:z P:x P:z P:y P:z P:x P:z P:z P:z P:z P:z P:y P:x P:z P:z P:x P:z P:z P:y D:xy D:xy P:y D:xy D:xy P:x P:y P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 120 111 111 109 130 121 120 118 109 123 118 132 131 124 117 122 110 117 110 129 119 112 119 112 190 188 121 189 191 130 123 132 O O O O O O O O O O O O O O O O O O O O O O O O W W O W W O O O -11.981 2.00 677 A 10.65 6.80 6.07 5.99 5.24 3.93 3.66 3.58 3.26 2.67 2.61 2.40 2.36 2.34 2.27 2.10 2.02 1.97 1.57 1.44 1.24 1.18 1 2 2 2 2 1 1 2 2 2 1 2 1 2 1 2 1 1 1 2 2 1 S P:z P:y P:x P:x S S P:y P:y P:x S P:z S P:x S P:z S S S P:x P:z S -6.493 -7.014 -7.014 -7.014 -7.014 -6.493 -6.493 -7.014 -7.014 -7.014 -6.493 -7.014 -6.493 -7.014 -6.493 -7.014 -6.493 -6.493 -6.493 -7.014 -7.014 -6.493 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 147 96 36 96 58 180 175 96 46 64 148 30 183 94 157 94 149 179 154 30 58 155 H S S S S H H S S S H S H S H S H H H S S H -11.900 2.00 678 A 13.73 12.67 11.61 10.39 6.40 3.63 3.24 2.43 2.37 1.92 1.87 1.65 1.63 1.55 1.23 1.20 1.14 1.10 2 1 2 1 1 2 2 2 2 1 1 2 2 2 1 2 1 2 P:z S P:x S S P:x P:x P:y P:y S S P:z P:z P:x S P:y S P:z -7.014 -6.493 -7.014 -6.493 -6.493 -7.014 -7.014 -7.014 -7.014 -6.493 -6.493 -7.014 -7.014 -7.014 -6.493 -7.014 -6.493 -7.014 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 30 184 30 183 163 58 97 91 97 157 180 97 58 96 175 30 181 96 S H S H H S S S S H H S S S H S H S -11.870 2.00 679 A 21.44 13.63 9.90 8.35 6.73 6.45 5.63 5.23 4.20 1.67 1.55 1.31 1.05 1.01 2 1 1 1 2 2 1 2 2 1 2 2 2 2 P:x S S S P:z P:y S P:z P:x S S P:x P:z S -7.014 -6.493 -6.493 -6.493 -7.014 -7.014 -6.493 -7.014 -7.014 -6.493 2.471 -7.014 -7.014 2.471 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 0.00 1.33 1.33 0.00 76 150 178 160 92 92 170 76 92 151 150 93 93 160 S H H H S S H S S H H S S H -11.813 2.00 680 A 2.32 2.30 2.28 2.23 1.89 1.78 1.78 1.74 1.53 1.49 1.48 1.48 1.46 1.44 1.39 1.38 1.36 1.36 1.34 1.34 1.33 1.33 1.32 1.31 1.30 1.28 1.28 1.23 1.21 1.20 1.19 1.15 1.13 1.09 1.08 1.07 1.06 1.06 1.05 1.04 1.04 1.03 1.03 1.01 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:y D:x2-y2 P:x P:y D:x2-y2 P:y P:x P:y P:x P:x P:x P:y P:y P:y P:x P:y P:x P:x P:z P:x P:x P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 188 190 191 189 194 193 186 185 187 196 119 192 114 118 195 127 111 125 130 128 120 109 112 113 116 115 110 126 116 131 117 123 122 114 119 131 129 124 109 117 110 118 123 132 112 W W W W W W W W W W O W O O W O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -11.605 2.00 681 A 15.50 12.32 10.62 9.69 9.42 9.08 7.62 7.01 3.08 1.44 1.31 1.26 1.23 2 2 1 2 1 1 2 1 1 2 2 2 1 P:x P:x S P:z S S P:z S P:y P:z S S P:x -7.014 -7.014 -6.493 -7.014 -6.493 -6.493 -7.014 -6.493 -9.089 -0.555 2.471 2.471 -9.089 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.33 0.00 0.00 0.00 1.33 91 98 182 91 161 181 98 171 104 1 182 161 104 S S H S H H S H O Mo H H O -11.555 2.00 682 A 6.54 6.39 4.01 3.99 3.72 3.60 2.45 2.36 2.33 2.27 2.24 2.07 1.69 1.65 1.51 1.48 1.36 1.33 -1.33 1.33 1.32 1.32 1.30 1.26 1.24 1.20 1.19 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 P:x P:x P:x P:x P:y P:y D:xy D:xy P:y P:y P:x P:x D:xz P:y D:yz P:y P:x D:x2-y2 P:x D:xz D:x2-y2 D:yz P:y P:x D:xz P:z P:y P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -4.498 -9.089 -9.089 -4.498 2.188 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.00 1.33 0.80 1.33 1.33 0.80 0.00 0.80 0.80 0.80 1.33 1.33 0.80 1.33 1.33 1.33 108 105 107 106 105 108 189 191 107 106 112 109 197 119 187 118 122 190 197 194 188 196 129 123 193 114 132 137 O O O O O O W W O O O O P O W O O W P W W W O O W O O O -11.543 2.00 683 A 9.68 8.43 6.62 6.51 2.24 2.05 -1.98 1.90 1.79 1.66 1.64 1.55 1.49 1.43 1.43 1.29 1.22 1.14 1.04 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z D:xy P:z P:z D:yz D:xz P:z P:z P:z P:z D:xz D:yz P:z P:z P:x P:y -9.089 -9.089 -9.089 -9.089 10.422 -9.089 2.188 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 0.00 1.33 0.00 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 108 105 106 107 197 125 197 186 192 116 115 114 127 194 196 126 128 111 117 O O O O P O P W W O O O O W W O O O O -11.539 2.00 684 A 6.25 5.86 4.22 3.70 3.48 3.47 2.67 2.65 2.48 2.06 2.05 2.00 1.92 1.78 1.70 1.62 1.46 1.43 1.37 1.37 -1.27 1.22 1.22 1.14 1.13 1.12 1.11 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 P:y P:y P:y P:x P:y P:x D:xy P:x P:y D:xy P:x P:x D:xz D:yz P:y D:yz P:z P:y D:x2-y2 P:x P:y P:y D:x2-y2 P:y P:z P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 10.422 -9.089 -9.089 -4.498 -9.089 2.188 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 0.80 0.80 1.33 0.00 1.33 1.33 0.80 1.33 0.00 1.33 0.80 1.33 1.33 1.33 1.33 107 106 105 106 108 107 188 105 120 190 108 110 195 185 117 197 113 130 189 124 197 131 191 136 105 111 121 O O O O O O W O O W O O W W O P O O W O P O W O O O O -11.427 2.00 685 A 10.20 10.07 9.87 4.86 4.81 3.64 3.38 2.66 2.50 2.40 1.72 1.59 1.53 1.48 1.32 1.23 1.22 1.06 1.04 2 2 1 2 1 2 2 2 2 2 2 2 2 2 1 2 1 2 1 P:y P:x S P:x S P:y P:y S P:y P:y S P:z P:z P:z D:xz P:y S S S -7.014 -7.014 -6.493 -7.014 -6.493 -7.014 -7.014 -17.266 -7.014 -7.014 -4.108 -7.014 -7.014 -7.014 -3.733 -7.014 -6.493 2.471 -6.493 1.33 1.33 1.00 1.33 1.00 1.33 1.33 2.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 0.00 1.00 94 94 149 96 175 46 36 94 96 40 15 96 94 95 15 92 154 149 153 S S H S H S S S S S Mo S S S Mo S H H H -11.417 2.00 686 A 5.07 5.03 4.97 4.95 3.03 2.95 2.53 2.50 2.10 1.70 1.69 1.66 1.66 1.66 1.65 1.62 1.61 1.59 1.59 1.47 1.46 1.26 1.22 1.13 1.12 1.10 1.09 1.04 1.02 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:x P:x P:y P:y P:y P:x P:x D:x2-y2 P:y P:y P:y D:x2-y2 D:x2-y2 P:y D:x2-y2 D:x2-y2 P:x P:x P:x P:x P:y P:y P:y P:x P:y P:x P:x P:x P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 106 108 105 107 105 108 106 107 197 114 116 110 188 191 111 189 190 119 118 115 113 131 130 112 123 109 122 117 120 120 O O O O O O O O P O O O W W O W W O O O O O O O O O O O O O -11.410 2.00 687 A 6.92 6.53 3.95 3.80 2.31 2.14 1.92 1.88 1.88 1.87 1.74 1.61 1.58 1.53 1.52 1.43 1.42 1.39 1.38 1.23 1.14 1.08 1.07 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z D:z2 P:x P:z P:z P:z P:z P:x P:z P:z P:z P:z P:y P:z P:y P:z P:z P:z P:x P:z P:z -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 107 106 108 105 197 106 112 118 119 109 107 111 120 110 117 108 128 105 126 115 113 105 125 127 O O O O P O O O O O O O O O O O O O O O O O O O -11.333 2.00 688 A 11.15 7.44 6.71 6.15 4.90 3.12 2.52 2.46 2.41 2.15 1.86 1.62 1.50 1.50 1.41 1.41 1.27 1.26 1.13 1.04 2 1 2 2 2 2 1 2 2 2 1 2 2 2 2 2 2 1 1 2 P:y S P:x P:y P:y P:x S S P:y P:y S P:y P:y P:z S P:y S S D:xz P:z -7.014 -6.493 -7.014 -7.014 -7.014 -7.014 -6.493 -17.266 -7.014 -7.014 -6.493 -7.014 -7.014 -7.014 -17.266 -7.014 -4.108 -6.493 -3.733 -7.014 1.33 1.00 1.33 1.33 1.33 1.33 1.00 2.00 1.33 1.33 1.00 1.33 1.33 1.33 2.00 1.33 1.00 1.00 1.00 1.33 96 175 96 30 46 94 149 96 92 36 184 32 94 97 30 98 8 153 8 95 S H S S S S H S S S H S S S S S Mo H Mo S -11.302 2.00 689 A 26.84 17.08 16.42 4.13 4.07 3.80 3.53 2.06 1.89 1.85 1.77 1.56 1.52 1.29 1.24 1.21 1 1 1 1 1 1 1 1 2 1 2 1 1 2 1 1 P:y P:x P:y D:z2 S P:x D:yz S P:x S S P:z D:xz S S S -9.089 -9.089 -9.089 -3.733 -24.020 -9.089 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1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 186 193 185 126 113 115 116 127 194 128 125 195 114 118 192 187 110 196 120 126 109 113 116 115 116 127 111 125 128 114 195 117 113 196 119 112 W W W O O O O O W O O W O O W W O W O O O O O O O O O O O O W O O W O O -11.269 2.00 692 A 4.58 4.40 3.72 3.26 3.01 2.93 2.72 2.70 2.19 2.08 2.05 1.99 1.80 1.80 1.76 1.72 1.63 1.62 1.59 1.58 1.52 1.47 1.47 1.33 1.31 1.28 1.20 1.18 1.17 1.16 1.16 1.15 1.11 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 P:x P:z P:x P:z P:x P:x P:y P:z P:z P:z P:z P:y P:x P:x P:z P:z P:y P:y P:z P:y P:y D:z2 P:z D:z2 P:z P:z D:z2 D:x2-y2 D:xy D:x2-y2 D:z2 D:xz -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 188 190 111 115 110 113 117 120 117 131 124 121 130 120 131 130 117 110 121 111 111 110 124 193 120 194 127 125 196 191 190 189 187 192 W W O O O O O O O O O O O O O O O O O O O O O W O W O O W W W W W W -11.206 2.00 693 A 7.72 7.05 6.46 4.58 3.86 3.22 2.66 2.59 2.42 2.40 2.22 2.05 1.86 1.83 1.68 1.55 1.54 1.54 1.44 1.10 1.05 1.01 2 2 2 2 2 1 1 2 2 1 1 2 2 2 1 2 2 1 2 2 2 1 P:z P:z P:x P:x P:y S S P:z P:x S S S S P:z S P:y P:x S S P:y P:x S -7.014 -7.014 -7.014 -7.014 -7.014 -6.493 -6.493 -7.014 -7.014 -6.493 -6.493 -17.266 -17.266 -7.014 -6.493 -7.014 -7.014 -6.493 -4.108 -7.014 -7.014 -6.493 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.00 2.00 2.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.00 58 64 64 58 92 157 155 95 93 179 151 64 58 93 180 46 69 176 15 58 59 152 S S S S S H H S S H H S S S H S S H Mo S S H -11.177 2.00 694 A 9.53 8.81 7.11 6.08 3.79 3.45 2.83 2.71 2.43 2.27 2.12 2.09 2.00 1.84 1.67 1.43 1.40 1.33 1.28 1.19 1.06 1.04 2 2 2 2 1 2 1 2 2 2 2 1 2 1 2 2 2 1 2 1 2 1 P:y P:z P:y P:x S P:y S P:y P:z P:y S S S S P:z P:x S S S S P:z S -7.014 -7.014 -7.014 -7.014 -6.493 -7.014 -6.493 -7.014 -7.014 -7.014 -4.108 -6.493 -17.266 -6.493 -7.014 -7.014 -17.266 -6.493 -17.266 -6.493 -7.014 -6.493 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.00 2.00 1.00 1.33 1.33 2.00 1.00 2.00 1.00 1.33 1.00 30 95 36 36 154 98 176 35 36 96 10 183 30 184 58 29 95 147 36 157 30 156 S S S S H S H S S S Mo H S H S S S H S H S H -11.135 2.00 695 A 10.06 8.89 6.65 4.87 4.81 4.54 3.94 3.50 3.02 2.53 2.31 1.76 1.73 1.59 1.38 1.36 1.35 1.24 1.15 1.13 1.04 2 2 2 2 1 1 1 2 2 1 2 2 2 2 2 1 2 1 1 2 3 P:z P:z P:z P:x S S S P:y P:y S P:y P:x S S P:y S P:x D:xy D:xy S S -7.014 -7.014 -7.014 -7.014 -6.493 -6.493 -6.493 -7.014 -7.014 -6.493 -7.014 -7.014 -17.266 -17.266 -7.014 -6.493 -7.014 -3.733 -3.733 -4.108 0.830 1.33 1.33 1.33 1.33 1.00 1.00 1.00 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1.28 1.28 1.24 1.21 1.21 1.20 1.13 1.11 1.11 1.11 1.09 1.05 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 P:x P:x P:y P:y P:z P:z P:z P:z P:y P:x P:y P:x P:x P:x P:z P:y D:xz P:y P:z P:z P:z D:xy D:yz D:yz D:yz D:xz D:xy P:y P:y P:x D:xy P:x D:xz P:z D:yz P:z D:xy P:y D:xz P:y P:x P:x P:x P:x S D:xz P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 3.091 -4.498 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 0.00 0.80 1.33 109 112 120 117 115 114 116 113 118 110 119 111 144 135 137 142 191 141 139 138 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4.12 4.11 3.60 3.22 3.08 3.06 2.83 2.30 2.27 2.00 1.82 1.78 1.63 1.34 1.22 1.07 1.06 1.03 1.03 2 2 2 1 2 2 1 1 2 2 2 2 2 2 2 2 2 2 1 2 2 1 P:y P:z P:z S P:z P:x S S S P:x P:x P:x S S P:x P:x S P:z S P:y P:y S -7.014 -7.014 -7.014 -6.493 -7.014 -7.014 -6.493 -6.493 -17.266 -7.014 -7.014 -0.555 -4.108 -4.108 -7.014 -7.014 -17.266 -7.014 -6.493 -7.014 -7.014 -6.493 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.00 2.00 1.33 1.33 0.00 1.00 1.00 1.33 1.33 2.00 1.33 1.00 1.33 1.33 1.00 92 93 92 170 64 93 160 177 92 46 64 28 21 28 52 76 93 46 151 46 52 155 S S S H S S H H S S S Mo Mo Mo S S S S H S S H -10.949 2.00 700 A 11.25 7.69 7.24 6.75 4.13 3.94 3.58 3.09 2.30 2.24 2.21 2.17 2.02 1.86 1.84 1.72 1.62 1.52 1.42 1.40 1.37 1.25 1.17 1.01 2 2 1 2 1 2 2 2 1 1 2 2 2 2 1 2 2 2 2 1 1 2 1 1 P:z P:z S P:x S P:x P:x P:y S P:y S S P:x P:z S S P:y P:z P:y D:yz D:xy P:y P:x S -7.014 -7.014 -6.493 -7.014 -6.493 -7.014 -7.014 -7.014 -6.493 -9.089 -17.266 -17.266 -7.014 -7.014 -6.493 -4.108 -7.014 -7.014 -7.014 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-9.089 -4.498 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 107 106 128 133 140 143 126 124 192 134 121 185 186 126 130 185 186 131 195 139 122 128 137 195 123 192 132 191 129 189 128 O O O O O O O O W O O W W O O W W O W O O O O W O W O W O W O -10.673 2.00 709 A 8.42 8.33 7.10 4.09 3.03 1.96 1.71 1.66 1.63 1.59 1.49 1.48 1.42 1.42 1.38 1.30 1.26 1.23 1.20 1.19 1.19 1.14 1.13 1.07 1.06 1.03 2 2 1 1 1 1 1 1 1 2 2 2 1 2 2 1 2 1 2 2 1 2 1 1 2 2 P:z P:z P:y P:x P:y S S S S P:x P:z S S P:x P:z S P:y D:xz P:y S D:z2 P:z D:yz P:z P:x P:x -7.014 -7.014 -9.089 -9.089 -9.089 -6.493 -6.493 -6.493 -6.493 -7.014 -7.014 -17.266 -6.493 -7.014 -7.014 -24.020 -7.014 -3.733 -7.014 -17.266 -3.733 -7.014 -3.733 -9.089 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 2.00 1.00 1.33 1.33 2.00 1.33 1.00 1.33 2.00 1.00 1.33 1.00 1.33 1.33 1.33 97 95 103 103 104 176 156 146 162 30 91 95 163 53 36 103 92 10 36 97 2 58 1 103 97 91 S S O O O H H H H S S S H S S O S Mo S S Mo S Mo O S S -10.606 2.00 710 A 10.24 5.69 5.45 4.14 2.22 2.20 2.12 2.12 2.09 1.99 1.83 1.79 1.63 1.60 1.46 1.37 1.37 1.34 1.29 1.29 1.26 1.06 1.06 1 1 2 1 2 2 1 2 1 2 2 1 2 2 1 2 1 1 1 2 1 1 1 P:y P:x P:z P:y P:y P:z S P:y D:xz P:z P:y S P:z P:y S P:x P:z D:z2 S P:y P:y P:x S -9.089 -9.089 -7.014 -9.089 -7.014 -7.014 -6.493 -7.014 -3.733 -7.014 -7.014 -24.020 -7.014 -7.014 -6.493 -7.014 -9.089 -3.733 -6.493 -7.014 -9.089 -9.089 -6.493 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 2.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 103 103 95 101 36 36 156 98 10 93 96 103 96 92 147 98 103 2 176 53 104 101 161 O O S O S S H S Mo S S O S S H S O Mo H S O O H -10.598 2.00 711 A 35.34 8.94 5.61 4.62 3.94 2.56 2.35 2.22 1.59 1.59 1.29 1.14 1 1 1 1 1 1 1 1 1 2 2 2 P:y P:x S P:z D:z2 S S P:y P:y P:x S P:z -9.089 -9.089 -24.020 -9.089 -3.733 -6.493 -6.493 -9.089 -9.089 -7.014 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135 120 138 188 142 190 141 131 130 121 196 187 193 194 194 193 124 196 109 112 186 105 187 108 185 190 188 O O O O O O O O O O W O W O O O O W W W W W W O W O O W O W O W W W -10.546 2.00 713 A 3.51 3.50 3.40 3.32 2.58 2.51 2.44 2.33 2.16 2.06 2.05 1.96 1.91 1.87 1.60 1.46 1.46 1.40 1.35 1.33 1.30 1.29 1.17 1.07 1.06 1.04 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z D:z2 D:z2 P:y D:z2 D:z2 P:x P:x P:x P:y P:y P:x P:y P:x P:y P:y D:xz P:x P:y D:xz P:x P:z P:x D:yz -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 0.80 116 113 115 114 190 189 132 188 191 121 123 124 130 129 134 131 122 141 142 186 133 143 185 144 137 135 195 O O O O W W O W W O O O O O O O O O O W O O W O O O W -10.537 2.00 714 A 3.33 3.32 3.08 3.03 2.93 2.91 2.86 2.64 2.43 2.39 2.22 2.17 1.94 1.86 1.74 1.73 1.70 1.60 1.46 1.38 1.36 1.30 1.28 1.15 1.14 1.08 1.06 1.05 1.04 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:z P:y P:z P:x P:z P:z P:x D:xz P:x P:y D:xz P:y D:x2-y2 P:y D:x2-y2 P:x P:x P:y D:yz P:x P:x P:x D:yz D:x2-y2 D:xy P:y D:x2-y2 P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33 1.33 119 139 118 128 112 137 126 109 191 122 129 189 140 193 132 194 123 133 143 191 116 114 134 189 192 185 120 190 107 106 O O O O O O O O W O O W O W O W O O O W O O O W W W O W O O -10.522 2.00 715 A 7.68 4.65 3.80 3.49 2.39 2.03 1.80 1.80 1.53 1.45 1.31 1.18 1.14 1.13 1.12 1.11 1.08 1.05 1.03 1 1 2 1 2 1 2 2 1 2 2 1 2 2 1 1 2 2 2 P:y P:x P:z P:y P:z P:x P:x P:z P:z P:x P:x S P:y P:x D:z2 D:yz P:y P:x P:x -9.089 -9.089 -7.014 -9.089 -7.014 -9.089 -7.014 -7.014 -9.089 -7.014 -7.014 -24.020 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 2.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 103 103 97 104 93 104 91 91 102 57 44 103 62 68 2 1 39 38 34 O O S O S O S S O S S O S S Mo Mo S S S -10.499 2.00 716 A 6.57 3.38 3.07 2.89 2.77 2.61 2.33 2.30 2.17 2.07 1.67 1.41 1.40 1.40 1.34 1.23 1.02 1.01 1.00 2 2 2 2 2 2 1 1 2 1 1 2 2 2 1 1 1 2 1 P:z P:z P:z P:y P:y P:z S S P:z P:y D:xz P:y P:y S S P:x S P:z P:y -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -6.493 -6.493 -7.014 -9.089 -3.733 -7.014 -7.014 -17.266 -6.493 -9.089 -6.493 -7.014 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 2.00 1.00 1.33 1.00 1.33 1.33 93 46 95 92 94 97 151 152 36 104 21 96 46 93 148 104 176 94 103 S S S S S S H H S O Mo S S S H O H S O -10.493 2.00 717 A 3.09 2.82 2.76 2.06 2.00 1.90 1.84 1.72 1.63 1.57 1.56 1.49 1.43 1.40 1.25 1.17 1.11 1.08 1.07 1.01 2 2 2 2 1 2 2 2 1 1 1 1 2 2 2 2 2 1 2 1 P:y P:z P:x P:x D:xy P:z P:x P:z P:y D:z2 S D:xz P:z P:y P:x P:x P:x D:xy P:z D:x2-y2 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -9.089 -3.733 -6.493 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 46 97 68 63 20 46 44 94 103 14 152 21 93 92 61 57 38 13 68 14 S S S S Mo S S S O Mo H Mo S S S S S Mo S Mo -10.459 2.00 718 A 4.10 3.61 3.16 2.54 2.02 1.98 1.96 1.87 1.83 1.69 1.64 1.58 1.55 1.54 1.53 1.31 1.27 1.23 1.09 1.08 1.08 1.04 1.02 1.01 1 1 1 1 2 2 1 2 2 1 1 2 2 2 2 2 2 2 1 1 2 2 2 2 P:z P:x D:z2 P:y P:y P:z D:x2-y2 P:y P:y D:xy P:x S P:z P:y P:z P:z P:y P:z D:xy D:z2 P:z P:y P:x P:x -9.089 -9.089 -3.733 -9.089 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -9.089 -4.108 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 102 102 14 104 39 63 9 62 38 10 104 13 35 63 40 39 61 59 14 10 62 40 62 39 O O Mo O S S Mo S S Mo O Mo S S S S S S Mo Mo S S S S -10.448 2.00 719 A 4.06 4.04 3.59 2.89 2.62 2.33 2.19 2.17 2.13 2.04 1.69 1.68 1.54 1.53 1.14 1.10 2 2 2 2 1 1 1 1 2 2 2 1 2 2 2 1 P:y P:y P:y P:y D:x2-y2 D:z2 P:y D:z2 S P:y P:y D:x2-y2 P:y P:y P:z D:x2-y2 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -9.089 -3.733 -4.108 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 44 68 39 62 13 9 103 20 14 57 43 7 34 67 38 19 S S S S Mo Mo O Mo Mo S S Mo S S S Mo -10.437 2.00 720 A 2.15 2.06 2.00 1.98 1.91 1.86 1.81 1.79 1.76 1.76 1.64 1.57 1.57 1.54 1.51 1.48 1.47 1.45 1.41 1.39 1.34 1.33 1.32 1.29 1.29 1.23 1.20 1.19 1.17 1.15 1.13 1.09 1.09 1.08 1.07 1.06 1.05 1.01 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y D:x2-y2 D:x2-y2 D:x2-y2 P:y P:x P:x P:x P:y D:x2-y2 P:y P:x P:x P:x P:y P:y P:x P:x P:x P:y P:x P:y D:xz P:x P:y P:y D:yz P:x P:y P:y P:x P:y D:yz P:x P:x P:y D:xz P:x P:y -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 1.33 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 1.33 1.33 128 191 188 190 111 125 127 119 126 189 110 138 118 121 139 137 113 136 120 114 123 132 190 124 129 116 189 115 130 112 128 131 191 109 117 127 188 126 109 O W W W O O O O O W O O O O O O O O O O O O W O O O W O O O O O W O O O W O O -10.429 2.00 721 A 2.40 2.35 2.35 2.27 2.24 2.19 2.01 2.00 1.71 1.70 1.65 1.59 1.55 1.54 1.47 1.46 1.35 1.32 1.29 1.27 1.24 1.21 1.21 1.20 1.19 1.19 1.17 1.13 1.11 1.09 1.02 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:x P:x P:z P:z P:z P:z P:y P:y P:y P:z D:x2-y2 P:z D:xz P:y D:x2-y2 P:x P:z P:z P:z P:z P:z P:z D:xz P:z P:z P:y D:yz D:z2 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 0.80 112 118 119 109 129 132 125 127 138 136 123 113 122 123 185 132 185 115 186 122 134 133 122 113 143 115 186 140 129 110 195 186 O O O O O O O O O O O O O O W O W O W O O O O O O O W O O O W W -10.424 2.00 722 A 2.41 2.39 1.96 1.94 1.80 1.72 1.32 1.27 1.12 1.10 1.06 1.05 1.02 1.02 1 1 1 1 1 1 1 1 1 2 1 1 1 1 P:z P:z P:z P:z P:z P:z P:y P:y D:z2 P:x P:z P:x P:z D:yz -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -3.733 -7.014 -9.089 -9.089 -9.089 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 0.80 126 128 111 120 110 117 124 121 13 62 116 131 114 193 O O O O O O O O Mo S O O O W -10.419 2.00 723 A 3.03 2.60 2.17 2.15 2.05 2.02 1.88 1.84 1.55 1.53 1.51 1.42 1.10 1.06 1.04 1 2 1 2 2 2 2 2 1 2 2 1 1 1 1 D:z2 P:x D:xy P:x P:z P:z P:x P:z D:z2 P:x P:z D:xy D:xy D:z2 P:z -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -9.089 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.33 13 62 14 43 39 44 67 68 19 39 62 19 9 14 128 Mo S Mo S S S S S Mo S S Mo Mo Mo O -10.413 2.00 724 A 6.74 6.67 6.38 4.87 2.46 2.23 1.92 1.69 1.68 1.68 1.63 1.60 1.54 1.44 1.25 1.14 1.09 1.08 1.07 1.06 1 1 1 1 2 2 2 2 2 1 1 1 2 1 2 2 2 1 2 1 P:z P:y P:x P:x P:z P:x P:z P:y P:x S S S P:z P:z P:x P:z P:z D:z2 S S -9.089 -9.089 -9.089 -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 -24.020 -24.020 -6.493 -7.014 -9.089 -7.014 -7.014 -7.014 -3.733 -17.266 -6.493 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 2.00 2.00 1.00 1.33 1.33 1.33 1.33 1.33 1.00 2.00 1.00 102 104 102 104 98 97 91 91 78 104 102 181 97 104 91 63 58 14 91 171 O O O O S S S S S O O H S O S S S Mo S H -10.318 2.00 725 A 4.43 4.23 2.32 2.18 2.00 1.97 1.91 1.72 1.65 1.57 1.50 1.47 1.40 1.39 1.36 1.29 1.24 1.18 1.11 1.10 1.04 1.02 1.01 1 1 2 2 2 2 2 1 2 1 2 2 2 2 1 2 2 1 2 1 2 2 2 P:z P:x P:y P:y P:z P:y P:y S P:y P:x P:x P:x P:y P:z P:y P:x P:x D:x2-y2 P:x D:xy P:x P:y P:y -9.089 -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 -6.493 -7.014 -9.089 -7.014 -7.014 -7.014 -7.014 -9.089 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 102 102 69 91 98 98 53 171 63 104 68 32 55 30 104 98 97 14 34 8 55 35 33 O O S S S S S H S O S S S S O S S Mo S Mo S S S -10.246 2.00 726 A 2.83 2.49 2.48 2.43 2.34 2.12 2.06 2.02 1.89 1.87 1.76 1.59 1.58 1.53 1.40 1.39 1.21 1.14 1.12 1.11 1.10 1.03 1.01 1 1 2 2 2 2 2 1 1 2 2 2 1 1 2 2 1 2 2 2 2 2 2 D:z2 D:z2 P:z P:z P:z P:z P:z D:xy D:z2 P:z S P:x D:xy D:xy P:z P:z D:z2 P:z P:z P:z D:z2 P:x P:z -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -4.108 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 3.575 -7.014 -7.014 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 0.00 1.33 1.33 20 5 69 45 75 55 32 21 9 52 7 34 27 15 59 35 27 74 34 57 20 74 51 Mo Mo S S S S S Mo Mo S Mo S Mo Mo S S Mo S S S Mo S S -10.235 2.00 727 A 4.68 3.42 2.68 2.41 1.95 1.92 1.77 1.73 1.58 1.45 1.44 1.36 1.35 1.33 1.28 1.20 1.20 1.19 1.15 1.09 1.09 1.09 1.08 1.06 2 2 2 1 1 2 2 2 1 2 2 2 2 1 2 1 2 2 1 1 2 2 2 1 P:y P:x P:z S S S P:y P:y P:y P:y P:y P:y S D:x2-y2 P:y P:y P:x P:y D:xy S P:z P:y P:x P:x -7.014 -7.014 -7.014 -6.493 -6.493 -17.266 -7.014 -7.014 -9.089 -7.014 -7.014 -7.014 -4.108 -3.733 -7.014 -9.089 -7.014 -7.014 -3.733 -6.493 -7.014 -7.014 -7.014 -9.089 1.33 1.33 1.33 1.00 1.00 2.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 98 98 30 161 183 98 69 67 104 61 30 38 13 12 43 103 61 63 18 171 97 55 66 104 S S S H H S S S O S S S Mo Mo S O S S Mo H S S S O -10.222 2.00 728 A 4.01 3.90 3.69 3.30 2.98 2.84 2.75 2.62 2.52 2.29 2.12 1.96 1.52 1.50 1.49 1.45 1.44 1.28 1.27 1.25 1.18 1.17 1.13 1.12 1.10 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:y P:y P:x P:y P:x P:x P:y P:x P:y P:y P:x P:y P:y P:y P:x P:x D:x2-y2 P:y P:z D:xy D:x2-y2 D:x2-y2 P:z D:x2-y2 D:xy -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 0.80 127 126 128 125 116 113 115 114 126 125 127 128 113 121 124 116 114 190 115 123 186 188 189 124 191 185 O O O O O O O O O O O O O O O O O W O O W W W O W W -10.214 2.00 729 A 6.00 5.54 4.64 4.55 3.12 3.02 2.57 2.50 2.25 2.01 1.78 1.75 1.63 1.54 1.49 1.40 1.38 1.37 1.34 1.28 1.28 1.27 1.26 1.21 1.17 1.14 1.10 1.10 1.09 1.04 1.01 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:x D:z2 P:z D:z2 P:y P:x P:x D:yz P:z D:yz P:x P:y P:y P:z P:z D:z2 D:xz P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 131 130 124 121 120 117 110 111 132 129 130 123 131 122 117 190 124 188 110 120 118 194 121 193 119 111 109 125 127 193 187 112 O O O O O O O O O O O O O O O W O W O O O W O W O O O O O W W O -10.208 2.00 730 A 8.14 6.79 3.05 2.67 1.92 1.81 1.77 1.52 1.48 1.40 1.26 1.26 1.23 1.19 1.16 1.08 1.01 1 1 1 1 2 1 2 2 1 1 2 1 1 2 1 2 1 P:x P:z P:y P:x P:y D:xy P:y P:z D:x2-y2 S P:z D:z2 D:xy P:x D:x2-y2 P:z D:x2-y2 -9.089 -9.089 -9.089 -9.089 -7.014 -3.733 -7.014 -7.014 -3.733 -24.020 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 2.00 1.33 1.00 1.00 1.33 1.00 1.33 1.00 102 102 104 104 69 27 75 75 20 102 63 14 21 74 15 40 9 O O O O S Mo S S Mo O S Mo Mo S Mo S Mo -10.196 2.00 731 A 3.96 3.87 3.68 3.67 3.44 3.44 3.43 3.03 2.11 1.97 1.87 1.86 1.86 1.67 1.64 1.63 1.62 1.59 1.55 1.54 1.38 1.34 1.31 1.24 1.17 1.11 1.09 1.07 1.02 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:y P:z P:z P:z P:y P:y P:y P:x P:x P:x P:x P:x P:z P:z P:x P:z P:y P:y P:z P:y D:x2-y2 P:y D:x2-y2 D:x2-y2 D:x2-y2 P:y P:z P:y P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 0.80 0.80 1.33 1.33 1.33 1.33 121 128 130 131 124 126 127 125 128 125 120 126 117 122 132 127 129 111 114 123 110 192 116 195 185 186 107 136 106 138 O O O O O O O O O O O O O O O O O O O O O W O W W W O O O O -10.180 2.00 732 A 4.82 4.35 4.25 4.20 2.18 1.84 1.80 1.62 1.55 1.40 1.27 1.20 1.19 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:x P:x P:y P:z P:z P:z P:z D:z2 P:y P:x P:x D:z2 P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 1.33 123 129 132 122 109 118 119 112 191 124 131 130 189 128 O O O O O O O O W O O O W O -10.178 2.00 733 A 3.59 2.87 2.65 2.46 2.10 2.00 1.94 1.74 1.71 1.62 1.39 1.34 1.29 1.23 1.17 1.10 1.09 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:x P:x P:x P:x P:z P:z P:y P:z P:z P:x P:y P:z P:y P:z P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 122 129 125 126 127 128 121 123 112 130 132 119 126 139 127 137 105 132 O O O O O O O O O O O O O O O O O O -10.178 2.00 734 A 2.72 2.52 2.40 1.97 1.59 1.58 1.47 1.44 1.36 1.22 1.21 1.21 1.15 1.10 1.07 1.05 1.05 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 P:z P:y P:x P:z P:x P:z P:y P:x P:x P:z P:z P:x D:z2 P:y P:y P:y P:y P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -7.014 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 132 122 129 123 128 131 123 118 132 112 124 127 189 109 121 125 59 119 O O O O O O O O O O O O W O O O S O -10.166 2.00 735 A 3.84 2.77 2.77 2.77 2.42 2.33 2.06 1.75 1.73 1.59 1.57 1.54 1.50 1.49 1.48 1.45 1.38 1.38 1.36 1.36 1.36 1.29 1.21 1.19 1.17 1.15 1.11 1.11 1.09 1.07 1.06 2 2 1 2 2 2 1 2 1 2 2 1 2 2 2 1 2 1 1 1 2 1 2 2 1 1 2 2 2 2 2 P:y P:x D:x2-y2 P:x P:y P:x D:xy P:z D:z2 P:x P:x D:xy P:x P:z P:x D:x2-y2 P:z D:z2 D:z2 D:x2-y2 S D:xy P:z S D:xy D:x2-y2 P:y P:z P:y P:y S -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -4.108 -3.733 -7.014 -4.108 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -4.108 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 51 50 19 44 74 38 20 44 19 34 73 26 68 74 57 7 73 20 26 26 12 9 50 5 13 20 34 51 50 31 27 S S Mo S S S Mo S Mo S S Mo S S S Mo S Mo Mo Mo Mo Mo S Mo Mo Mo S S S S Mo -10.159 2.00 736 A 2.33 2.25 2.17 1.98 1.90 1.87 1.73 1.65 1.59 1.44 1.39 1.26 1.23 1.20 1.19 1.17 1.15 1.08 1 2 2 2 2 1 2 2 1 2 1 1 1 2 2 2 1 2 D:z2 P:z P:z P:x P:y D:z2 P:z P:y D:z2 P:z D:xy D:x2-y2 D:xy P:z P:x P:x D:yz P:z -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 18 67 43 42 43 13 38 35 12 61 13 19 18 42 62 38 9 66 Mo S S S S Mo S S Mo S Mo Mo Mo S S S Mo S -10.139 2.00 737 A 2.85 2.63 2.62 2.35 2.35 2.22 1.97 1.90 1.87 1.73 1.72 1.68 1.49 1.40 1.39 1.32 1.14 1.07 1.02 1.01 1 1 2 2 1 2 2 2 2 1 2 2 2 2 1 1 2 1 1 2 D:xz D:yz P:y P:y D:yz P:x P:y P:x P:x D:xz P:y P:y P:y P:y D:yz D:yz P:x D:yz D:xz P:y -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.33 14 13 44 68 20 39 35 67 62 19 38 75 43 74 10 9 63 19 9 58 Mo Mo S S Mo S S S S Mo S S S S Mo Mo S Mo Mo S -10.117 2.00 738 A 3.29 2.81 2.12 2.05 2.04 2.01 1.93 1.62 1.57 1.50 1.38 1.36 1.35 1.24 1.21 1.20 1.19 1.18 1.08 1.08 1.07 1.06 1.04 1.04 1.01 1.00 1 2 1 2 1 2 1 2 2 2 2 2 1 2 1 2 2 2 2 1 2 1 2 1 2 2 D:yz P:y D:xz P:y D:xy P:x D:z2 P:x P:x P:y P:y P:y D:xz P:y D:yz P:x P:x P:z P:y D:yz P:z D:xz P:y D:xz P:z P:y -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.33 14 62 13 34 7 61 5 68 51 68 69 45 19 39 21 33 67 57 73 20 31 15 63 9 34 40 Mo S Mo S Mo S Mo S S S S S Mo S Mo S S S S Mo S Mo S Mo S S -10.099 2.00 739 A 4.69 2.79 2.21 1.97 1.87 1.74 1.63 1.52 1.35 1.32 1.21 1.20 1.13 1.08 1.07 1.07 1.04 1.03 1.01 1.00 2 2 1 2 1 2 2 1 2 2 1 2 2 1 1 2 2 2 2 2 P:y P:y D:x2-y2 P:y D:x2-y2 P:x P:x D:z2 P:x P:y D:x2-y2 P:y P:y D:x2-y2 D:yz P:y P:y P:z P:z S -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -4.108 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 57 59 5 67 4 56 54 7 44 68 18 44 74 13 14 63 56 42 66 6 S S Mo S Mo S S Mo S S Mo S S Mo Mo S S S S Mo -10.076 2.00 740 A 2.94 2.93 2.80 2.43 2.41 2.13 2.02 1.98 1.92 1.89 1.84 1.79 1.60 1.54 1.52 1.49 1.43 1.41 1.39 1.39 1.33 1.30 1.30 1.30 1.29 1.27 1.24 1.24 1.23 1.18 1.12 1.11 1.10 1.08 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:x P:z P:x P:x P:x P:z P:z P:z P:y P:z P:z P:z P:y P:x P:y P:y P:z P:y P:x P:z P:x P:x P:z P:z P:x P:x P:z P:z P:y P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 116 114 107 106 125 118 127 139 137 119 137 135 121 139 144 141 110 131 125 124 112 111 106 109 130 117 142 130 120 107 131 121 127 124 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -10.072 2.00 741 A 3.13 2.79 2.72 2.68 2.56 2.32 2.24 2.17 2.01 1.97 1.86 1.81 1.79 1.73 1.70 1.70 1.60 1.58 1.56 1.52 1.45 1.43 1.43 1.41 1.38 1.37 1.27 1.27 1.19 1.15 1.10 1.03 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:x P:x P:x P:x P:x P:y P:x P:y P:y P:y P:y P:x P:y P:y P:y P:x P:x P:z P:y P:y P:y P:y P:z P:x P:y P:y P:y P:x P:x P:y P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 113 127 142 108 115 105 125 114 141 116 105 117 115 135 119 135 134 112 110 123 133 113 126 127 132 144 125 144 106 114 116 108 120 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -10.068 2.00 742 A 2.88 2.53 2.40 2.31 2.29 2.28 2.17 2.03 1.99 1.73 1.72 1.67 1.65 1.62 1.61 1.52 1.51 1.49 1.49 1.46 1.45 1.45 1.35 1.30 1.19 1.14 1.11 1.11 1.04 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:y P:y P:z P:x P:z P:z P:x P:z P:x P:y P:y P:y P:z P:x P:z P:z P:x P:y P:z P:z P:z P:y P:z P:x P:z P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 122 115 113 136 122 129 129 105 108 118 123 119 112 138 123 112 132 132 109 109 107 138 136 140 109 143 138 133 134 119 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -10.052 2.00 743 A 3.70 3.64 3.23 2.22 2.19 2.19 2.12 2.11 1.97 1.78 1.74 1.65 1.63 1.62 1.61 1.51 1.50 1.47 1.46 1.34 1.30 1.27 1.26 1.16 1.05 1.00 2 2 1 1 2 2 2 1 2 2 2 1 2 1 2 2 1 2 2 2 2 2 1 1 2 2 P:y P:y D:x2-y2 D:z2 P:x P:x P:z D:xy P:x S S D:xy P:z D:z2 P:x P:x D:x2-y2 P:y P:z P:y P:y P:z D:z2 D:z2 S P:y -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -4.108 -4.108 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -4.108 -7.014 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 66 42 11 12 37 41 65 17 60 9 18 12 41 5 39 65 17 57 37 60 98 66 17 11 12 54 S S Mo Mo S S S Mo S Mo Mo Mo S Mo S S Mo S S S S S Mo Mo Mo S -10.026 2.00 744 A 4.58 3.46 3.35 2.96 2.93 2.67 2.54 2.47 2.41 2.29 2.17 2.06 2.03 2.01 1.78 1.59 1.57 1.51 1.45 1.39 1.37 1.27 1.20 1.19 1.15 1.11 1.09 1.07 1.06 1 2 1 2 2 2 2 2 2 2 1 1 1 2 2 2 2 2 2 2 2 1 2 1 1 1 2 2 2 D:x2-y2 P:y D:z2 P:y P:y P:x P:z P:x P:y P:z D:xy D:xy D:z2 P:z P:x P:y P:x P:z P:y S P:z D:xy P:z D:x2-y2 D:x2-y2 D:z2 D:x2-y2 P:y P:y -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -4.108 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 3.575 -7.014 -7.014 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.00 0.00 1.33 1.33 17 49 18 48 71 48 72 66 72 42 18 24 24 49 42 42 71 48 66 12 71 12 66 25 16 17 17 62 37 Mo S Mo S S S S S S S Mo Mo Mo S S S S S S Mo S Mo S Mo Mo Mo Mo S S -10.022 2.00 745 A 3.54 3.10 2.48 2.23 1.84 1.81 1.75 1.74 1.64 1.57 1.54 1.46 1.44 1.43 1.33 1.32 1.25 1.20 1.15 1.11 1.11 1.10 1.10 1.07 1.06 1.02 1.02 1.01 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:x P:y P:y P:y P:x P:x P:z P:z P:x P:y P:y P:z P:z P:y P:y P:x D:z2 P:y P:z P:x P:z D:xy D:xy P:x D:xy P:z P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33 1.33 106 107 132 123 144 135 141 142 105 108 129 133 134 132 129 138 136 139 197 122 125 119 127 190 188 105 192 137 128 O O O O O O O O O O O O O O O O O O P O O O O W W O W O O -10.021 2.00 746 A 3.12 2.97 2.89 2.79 2.61 2.61 2.52 2.51 2.42 2.41 2.27 2.20 2.03 2.01 1.95 1.80 1.80 1.76 1.50 1.49 1.48 1.41 1.36 1.36 1.32 1.26 1.21 1.13 1.13 1.11 1.05 1.03 1.01 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:x P:x P:x P:x P:x P:x P:z P:z P:z P:x P:z P:z P:y P:z P:z P:y P:z P:x P:y P:y P:y P:y P:z P:y P:y P:x P:z P:y P:z P:z P:z P:y P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 122 113 125 129 115 116 127 112 111 119 114 120 110 123 109 118 127 117 132 115 121 116 125 139 113 120 130 121 117 131 130 124 114 126 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -10.011 2.00 747 A 3.53 3.44 3.33 3.31 1.79 1.77 1.69 1.67 1.60 1.57 1.45 1.45 1.32 1.27 1.26 1.23 1.20 1.16 1.03 1.01 1.01 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:y P:y P:x P:x P:z P:y P:y P:z P:z P:z P:y P:y P:y P:z P:z P:y P:x P:z P:x P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 124 121 107 106 118 119 129 110 111 132 144 135 131 130 126 133 134 128 138 141 108 108 O O O O O O O O O O O O O O O O O O O O O O -10.011 2.00 748 A 2.99 2.98 2.97 2.91 2.43 2.35 1.86 1.76 1.57 1.52 1.37 1.30 1.25 1.25 1.17 1.14 1.14 1.09 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:z P:z P:y P:y P:y P:y P:z P:z D:z2 P:z P:z P:x P:x P:z P:y P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -3.733 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 117 120 130 131 109 112 110 111 122 123 17 124 108 119 118 121 124 105 O O O O O O O O O O Mo O O O O O O O -10.008 2.00 749 A 2.12 2.07 1.81 1.62 1.51 1.48 1.48 1.46 1.45 1.21 1.18 1.16 1.02 1 1 1 1 2 1 1 2 1 1 1 1 1 D:z2 P:z P:z D:xy P:x P:y P:x P:x P:x P:z P:z P:y P:y -3.733 -9.089 -9.089 -3.733 -7.014 -9.089 -9.089 -7.014 -9.089 -9.089 -9.089 -9.089 -9.089 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 17 130 131 5 54 109 120 31 117 123 122 112 107 Mo O O Mo S O O S O O O O O -10.003 2.00 750 A 4.25 4.23 3.39 3.31 3.29 3.22 3.19 3.09 3.02 2.84 2.62 2.56 2.45 2.30 2.26 2.23 2.19 2.12 1.70 1.63 1.27 1.27 1.22 1.22 1.20 1.13 1.06 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:y P:y P:z P:z P:z P:x P:z P:y P:x P:x P:y P:y P:y P:y P:z P:z P:x P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 128 126 116 117 120 111 131 110 114 130 126 121 113 115 124 136 138 128 114 116 113 115 119 109 115 118 112 113 O O O O O O O O O O O O O O O O O O O O O O O O O O O O -9.960 2.00 751 A 3.92 3.41 3.19 2.96 2.33 2.25 2.16 1.92 1.76 1.54 1.50 1.43 1.42 1.27 1.26 1.03 1.02 1 1 2 2 2 2 1 2 1 2 2 2 1 2 2 1 1 D:xy D:xy P:x P:x P:z P:y D:x2-y2 P:z D:x2-y2 P:z P:z P:x D:z2 P:y P:x D:xy D:z2 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.00 23 17 41 47 71 48 24 48 16 70 47 31 23 50 65 7 12 Mo Mo S S S S Mo S Mo S S S Mo S S Mo Mo -9.920 2.00 752 A 2.64 2.39 2.34 2.32 2.25 2.20 2.12 2.06 1.91 1.89 1.86 1.65 1.63 1.54 1.42 1.37 1.37 1.36 1.19 1.16 1.14 1.13 1.10 1.09 1.07 1.06 1.01 1 1 2 1 2 2 2 1 2 2 2 2 2 2 1 2 1 1 2 2 1 1 2 1 2 2 1 D:z2 D:xy P:z D:x2-y2 P:x P:z P:x D:z2 P:y P:z P:y P:y P:y P:x D:x2-y2 P:z D:xy D:xy P:z P:z D:z2 D:z2 P:z D:xy P:z P:x D:x2-y2 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.00 7 12 61 6 37 38 60 12 61 33 50 38 55 56 13 73 25 7 50 56 25 6 60 4 37 49 26 Mo Mo S Mo S S S Mo S S S S S S Mo S Mo Mo S S Mo Mo S Mo S S Mo -9.892 2.00 753 A 3.00 2.64 2.60 2.36 2.14 2.10 2.07 1.99 1.87 1.78 1.75 1.73 1.61 1.52 1.48 1.44 1.40 1.38 1.25 1.24 1.22 1.21 1.17 1.13 1.12 1.09 1.08 1.08 2 2 2 1 2 1 1 2 2 1 1 2 2 1 2 2 2 1 2 1 1 1 1 2 2 1 2 2 P:y P:x P:y D:xz P:x D:yz D:yz P:y P:x D:yz D:xz P:y P:y D:yz P:y P:x P:x D:xz P:x D:yz D:xz D:xz D:xz P:y P:y D:xz P:y P:y -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 45 57 75 15 34 7 5 35 61 20 9 67 52 21 40 74 38 12 37 18 13 27 17 66 32 8 59 69 S S S Mo S Mo Mo S S Mo Mo S S Mo S S S Mo S Mo Mo Mo Mo S S Mo S S -9.838 2.00 754 A 8.36 7.95 6.76 3.91 3.86 2.42 2.24 2.23 2.06 1.83 1.78 1.72 1.71 1.62 1.60 1.58 1.40 1.35 1.35 1.27 2 2 1 1 2 2 1 2 2 2 1 2 1 1 1 2 2 2 2 2 P:z P:z D:x2-y2 D:z2 P:y P:y D:x2-y2 P:y P:x S D:z2 S D:xy D:x2-y2 D:xy P:x P:x P:x P:y S -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -17.266 -3.733 -17.266 -3.733 -3.733 -3.733 -0.555 -0.555 -7.014 -7.014 -4.108 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 2.00 1.00 2.00 1.00 1.00 1.00 0.00 0.00 1.33 1.33 1.00 75 52 27 28 52 75 28 89 52 52 27 75 28 21 21 27 21 90 76 21 S S Mo Mo S S Mo S S S Mo S Mo Mo Mo Mo Mo S S Mo -9.792 2.00 755 A 2.85 2.75 2.71 2.71 2.66 2.64 2.59 2.47 2.46 2.18 2.14 2.07 1.71 1.70 1.64 1.58 1.57 1.56 1.55 1.53 1.52 1.52 1.44 1.41 1.09 1.06 1.06 1.05 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 P:x P:y P:y P:x P:x P:y P:y P:x P:z P:z P:z P:z P:z P:z P:z P:y P:y P:x P:y P:x P:y P:x P:x P:z S P:x P:y P:y P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -13.975 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 2.00 1.33 1.33 1.33 1.33 137 138 144 139 141 136 135 142 142 135 141 144 133 134 140 134 139 140 137 143 133 136 138 143 197 122 131 130 123 O O O O O O O O O O O O O O O O O O O O O O O O P O O O O -9.781 2.00 756 A 4.45 3.92 3.01 2.57 2.35 2.34 2.34 2.24 2.06 2.03 1.93 1.78 1.61 1.29 1.26 1.23 1.21 1.20 1.17 1.17 1.15 1.13 1.13 2 2 2 1 1 1 2 1 1 2 2 2 2 2 2 1 2 2 2 2 1 2 2 P:x P:y P:x D:xz D:xz D:xz P:y D:yz D:yz P:x P:x P:y P:x P:x P:x D:xz P:x P:z P:y P:y D:yz P:y P:x -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -0.555 -7.014 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 0.00 1.33 1.33 1.00 1.33 1.33 68 51 73 20 5 26 34 19 27 44 63 74 31 56 50 7 54 14 50 57 4 75 55 S S S Mo Mo Mo S Mo Mo S S S S S S Mo S Mo S S Mo S S -9.770 2.00 757 A 3.21 3.16 2.97 2.86 2.77 2.51 2.48 2.35 2.07 1.99 1.75 1.68 1.67 1.58 1.41 1.40 1.28 1.16 1.05 1.05 1.04 1.02 1.02 1.00 2 2 1 2 1 2 2 2 1 2 2 1 1 1 1 1 1 1 1 2 2 1 1 2 P:x P:y D:xz P:y D:yz P:x P:y P:y D:yz P:y P:y D:xz D:yz D:xz D:xz D:yz D:yz D:xz D:xz P:y P:x D:xz D:yz P:x -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 66 61 18 38 12 42 43 75 17 67 63 8 13 12 7 19 10 11 23 35 63 17 6 37 S S Mo S Mo S S S Mo S S Mo Mo Mo Mo Mo Mo Mo Mo S S Mo Mo S -9.726 2.00 758 A 6.61 6.52 5.45 5.31 2.76 2.75 2.46 2.33 2.33 2.32 2.05 2.03 1.95 1.94 1.73 1.57 1.53 1.48 1.34 1.27 1.26 1.21 1.17 1.16 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z D:yz D:yz P:x P:x D:xz D:xz P:z P:z P:z P:z P:x P:x D:xz D:xz D:yz D:yz P:y P:y P:y P:y D:xy -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 136 138 139 137 188 190 134 133 191 189 114 115 116 113 144 135 188 190 191 189 135 142 144 141 186 O O O O W W O O W W O O O O O O W W W W O O O O W -9.717 2.00 759 A 5.57 5.21 4.46 4.20 3.97 3.91 3.89 3.48 1.98 1.72 1.72 1.71 1.71 1.70 1.69 1.68 1.62 1.50 1.48 1.47 1.46 1.34 1.33 1.32 1.29 1.28 1.24 1.21 1.17 1.15 1.10 1.09 1.08 1.06 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:y P:y P:y P:x P:x P:x P:x D:yz P:y D:xy P:y P:y D:yz D:xy D:yz P:y P:x P:x D:xz D:yz D:xz D:xz D:xy P:z D:xz P:z D:xy D:xy P:x P:x D:xy D:xy P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 142 141 140 143 144 135 134 133 194 118 193 120 117 193 194 192 119 112 109 186 195 187 185 196 144 196 142 187 195 110 111 186 192 141 O O O O O O O O W O W O O W W W O O O W W W W W O W O W W O O W W O -9.703 2.00 760 A 3.54 3.03 2.50 2.33 2.26 2.15 2.03 1.97 1.84 1.70 1.68 1.64 1.59 1.55 1.51 1.44 1.33 1.31 1.28 1.19 1.16 1.11 1.10 1.05 1.01 1.01 1 2 2 2 1 2 1 2 2 1 1 2 1 1 1 1 2 2 2 2 2 2 2 2 2 2 D:yz P:y P:y P:y D:xz P:x D:yz P:x P:x D:yz D:yz P:y D:xz D:xz D:xz D:yz P:x P:x P:y P:y P:y P:x P:x P:x P:y P:x -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 18 42 66 32 17 71 25 65 60 11 5 55 24 12 3 8 73 41 49 41 73 54 68 67 60 34 Mo S S S Mo S Mo S S Mo Mo S Mo Mo Mo Mo S S S S S S S S S S -9.680 2.00 761 A 2.70 2.62 2.18 2.08 2.02 1.90 1.59 1.53 1.52 1.52 1.50 1.45 1.40 1.39 1.35 1.29 1.23 1.22 1.20 1.15 1.14 1.14 1.14 1.13 1.09 1.06 1.06 1.02 1 2 2 2 2 1 2 2 2 2 2 2 1 2 2 1 1 2 2 2 1 2 2 2 2 2 2 2 D:x2-y2 P:x P:z S P:z D:x2-y2 P:x S P:z S P:z P:z D:z2 P:y P:y D:xy D:xy S P:x P:y D:z2 P:y P:x P:x P:z P:y P:y P:x -3.733 -7.014 -7.014 -4.108 -7.014 -3.733 -7.014 -4.108 -7.014 -4.108 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -4.108 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.00 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 26 50 50 19 75 25 44 17 69 27 73 45 15 74 52 26 27 14 42 63 25 34 73 75 63 64 71 48 Mo S S Mo S Mo S Mo S Mo S S Mo S S Mo Mo Mo S S Mo S S S S S S S -9.659 2.00 762 A 4.16 4.06 4.03 3.84 3.55 3.39 3.28 3.26 3.13 2.82 2.79 2.79 2.74 2.73 2.57 2.43 2.32 2.20 1.85 1.77 1.27 1.27 1.09 1.08 1.07 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:y P:x P:y D:x2-y2 D:x2-y2 P:x P:x P:y P:y P:x P:x P:y P:y P:y P:y D:z2 D:z2 D:z2 D:z2 P:x P:x P:z P:z D:z2 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 138 144 136 135 188 190 141 142 136 137 139 137 138 139 134 133 196 187 194 193 140 143 128 126 186 O O O O W W O O O O O O O O O O W W W W O O O O W -9.651 2.00 763 A 5.30 4.86 4.62 3.79 3.74 3.68 3.47 3.39 3.31 3.15 3.03 3.01 2.52 2.28 2.11 2.06 1.94 1.84 1.58 1.36 1.34 1.14 1.10 1.03 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:x D:x2-y2 D:x2-y2 P:y P:y P:x P:y P:y P:y P:x P:y D:z2 P:y P:x P:y D:z2 D:z2 P:x D:z2 D:z2 P:z P:z P:x -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 139 137 140 191 189 137 134 142 139 144 136 143 138 192 133 141 135 195 186 136 194 185 115 125 138 O O O W W O O O O O O O O W O O O W W O W W O O O -9.649 2.00 764 A 3.24 2.13 2.12 2.07 1.83 1.70 1.62 1.59 1.55 1.54 1.40 1.34 1.34 1.32 1.28 1.26 1.24 1.10 1.10 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 1 P:y P:y P:x S P:x P:y S P:z P:x P:y S P:x P:z P:x P:x P:x D:z2 P:x D:xz -7.014 -7.014 -7.014 -4.108 -7.014 -7.014 -4.108 -7.014 -7.014 -7.014 -4.108 -7.014 -0.555 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 0.00 1.33 1.33 1.33 1.00 1.33 1.00 73 38 39 5 43 39 20 63 40 31 14 44 13 55 57 56 26 51 19 S S S Mo S S Mo S S S Mo S Mo S S S Mo S Mo -9.647 2.00 765 A 5.10 5.09 3.27 2.70 2.53 2.50 2.43 2.28 2.13 2.07 2.01 1.83 1.79 1.66 1.65 1.62 1.61 1.56 1.52 1.45 1.40 1.24 1.17 1.14 1.03 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:x P:x P:y P:y P:y D:x2-y2 P:y P:y P:x P:x P:x P:z P:z P:z P:y P:x D:x2-y2 P:x D:xy P:y P:x D:xy P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 0.80 1.33 1.33 142 144 138 136 137 141 140 190 139 143 134 133 135 135 134 141 142 141 188 142 196 135 122 193 144 137 O O O O O O O W O O O O O O O O O O W O W O O W O O -9.639 2.00 766 A 6.61 6.21 5.21 4.59 4.19 3.45 3.19 2.41 1.76 1.34 1.33 1.32 1.30 1.25 1.07 1.05 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:z P:z P:z P:z D:z2 D:x2-y2 D:z2 D:z2 P:x D:z2 D:x2-y2 D:x2-y2 P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 135 141 133 143 134 140 144 142 193 193 195 192 142 194 185 195 136 O O O O O O O O W W W W O W W W O -9.635 2.00 767 A 2.51 2.26 1.85 1.85 1.70 1.47 1.30 1.28 1.26 1.22 1.15 1.13 1.11 1.09 1.05 2 2 2 2 2 2 2 2 2 2 1 1 1 2 1 P:x P:x P:x P:x P:x P:y P:y P:x P:x S D:xz P:x D:xz P:x P:x -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -4.108 -3.733 -9.089 -3.733 -7.014 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 33 37 41 67 62 57 48 45 51 17 7 143 17 31 141 S S S S S S S S S Mo Mo O Mo S O -9.633 2.00 768 A 3.40 3.38 3.36 3.29 3.23 3.20 3.17 3.11 2.86 2.75 2.18 2.16 2.09 1.87 1.85 1.70 1.65 1.55 1.40 1.32 1.31 1.18 1.17 1.17 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:y P:z P:y P:y P:x P:y P:z P:z P:z D:z2 P:x P:x P:y D:yz D:z2 P:z P:z D:xz D:xz P:z P:x P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 137 135 139 133 134 140 138 140 138 136 185 143 141 144 190 187 142 133 189 191 135 121 138 142 O O O O O O O O O O W O O O W W O O W W O O O O -9.628 2.00 769 A 4.81 3.38 2.97 2.43 2.39 2.37 2.35 2.30 2.14 2.03 2.03 2.01 1.68 1.66 1.63 1.61 1.54 1.41 1.36 1.27 1.26 1.22 1.19 1.11 1.10 1.05 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:z P:z P:y P:x P:z P:x P:x P:y P:y P:x P:y P:z P:x P:x P:z P:y P:x D:x2-y2 D:x2-y2 D:x2-y2 P:x P:y P:y D:xy P:z D:xy -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 1.33 1.33 0.80 1.33 0.80 136 143 134 141 135 141 133 144 138 139 143 142 144 136 134 133 140 137 191 189 196 138 133 137 195 140 185 O O O O O O O O O O O O O O O O O O W W W O O O W O W -9.593 2.00 770 A 8.25 4.99 2.87 2.86 2.65 2.43 2.30 1.82 1.46 1.38 1.33 1.30 1.25 1.25 1.24 1.22 1.22 1.20 1.17 1.14 1.12 1.06 1.05 1.02 2 2 2 2 2 2 1 1 2 1 2 2 2 1 2 2 2 2 2 2 2 1 2 2 S P:x P:x P:x P:x P:z D:z2 D:xy P:y D:xy P:z P:y P:x D:x2-y2 P:y P:z P:y P:x P:y P:z P:y D:xy P:y S -4.108 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -4.108 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 20 74 51 69 45 51 26 27 68 19 69 54 73 20 71 74 74 48 50 45 65 14 39 17 Mo S S S S S Mo Mo S Mo S S S Mo S S S S S S S Mo S Mo -9.553 2.00 771 A 21.14 10.59 3.21 2.00 1.92 1.92 1.55 1.31 1.25 1.18 1.16 1 1 1 2 1 1 2 2 2 2 2 P:z P:z D:yz P:y D:xy D:z2 P:x P:z P:x S P:y -9.089 -9.089 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -4.108 -7.014 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.33 99 100 22 41 22 22 47 84 71 17 48 O O Mo S Mo Mo S S S Mo S -9.533 2.00 772 A 3.84 3.80 2.19 1.97 1.91 1.74 1.72 1.63 1.62 1.53 1.45 1.41 1.38 1.36 1.33 1.32 1.30 1.11 1.07 1.06 1.01 2 2 2 1 2 2 2 2 1 1 1 2 2 2 2 2 2 1 2 2 2 P:x P:y P:y P:y S S P:y P:y D:yz D:z2 D:xz P:y P:x P:x P:y P:x P:x D:xy P:y P:y S -7.014 -7.014 -7.014 -9.089 -4.108 -4.108 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -4.108 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 48 31 65 102 5 17 49 33 17 4 23 71 31 32 60 51 61 6 66 32 20 S S S O Mo Mo S S Mo Mo Mo S S S S S S Mo S S Mo -9.501 2.00 773 A 18.26 7.34 3.11 2.72 2.50 2.08 1.50 1.37 1.33 1.27 1.25 1.10 1.03 1 1 2 2 2 1 2 1 1 2 2 2 1 P:z P:z P:x P:y S D:xz P:y D:z2 D:z2 P:y P:z P:z P:x -9.089 -9.089 -7.014 -7.014 -4.108 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -9.089 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.33 99 100 71 41 17 22 70 23 22 42 71 48 99 O O S S Mo Mo S Mo Mo S S S O -9.497 2.00 774 A 2.85 2.62 2.50 2.25 2.24 2.19 2.09 2.01 1.77 1.68 1.37 1.30 1.22 1.22 1.19 1.19 1.15 1.12 1.09 1 1 2 2 1 2 2 2 2 2 2 2 2 2 2 2 1 1 2 D:yz P:z P:x P:y D:xz P:y P:x P:x P:y P:x P:x P:x P:x P:y P:x P:x D:xz D:yz P:x -3.733 -9.089 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 16 101 47 55 13 71 41 65 43 38 54 31 63 65 71 66 11 2 55 Mo O S S Mo S S S S S S S S S S S Mo Mo S -9.469 2.00 775 A 10.04 9.69 9.42 8.94 5.46 5.35 5.13 5.12 1.88 1.77 1.61 1.55 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:y P:y P:y P:y P:x P:x D:xy D:xy D:xy D:xy -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 139 137 138 136 137 139 136 138 191 189 190 188 O O O O O O O O W W W W -9.458 2.00 776 A 6.65 6.44 6.20 5.67 4.79 4.77 4.45 4.16 3.92 3.91 2.76 2.50 2.11 1.63 1.28 1.27 1.22 1.21 1.13 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:y P:z P:y P:y P:z P:y P:x P:z P:x P:z P:z P:x P:x P:z P:z D:yz D:yz D:xz D:xz -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 135 144 144 135 133 142 134 141 141 142 133 134 143 140 105 108 187 196 194 193 O O O O O O O O O O O O O O O O W W W W -9.445 2.00 777 A 3.64 3.29 3.06 2.57 2.44 1.87 1.80 1.57 1.55 1.42 1.41 1.30 1.28 1.18 1.18 1.10 1.08 1.03 2 2 2 2 2 1 1 2 2 2 1 2 2 2 1 2 2 2 P:z P:z P:z P:z P:x D:z2 D:z2 S S S D:z2 P:z P:z P:z D:z2 S P:x P:x -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -4.108 -4.108 -4.108 -3.733 -7.014 -7.014 -7.014 -3.733 -4.108 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.33 59 35 50 73 75 26 8 27 7 18 25 48 51 74 27 12 50 52 S S S S S Mo Mo Mo Mo Mo Mo S S S Mo Mo S S -9.429 2.00 778 A 5.76 5.73 5.08 4.47 4.37 4.35 3.56 3.48 3.34 3.24 3.21 2.80 1.62 1.56 1.47 1.47 1.31 1.28 1.18 1.14 1.10 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:x P:x P:x P:y P:x P:z P:z P:y D:xz D:xz P:y P:z P:y P:x P:z D:yz D:yz P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 140 143 133 134 140 143 142 134 141 141 142 133 192 195 140 135 143 137 144 186 185 139 O O O O O O O O O O O O W W O O O O O W W O -9.404 2.00 779 A 3.06 3.00 2.41 2.25 2.10 2.03 2.00 1.95 1.87 1.79 1.79 1.76 1.72 1.71 1.61 1.60 1.59 1.57 1.53 1.50 1.49 1.45 1.40 1.36 1.33 1.31 1.25 1.24 1.22 1.20 1.19 1.19 1.18 1.06 1.05 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:x P:y P:y P:z P:x D:x2-y2 D:z2 P:y P:z D:x2-y2 D:z2 D:z2 P:x P:x P:y P:z D:x2-y2 D:x2-y2 D:z2 P:x P:z D:z2 P:x P:x P:y D:z2 P:y D:z2 P:y P:z P:y D:z2 P:y P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 1.33 0.80 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 1.33 1.33 140 134 136 135 137 133 138 188 192 133 143 190 186 185 141 142 139 144 191 189 195 139 142 194 143 140 138 187 128 196 136 130 144 193 134 121 O O O O O O O W W O O W W W O O O O W W W O O W O O O W O W O O O W O O -9.398 2.00 780 A 2.85 2.45 2.38 2.03 2.00 1.93 1.76 1.69 1.56 1.55 1.35 1.32 1.24 1.15 1.14 1.13 1.12 1.06 1.04 1.00 2 2 2 1 2 2 2 2 1 1 2 2 2 2 2 2 2 2 1 2 P:z S P:x D:z2 P:x P:z P:x P:z D:xy D:z2 P:z S S S P:x P:y P:y P:x D:xy P:z -7.014 -4.108 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -4.108 -4.108 -4.108 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 59 9 35 8 75 35 59 69 13 10 39 18 27 5 39 54 48 49 9 45 S Mo S Mo S S S S Mo Mo S Mo Mo Mo S S S S Mo S -9.390 2.00 781 A 3.36 3.13 2.55 2.21 2.17 2.15 2.00 1.99 1.80 1.80 1.76 1.67 1.66 1.57 1.46 1.36 1.31 1.31 1.25 1.25 1.24 1.23 1.21 1.11 1.09 1.08 1.06 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:x P:y P:y P:z P:y P:z P:x P:y P:y P:x P:z P:z D:x2-y2 P:x D:x2-y2 D:xy D:yz D:xy P:x P:z D:xy P:z P:y P:x P:y D:xz D:yz -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 142 133 140 128 130 135 121 125 139 137 135 140 122 191 140 189 185 192 192 136 133 194 129 127 128 138 187 194 O O O O O O O O O O O O O W O W W W W O O W O O O O W W -9.388 2.00 782 A 4.50 3.49 3.46 2.85 2.69 2.62 2.59 2.50 2.41 2.15 2.10 2.07 2.01 1.98 1.94 1.91 1.82 1.61 1.57 1.52 1.52 1.52 1.49 1.40 1.36 1.31 1.21 1.21 1.12 1.06 1.05 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:z P:y P:z P:y P:z P:z P:z P:x P:y P:z P:y P:x P:y P:x P:y D:xy P:z P:y D:yz P:y P:x D:xy D:xz D:xz P:x P:z P:x D:z2 D:xz P:y D:x2-y2 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 0.80 134 143 126 131 144 134 136 138 144 136 124 141 131 124 138 143 186 132 125 190 116 141 195 196 186 130 142 126 195 188 121 196 O O O O O O O O O O O O O O O O W O O W O O W W W O O O W W O W -9.383 2.00 783 A 4.72 4.36 4.10 3.17 3.13 2.99 2.89 2.30 2.29 2.23 2.21 2.18 1.87 1.86 1.81 1.78 1.61 1.60 1.57 1.56 1.55 1.34 1.23 1.20 1.19 1.11 1.08 1.06 1.06 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:z P:z P:x P:x P:y P:y P:y P:x D:xz P:y P:x P:z P:y P:x D:xz P:z P:x P:x P:y D:yz D:yz P:y P:z P:z D:z2 P:x D:yz P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 1.33 0.80 1.33 143 139 137 140 129 123 133 134 137 191 141 127 123 122 132 189 135 133 135 139 195 189 143 129 141 187 119 191 109 O O O O O O O O O W O O O O O W O O O O W W O O O W O W O -9.378 2.00 784 A 3.04 2.66 2.58 2.07 1.73 1.61 1.59 1.44 1.26 1.24 1.22 1.19 1.16 1.16 1.13 1.12 1.12 1.10 1.07 1.06 1.05 2 2 2 2 2 2 2 2 1 1 2 2 1 2 1 1 1 2 2 1 1 P:z P:y P:z S S P:z P:z P:y D:z2 D:xy P:z P:y D:z2 P:x P:z D:x2-y2 D:xy P:z P:z D:z2 P:z -7.014 -7.014 -7.014 -4.108 -4.108 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -9.089 -3.733 -3.733 -7.014 -7.014 -3.733 -9.089 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 74 37 51 18 12 63 40 42 24 26 60 93 11 75 133 27 20 37 48 27 140 S S S Mo Mo S S S Mo Mo S S Mo S O Mo Mo S S Mo O -9.348 2.00 785 A 2.29 2.27 2.24 2.24 2.11 2.11 2.09 2.03 1.99 1.92 1.85 1.73 1.72 1.65 1.62 1.48 1.46 1.46 1.44 1.38 1.36 1.34 1.32 1.32 1.30 1.29 1.28 1.26 1.22 1.22 1.18 1.17 1.15 1.13 1.13 1.08 1.06 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:z P:x P:x P:x P:y P:y P:x P:z P:z P:y P:x P:x P:x P:z P:y P:x P:z P:y D:x2-y2 D:yz D:x2-y2 D:x2-y2 D:yz P:y D:x2-y2 P:z P:z P:y D:yz P:x D:yz P:x P:z P:z P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 112 109 121 111 124 122 109 110 112 123 123 131 130 112 122 121 109 110 124 185 196 187 196 187 111 186 111 124 110 186 143 185 122 121 119 123 127 O O O O O O O O O O O O O O O O O O O W W W W W O W O O O W O W O O O O O -9.346 2.00 786 A 2.49 2.33 2.32 2.16 1.91 1.89 1.86 1.81 1.80 1.79 1.77 1.77 1.74 1.73 1.72 1.72 1.72 1.70 1.67 1.66 1.66 1.62 1.52 1.48 1.40 1.39 1.37 1.27 1.27 1.22 1.22 1.21 1.16 1.14 1.13 1.13 1.10 1.07 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:x P:y P:x P:z P:x P:z P:y P:z D:z2 D:z2 P:x D:z2 P:y P:y P:y P:z D:z2 P:x P:z P:z P:z P:x P:z P:z P:z P:z P:y P:z P:y P:z P:y D:xy P:x P:y D:xy P:z P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 127 114 125 116 113 120 129 113 115 190 189 117 191 119 115 118 116 188 128 126 132 131 126 114 130 128 127 129 125 132 119 126 190 115 128 188 118 130 O O O O O O O O O W W O W O O O O W O O O O O O O O O O O O O O W O O W O O -9.337 2.00 787 A 2.90 2.52 2.28 2.19 2.05 1.84 1.69 1.55 1.40 1.38 1.37 1.34 1.28 1.12 1.11 1.08 2 2 2 2 2 2 1 2 2 1 1 1 2 2 2 2 P:y P:z P:y P:y P:z P:y D:z2 P:x P:x D:xz P:y D:x2-y2 S P:y P:y P:y -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -9.089 -3.733 -4.108 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.33 33 37 31 34 60 63 6 43 52 19 102 12 7 37 60 65 S S S S S S Mo S S Mo O Mo Mo S S S -9.308 2.00 788 A 3.26 2.43 2.06 1.90 1.81 1.56 1.44 1.38 1.35 1.33 1.31 1.28 1.26 1.23 1.19 1.11 1.06 1.05 1.01 2 2 2 2 1 2 2 2 2 2 2 2 2 2 1 2 1 2 2 P:z P:z P:y P:z D:z2 P:y P:y P:z P:z P:y P:x S P:y P:z D:z2 P:z D:z2 P:x P:z -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -4.108 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.33 1.33 63 40 56 60 6 57 37 53 35 55 31 27 54 69 4 37 9 52 34 S S S S Mo S S S S S S Mo S S Mo S Mo S S -9.305 2.00 789 A 5.90 5.57 3.16 2.90 2.78 2.76 2.20 1.96 1.59 1.57 1.56 1.45 1.22 1.21 1.18 1.16 1.16 1.08 1.02 1.01 2 2 2 1 2 2 2 1 1 1 2 2 2 2 2 2 1 2 1 2 P:z P:z P:z D:xy P:y P:z P:x D:z2 D:x2-y2 D:z2 P:y S S S P:z P:z D:x2-y2 P:y D:xy S -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -17.266 -17.266 -4.108 -7.014 -7.014 -3.733 -7.014 -3.733 -4.108 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.33 2.00 2.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 69 45 63 20 76 40 52 20 15 14 63 69 45 28 75 52 21 52 27 10 S S S Mo S S S Mo Mo Mo S S S Mo S S Mo S Mo Mo -9.272 2.00 790 A 11.35 10.98 4.52 4.41 4.29 2.84 2.46 2.19 1.55 1.40 1.37 1.32 1.10 2 2 1 1 1 2 2 1 1 2 2 2 2 P:z P:z P:z P:y D:xy S S D:z2 D:x2-y2 P:x S S P:y -7.014 -7.014 -9.089 -9.089 -3.733 -17.266 -17.266 -3.733 -3.733 -7.014 -4.108 -4.108 -0.555 1.33 1.33 1.33 1.33 1.00 2.00 2.00 1.00 1.00 1.33 1.00 1.00 0.00 29 53 103 103 2 29 53 1 3 29 3 2 3 S S O O Mo S S Mo Mo S Mo Mo Mo -9.251 2.00 791 A 10.19 8.59 4.83 4.59 3.06 3.03 2.96 2.42 1.74 1.65 1.56 1.54 1.50 1.47 1.41 1.37 1.25 1.12 1.04 1 2 1 2 2 2 1 1 1 1 2 2 2 1 2 2 2 1 2 P:z P:z D:xy P:z S P:x P:y D:z2 D:x2-y2 P:z S P:x S D:x2-y2 P:z P:x P:x D:xy S -9.089 -7.014 -3.733 -7.014 -4.108 -7.014 -9.089 -3.733 -3.733 -9.089 -17.266 -7.014 -17.266 -3.733 -7.014 -7.014 -7.014 -3.733 -4.108 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 2.00 1.33 2.00 1.00 1.33 1.33 1.33 1.00 1.00 101 47 16 70 16 70 101 23 17 99 70 65 47 23 41 47 85 11 12 O S Mo S Mo S O Mo Mo O S S S Mo S S S Mo Mo -9.221 2.00 792 A 6.89 5.02 4.00 3.41 2.51 2.38 2.30 1.93 1.89 1.68 1.62 1.59 1.57 1.38 1.36 1.29 1.21 1.21 1.14 1.14 1.13 1.06 2 2 1 1 2 2 1 2 2 2 2 1 1 2 2 1 2 2 2 1 1 2 P:z P:z D:x2-y2 D:x2-y2 P:y P:x D:x2-y2 S P:z P:y P:z D:xy D:z2 P:y S D:z2 P:y P:x S D:xy D:xy S -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -4.108 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -17.266 -3.733 -7.014 -7.014 -4.108 -3.733 -3.733 -17.266 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 2.00 1.00 1.33 1.33 1.00 1.00 1.00 2.00 49 72 24 25 72 72 18 18 74 86 51 18 25 87 72 24 49 89 27 28 25 49 S S Mo Mo S S Mo Mo S S S Mo Mo S S Mo S S Mo Mo Mo S -9.199 2.00 793 A 2.61 2.42 2.07 1.95 1.92 1.71 1.49 1.44 1.41 1.40 1.39 1.34 1.33 1.31 1.26 1.20 1.16 1.11 1.09 1.08 1.06 1.05 2 2 2 1 2 2 2 1 2 1 1 2 2 2 2 2 2 2 2 2 2 1 P:z P:y P:x D:yz P:y P:z P:x D:yz P:y D:yz D:yz P:y P:y P:x P:x P:y P:x P:z P:y P:y P:z D:xz -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -0.555 -3.733 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.00 59 40 52 15 60 35 74 26 51 21 13 44 56 73 35 75 69 72 95 61 20 21 S S S Mo S S S Mo S Mo Mo S S S S S S S S S Mo Mo -9.174 2.00 794 A 4.78 3.94 2.39 1.91 1.79 1.57 1.55 1.31 1.30 1.28 1.27 1.22 1.17 1.16 1.11 1.08 1.04 1.02 2 2 1 2 2 2 1 2 1 2 2 1 2 2 1 1 2 2 P:z P:z D:x2-y2 P:z P:y P:y P:z P:x D:yz P:y P:y D:yz P:z S D:yz D:x2-y2 P:y S -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -9.089 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -17.266 -3.733 -3.733 -7.014 -4.108 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 2.00 1.00 1.00 1.33 1.00 55 32 5 35 73 41 103 72 24 60 50 26 59 32 12 2 37 10 S S Mo S S S O S Mo S S Mo S S Mo Mo S Mo -9.161 2.00 795 A 6.11 5.24 4.79 4.35 3.84 3.42 3.17 2.46 2.45 2.30 2.25 1.98 1.96 1.82 1.82 1.73 1.58 1.52 1.45 1.34 -1.29 1.17 1.12 1.04 1.03 1.00 1 2 2 2 1 2 1 1 2 2 2 2 2 1 2 2 2 2 2 1 2 2 2 2 2 2 P:z P:z P:z P:y D:xy S D:x2-y2 D:z2 S P:y P:z P:x P:x D:z2 P:y P:y P:x P:y P:x P:z D:x2-y2 P:x P:y P:z S S -9.089 -7.014 -7.014 -7.014 -3.733 -4.108 -3.733 -3.733 -4.108 -7.014 -7.014 -7.014 -7.014 -3.733 -0.555 -7.014 -7.014 -7.014 -7.014 -9.089 3.575 -7.014 -7.014 -7.014 -17.266 -4.108 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 0.00 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 2.00 1.00 103 54 31 97 4 3 5 2 2 29 55 55 97 3 5 53 53 31 31 104 5 29 30 91 31 8 O S S S Mo Mo Mo Mo Mo S S S S Mo Mo S S S S O Mo S S S S Mo -9.130 2.00 796 A 2.83 2.77 2.44 2.40 2.17 1.73 1.70 1.51 1.50 1.44 1.44 1.35 1.35 1.32 1.24 1.18 1.18 1.16 1.16 1.13 1.12 1.11 1.11 1.10 1.08 1.07 1.04 2 2 2 2 1 1 2 2 2 2 1 2 1 2 2 1 1 2 2 1 2 1 2 2 1 2 2 P:x P:y P:z P:x D:yz D:xy P:z P:x P:x P:x D:xz P:x D:xy P:x P:x D:yz D:xz P:x P:z D:xz P:z D:xz P:y P:z D:xz P:y P:x -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -0.555 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -0.555 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.33 1.00 1.00 0.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 0.00 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 71 41 65 52 23 16 17 75 70 34 24 48 11 66 42 21 4 32 5 28 48 9 31 70 11 59 55 S S S S Mo Mo Mo S S S Mo S Mo S S Mo Mo S Mo Mo S Mo S S Mo S S -9.104 2.00 797 A 5.56 5.34 4.48 4.43 2.97 2.96 2.63 2.62 2.51 2.51 1.62 1.62 1.55 1.48 1.38 1.36 1.34 1.31 1.24 1.21 1.13 1.05 1.04 1.00 2 1 2 1 1 2 2 2 1 2 1 2 2 1 1 2 2 1 2 1 2 1 2 2 P:z P:z P:z D:x2-y2 D:z2 P:z P:y P:z P:z P:z P:z S P:x D:xy D:x2-y2 P:z P:y D:xy S D:xy S D:x2-y2 P:z S -7.014 -9.089 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -9.089 -7.014 -9.089 -4.108 -7.014 -3.733 -3.733 -7.014 -0.555 -3.733 -4.108 -3.733 -17.266 -3.733 -7.014 -4.108 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 0.00 1.00 1.00 1.00 2.00 1.00 1.33 1.00 70 101 47 23 16 41 65 71 99 65 100 23 52 11 24 48 17 23 17 22 70 17 74 24 S O S Mo Mo S S S O S O Mo S Mo Mo S Mo Mo Mo Mo S Mo S Mo -9.085 2.00 798 A 6.29 5.80 3.14 2.31 2.17 2.14 2.06 2.06 1.19 1.17 1.16 1.15 1.14 1.13 1.09 1.09 1.08 2 2 1 1 2 1 2 2 2 2 2 2 1 2 1 2 2 P:x P:x D:xz D:yz P:z D:yz P:z P:y P:z P:z S P:y D:xz P:y P:z P:z P:y -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -4.108 -7.014 -3.733 -7.014 -9.089 -7.014 -7.014 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 75 52 28 21 39 27 51 76 62 68 10 93 27 41 104 90 58 S S Mo Mo S Mo S S S S Mo S Mo S O S S -9.067 2.00 799 A 5.93 5.62 4.94 4.92 4.56 4.35 3.64 3.36 3.12 3.09 2.87 2.74 2.61 2.43 2.39 2.34 2.31 1.63 1.62 1.45 1.26 1.21 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:y P:y P:x P:x P:z P:x P:z P:x P:z P:z P:z P:y P:y P:z D:z2 P:x P:x P:z P:z P:x P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33 1.33 1.33 108 105 138 136 137 139 135 136 144 138 107 141 106 139 137 142 197 106 107 133 134 105 108 O O O O O O O O O O O O O O O O P O O O O O O -9.058 2.00 800 A 4.27 3.53 3.47 3.14 2.98 2.47 2.27 2.24 2.18 2.13 2.07 2.01 1.95 1.91 1.84 1.81 1.63 1.53 1.43 1.40 1.33 1.21 1.20 1.14 1.11 1.10 1.09 1.06 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:x P:y P:y P:y P:y P:x P:x P:y P:z P:x P:z P:y P:y P:y P:y P:x P:z P:z P:x P:y P:x P:z P:x P:x P:y P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 136 138 131 124 126 141 116 130 144 121 117 117 110 143 110 125 135 134 144 131 126 128 127 124 142 116 127 134 143 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -9.052 2.00 801 A 3.71 3.49 3.14 2.95 2.81 2.78 2.60 2.41 2.33 2.28 2.10 1.96 1.86 1.78 1.68 1.66 1.63 1.59 1.51 1.51 1.50 1.46 1.45 1.45 1.37 1.33 1.26 1.19 1.16 1.16 1.16 1.12 1.09 1.01 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:x P:z P:z P:z P:z P:y P:x P:x P:z P:x P:y P:y P:z P:x P:x P:z P:x P:y P:x P:z P:y P:z P:y P:z P:x P:y P:x P:y P:x P:x P:x P:y P:y P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 142 135 121 122 129 130 140 133 138 132 125 136 114 123 136 141 111 144 128 120 120 111 124 127 131 115 121 114 139 128 134 130 138 137 133 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -9.050 2.00 802 A 2.87 2.47 2.09 2.01 2.00 1.98 1.95 1.91 1.89 1.84 1.58 1.48 1.44 1.42 1.35 1.33 1.32 1.30 1.24 1.16 1.15 2 2 1 1 2 2 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 P:z P:z P:x P:y P:z P:z P:y D:x2-y2 P:z P:z P:y P:x P:y P:z P:y P:x P:x P:x P:x P:z P:z -7.014 -7.014 -9.089 -9.089 -7.014 -7.014 -9.089 -3.733 -7.014 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -7.014 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 68 44 142 135 39 62 133 14 45 141 107 141 108 134 106 140 105 108 143 69 143 S S O O S S O Mo S O O O O O O O O O O S O -9.047 2.00 803 A 2.63 2.62 2.61 2.56 2.32 2.03 2.01 1.97 1.97 1.89 1.77 1.57 1.56 1.50 1.43 1.29 1.25 1.21 1.21 1.19 1.17 1.16 1.15 1.15 1.13 1.12 1.10 1.07 1.01 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 P:y P:y P:x P:x P:x P:x P:y P:y P:z P:y P:z P:y P:y P:y P:z P:y P:y P:x P:z P:x P:y P:z P:z P:y D:x2-y2 P:z P:x P:y P:x P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -7.014 -9.089 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33 1.33 133 134 108 141 143 105 144 106 140 107 142 143 135 140 135 105 126 106 44 134 137 133 134 108 197 144 140 139 107 131 O O O O O O O O O O O O O O O O O O S O O O O O P O O O O O -9.039 2.00 804 A 4.67 4.59 3.52 3.33 3.29 2.90 2.65 2.62 2.33 2.32 2.06 2.06 1.89 1.82 1.77 1.74 1.69 1.65 1.65 1.64 1.60 1.60 1.58 1.51 1.50 1.48 1.46 1.42 1.40 1.38 1.28 1.18 1.15 1.13 1.05 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:y P:x P:y P:x P:x P:x P:y P:x P:x P:x P:x P:x P:y P:z P:x P:x P:x P:z P:z P:x P:z P:z P:z P:y P:y P:y P:x P:y P:y P:z P:z P:y P:y P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 139 137 123 129 122 132 125 127 109 119 142 135 113 133 112 143 118 115 126 109 133 144 118 119 112 141 125 143 140 127 144 134 123 128 113 129 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -9.016 2.00 805 A 3.56 3.19 2.91 2.86 2.62 2.14 1.66 1.64 1.48 1.36 1.34 1.33 1.32 1.25 1.21 1.20 1.18 1.12 1.03 1.01 1.01 1.00 1 2 2 2 2 1 2 2 2 2 2 1 1 2 1 1 2 2 1 2 2 2 D:xy P:z P:z P:z P:z D:xy S S S P:z P:y D:z2 D:xy P:z D:z2 D:xy P:z P:y D:x2-y2 P:x P:z P:y -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -4.108 -4.108 -4.108 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 6 56 33 65 41 11 7 23 25 37 33 18 4 43 17 16 67 70 7 72 60 56 Mo S S S S Mo Mo Mo Mo S S Mo Mo S Mo Mo S S Mo S S S -8.999 2.00 806 A 2.36 1.85 1.84 1.81 1.79 1.79 1.75 1.70 1.68 1.66 1.64 1.61 1.55 1.54 1.54 1.52 1.52 1.51 1.51 1.48 1.46 1.45 1.44 1.43 1.42 1.42 1.40 1.39 1.36 1.34 1.33 1.32 1.28 1.24 1.24 1.23 1.22 1.21 1.20 1.17 1.17 1.14 1.14 1.14 1.13 1.13 1.12 1.11 1.09 1.09 1.08 1.08 1.06 1.06 1.05 1.05 1.05 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:x P:z P:y P:y P:y P:z P:z P:y P:x P:y P:z P:z P:z P:x P:y P:z P:x P:z P:y P:z P:x P:z P:z P:y P:z P:x P:z P:x P:z P:z P:z P:y P:y P:y P:x P:y P:x P:z P:y P:x P:y P:y P:x P:x P:x P:x P:y P:z P:z P:x P:y P:y P:z P:y P:x P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 127 113 125 109 139 126 128 121 119 114 115 116 131 123 118 141 135 130 129 112 123 124 136 132 129 137 133 140 143 119 122 120 111 133 127 122 117 134 138 110 109 120 111 124 143 142 128 130 121 117 134 132 125 110 140 144 137 113 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -8.977 2.00 807 A 7.34 3.08 2.13 2.02 2.00 1.88 1.63 1.43 1.25 1.24 1.22 1.16 1.12 1.10 1.09 1.09 1.08 1.04 1.03 1 2 2 2 2 2 2 1 2 1 1 2 1 2 1 2 1 1 2 P:z P:z P:z P:y P:x P:y S P:z P:y D:yz P:y P:z D:x2-y2 P:z P:y P:y D:xy D:xy P:y -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 -4.108 -9.089 -7.014 -3.733 -9.089 -7.014 -3.733 -7.014 -9.089 -7.014 -3.733 -3.733 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.33 104 44 68 91 75 54 14 103 29 21 102 94 27 56 104 64 10 2 58 O S S S S S Mo O S Mo O S Mo S O S Mo Mo S -8.971 2.00 808 A 5.66 5.24 3.94 3.89 3.60 3.44 3.20 3.06 3.01 2.88 2.50 2.42 2.40 2.38 2.33 2.29 1.93 1.89 1.87 1.78 1.64 1.61 1.50 1.47 1.26 1.13 1.11 1.09 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:x P:x P:x P:y P:x P:x P:x P:y P:y P:y P:x P:y P:y P:x P:y P:y P:y P:x P:x P:x P:y P:x P:z P:x D:xz P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 139 137 106 107 142 137 105 108 141 139 144 135 143 106 107 140 105 108 133 133 134 144 134 135 135 138 197 142 O O O O O O O O O O O O O O O O O O O O O O O O O O P O -8.968 2.00 809 A 3.57 2.65 2.64 2.26 2.22 1.83 1.73 1.57 1.57 1.50 1.49 1.47 1.33 1.32 1.11 1.10 1.07 1.05 1.04 1.02 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 1 2 2 2 1 P:z P:x P:z P:z P:z P:z P:y P:x P:y P:z D:z2 P:y S P:z P:x D:xy P:z P:y P:x D:xz -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -4.108 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 39 63 38 62 32 61 64 73 58 44 7 53 19 75 92 9 63 93 75 27 S S S S S S S S S S Mo S Mo S S Mo S S S Mo -8.955 2.00 810 A 5.71 4.34 4.08 3.96 3.71 3.47 3.37 2.54 2.48 2.47 2.39 2.27 2.18 2.15 2.12 2.10 2.09 1.76 1.73 1.70 1.66 1.51 1.39 1.36 1.35 1.33 1.30 1.30 1.25 1.18 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:y P:x P:y P:z P:y P:z P:y P:y P:y P:y P:x P:y P:x P:y P:z P:z P:x P:z P:z P:y P:x P:y P:x P:x P:x P:x P:x P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 134 138 140 136 140 105 134 106 140 108 107 138 144 136 133 107 106 105 144 142 139 142 143 108 107 137 143 106 105 108 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -8.951 2.00 811 A 5.51 5.17 5.11 5.07 3.75 3.48 3.34 3.29 2.80 2.78 2.74 2.30 2.29 2.16 2.03 1.87 1.76 1.72 1.67 1.55 1.51 1.46 1.41 1.22 1.12 1.09 1.09 1.08 1.08 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:x P:z P:y P:z P:z P:z P:z P:z P:z P:z P:x P:z P:z P:x P:y P:y P:y P:y P:z P:z D:xy P:y P:y P:x P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33 1.33 143 107 106 133 143 141 133 135 105 108 144 142 140 134 139 139 137 141 135 108 138 136 138 136 197 143 137 108 136 138 O O O O O O O O O O O O O O O O O O O O O O O O P O O O O O -8.926 2.00 812 A 5.44 5.29 3.69 2.47 2.29 1.96 1.56 1.44 1.36 1.36 1.31 1.29 1.28 1.27 1.27 1.25 1.17 1.08 1.04 1.01 2 2 1 1 2 1 1 1 2 2 1 2 2 2 2 2 2 1 2 1 P:z P:z P:z D:z2 P:z P:z P:z D:xy P:z S D:xy S P:y S P:z P:x P:x D:xy S P:y -7.014 -7.014 -9.089 -3.733 -7.014 -9.089 -9.089 -3.733 -7.014 -4.108 -3.733 -17.266 -7.014 -17.266 -7.014 -7.014 -7.014 -3.733 -4.108 -9.089 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 2.00 1.33 2.00 1.33 1.33 1.33 1.00 1.00 1.33 67 43 104 12 37 101 100 6 33 7 25 67 47 43 60 38 61 24 16 104 S S O Mo S O O Mo S Mo Mo S S S S S S Mo Mo O -8.917 2.00 813 A 39.35 17.34 1.85 1.81 1.42 1.37 1.23 1.18 1.10 1.06 1.01 1 1 2 1 2 1 2 1 1 1 2 P:z P:z P:z P:x P:y P:y P:z D:x2-y2 D:yz S P:y -9.089 -9.089 -7.014 -9.089 -7.014 -9.089 -7.014 -3.733 -3.733 -24.020 -0.555 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 2.00 0.00 100 99 83 99 47 101 41 22 22 100 22 O O S O S O S Mo Mo O Mo -8.905 2.00 814 A 8.73 4.20 3.58 2.83 2.72 2.06 1.78 1.51 1.43 1.37 1.36 1.26 1.19 1.18 1.15 1.09 1.09 1.04 1.03 1 1 2 2 2 2 2 1 2 1 2 1 2 1 2 2 2 1 1 P:z P:y P:z P:x P:z P:y P:y D:x2-y2 S D:xz P:x D:yz P:z D:x2-y2 P:y P:z P:y P:y D:xz -9.089 -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -4.108 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -9.089 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.00 104 104 38 40 61 58 53 7 14 27 50 10 77 1 39 56 43 102 2 O O S S S S S Mo Mo Mo S Mo S Mo S S S O Mo -8.875 2.00 815 A 4.11 3.55 2.54 2.47 2.18 1.97 1.75 1.67 1.64 1.56 1.47 1.44 1.42 1.40 1.38 1.36 1.17 1.16 1.04 2 2 2 2 2 2 2 1 2 1 1 1 2 1 1 2 2 1 1 S P:y P:z P:y P:z P:z P:z D:z2 P:z D:x2-y2 D:xy D:xy P:z D:x2-y2 P:z P:z P:x P:z D:xy -4.108 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -9.089 -7.014 -7.014 -9.089 -3.733 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.00 23 70 72 47 49 66 57 18 42 22 12 18 67 19 99 34 48 100 28 Mo S S S S S S Mo S Mo Mo Mo S Mo O S S O Mo -8.862 2.00 816 A 7.76 7.51 3.97 3.62 3.39 2.97 2.05 1.72 1.48 1.27 1.27 1.18 1.17 1.12 1 2 2 2 2 2 1 2 2 2 2 1 2 2 D:yz P:x P:z P:x P:z P:x D:yz P:z P:x P:z P:x D:xz P:y P:y -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 28 92 52 63 92 69 10 75 40 90 59 14 75 45 Mo S S S S S Mo S S S S Mo S S -8.851 2.00 817 A 12.36 5.69 4.09 3.31 1.64 1.57 1.52 1.51 1.37 1.34 1.16 1.15 1.11 1.09 1.07 1.03 1.02 1 1 2 2 1 1 1 2 2 1 1 2 2 1 1 2 1 P:z P:y P:z P:y D:yz D:yz D:x2-y2 P:z P:x P:z D:xz P:y P:y D:yz D:yz P:x D:yz -9.089 -9.089 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -9.089 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.00 104 104 52 76 10 21 1 77 40 103 27 56 53 28 20 46 1 O O S S Mo Mo Mo S S O Mo S S Mo Mo S Mo -8.827 2.00 818 A 3.55 3.43 2.71 2.52 2.00 1.80 1.74 1.48 1.48 1.47 1.38 1.27 1.27 1.19 1.11 1.08 1.07 1 2 2 2 1 2 1 2 2 2 2 2 1 2 1 2 1 P:z P:z P:y P:z P:y P:z P:z P:z P:x P:z P:z P:z D:yz P:x P:z P:x D:yz -9.089 -7.014 -7.014 -7.014 -9.089 -7.014 -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -9.089 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 101 34 76 52 101 61 104 68 59 44 38 56 28 61 100 35 21 O S S S O S O S S S S S Mo S O S Mo -8.811 2.00 819 A 3.25 2.03 2.01 1.99 1.99 1.91 1.90 1.88 1.87 1.84 1.81 1.77 1.73 1.39 1.12 1.06 1.04 1.03 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:y P:z P:y P:x P:x P:y P:x P:x P:y P:z P:z P:y P:z P:z P:x P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 103 125 131 127 130 122 123 132 124 121 129 128 126 103 140 133 143 143 134 O O O O O O O O O O O O O O O O O O O -8.805 2.00 820 A 5.43 3.45 2.90 2.02 1.58 1.56 1.48 1.09 1.06 1.06 1.04 1.03 1 2 2 1 2 2 2 2 1 1 2 1 P:z P:z P:z P:y S P:z P:z S D:x2-y2 P:y P:x D:x2-y2 -9.089 -7.014 -7.014 -9.089 -4.108 -7.014 -7.014 -17.266 -3.733 -9.089 -7.014 -3.733 1.33 1.33 1.33 1.33 1.00 1.33 1.33 2.00 1.00 1.33 1.33 1.00 103 31 54 103 6 42 43 54 7 102 56 5 O S S O Mo S S S Mo O S Mo -8.801 2.00 821 A 7.53 3.20 2.58 1.96 1.76 1.61 1.49 1.43 1.38 1.22 1.21 1.10 1.07 1.05 1 2 1 2 2 2 2 1 1 1 1 2 2 1 P:z P:z P:y P:z P:y P:z P:z D:x2-y2 P:z D:xy P:y P:x P:z D:x2-y2 -9.089 -7.014 -9.089 -7.014 -7.014 -7.014 -7.014 -3.733 -9.089 -3.733 -9.089 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.00 101 38 101 57 76 61 70 13 103 12 103 31 43 19 O S O S S S S Mo O Mo O S S Mo -8.775 2.00 822 A 6.34 3.23 3.00 2.68 2.12 1.97 1.68 1.68 1.65 1.54 1.45 1.39 1.33 1.29 1.25 1.25 1.25 1.14 1.07 1.03 2 2 2 1 1 2 2 2 1 2 2 2 2 2 1 2 2 1 2 1 P:x P:y P:z D:yz D:xz P:y P:y P:x P:z P:x P:z P:y P:x P:z P:y P:x P:z D:yz P:z D:yz -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 -9.089 -7.014 -7.014 -3.733 -7.014 -3.733 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 92 95 92 28 20 93 58 50 101 36 36 69 74 90 102 63 94 14 41 26 S S S Mo Mo S S S O S S S S S O S S Mo S Mo -8.751 2.00 823 A 2.62 2.07 1.89 1.84 1.76 1.52 1.40 1.39 1.36 1.36 1.36 1.18 2 1 2 2 1 2 2 2 2 2 2 2 S D:x2-y2 P:z P:x D:x2-y2 P:y P:y S P:z P:y P:z P:z -4.108 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -4.108 -7.014 -7.014 -7.014 -7.014 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 13 6 56 90 25 91 70 26 33 76 34 57 Mo Mo S S Mo S S Mo S S S S -8.738 2.00 824 A 6.48 5.47 3.53 2.28 2.06 1.90 1.87 1.85 1.64 1.63 1.55 1.50 1.49 1.45 1.42 1.16 1.13 1.12 1.04 1.01 2 2 1 2 2 2 1 1 2 1 2 2 1 2 2 1 2 2 2 2 P:z P:z P:z P:y P:y S D:x2-y2 P:y S D:x2-y2 S S D:x2-y2 P:y P:y D:z2 P:y S P:x P:x -7.014 -7.014 -9.089 -7.014 -7.014 -4.108 -3.733 -9.089 -4.108 -3.733 -17.266 -17.266 -3.733 -7.014 -7.014 -3.733 -7.014 -4.108 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 2.00 2.00 1.00 1.33 1.33 1.00 1.33 1.00 1.33 1.33 42 66 103 49 70 25 11 103 24 16 66 42 25 76 72 17 95 7 60 37 S S O S S Mo Mo O Mo Mo S S Mo S S Mo S Mo S S -8.696 2.00 825 A 2.68 2.41 2.26 1.93 1.81 1.65 1.59 1.47 1.46 1.46 1.41 1.40 1.30 1.28 1.24 1.20 1.02 1.01 2 1 2 2 2 2 1 2 2 2 2 1 1 2 2 2 2 1 P:x P:y P:y P:z P:y P:z D:x2-y2 P:y P:y P:y P:y D:xy D:xy P:x P:y P:z P:y D:x2-y2 -7.014 -9.089 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 90 102 70 56 58 33 22 93 97 76 47 28 23 97 53 65 38 16 S O S S S S Mo S S S S Mo Mo S S S S Mo -8.682 2.00 826 A 4.18 3.48 2.48 1.96 1.95 1.84 1.72 1.58 1.48 1.32 1.26 1.19 1.16 1.06 1.01 1.01 1 2 1 1 2 2 2 2 2 2 2 1 2 2 1 1 P:z P:x P:y D:xz P:z P:z P:x P:x P:y P:z P:y D:yz P:x S D:xz D:x2-y2 -9.089 -7.014 -9.089 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -4.108 -3.733 -3.733 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 101 59 101 9 66 57 47 35 35 54 36 8 53 2 25 22 O S O Mo S S S S S S S Mo S Mo Mo Mo -8.663 2.00 827 A 4.96 4.82 3.61 3.49 3.45 3.21 2.91 2.75 2.25 2.24 2.12 2.12 1.98 1.95 1.90 1.81 1.75 1.75 1.72 1.70 1.67 1.67 1.66 1.55 1.54 1.49 1.24 1.18 1.14 1.10 1.09 1.05 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 P:x P:x P:x P:x P:z P:z P:x P:z P:y P:z P:y P:y P:y P:z P:x P:y P:x D:xy P:y P:z D:xy P:x P:y P:y P:y P:y P:x D:x2-y2 P:z P:y P:x -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 191 189 114 128 126 116 116 114 131 123 128 129 114 116 109 132 117 121 130 189 126 122 191 120 112 124 111 110 111 186 126 119 119 W W O O O O O O O O O O O O O O O O O W O O W O O O O O O W O O O -8.657 2.00 828 A 2.59 2.39 2.16 2.01 1.97 1.89 1.88 1.61 1.52 1.47 1.39 1.39 1.30 1.21 1.18 1.16 1.15 1.04 1.04 2 2 2 2 1 2 2 1 2 1 2 2 1 1 1 2 2 1 2 P:x P:x P:x P:x D:xz P:z P:y D:xz P:z D:xz P:x P:y D:xz D:xz D:xz P:z P:x D:yz P:y -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.33 55 32 36 95 25 50 64 5 36 14 39 95 10 9 6 73 62 3 37 S S S S Mo S S Mo S Mo S S Mo Mo Mo S S Mo S -8.648 2.00 829 A 5.88 5.07 2.82 2.69 2.45 2.20 2.14 1.90 1.81 1.80 1.77 1.31 1.30 1.24 1.15 1.09 1.07 1.05 2 1 2 1 2 2 1 1 1 2 2 2 2 2 2 2 2 1 P:y D:xz P:y P:z P:x P:z D:yz P:y P:z P:y P:y P:z P:y P:x P:z P:z P:x P:y -7.014 -3.733 -7.014 -9.089 -7.014 -7.014 -3.733 -9.089 -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -0.555 -7.014 -9.089 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 91 1 53 104 90 91 1 104 101 97 77 29 29 47 42 3 77 101 S Mo S O S S Mo O O S S S S S S Mo S O -8.645 2.00 830 A 4.60 4.54 3.59 3.46 3.21 3.11 3.05 2.60 2.32 2.24 2.05 2.03 2.01 1.96 1.92 1.77 1.73 1.73 1.65 1.65 1.64 1.58 1.55 1.51 1.50 1.36 1.31 1.26 1.26 1.25 1.15 1.08 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 P:y P:y P:z P:y P:z P:y P:z P:x P:x P:z P:z P:x P:x P:z P:y P:y P:x P:x P:y P:y D:xy D:xy P:x P:y P:x P:y P:x P:x P:x P:y D:x2-y2 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 188 190 115 113 115 125 113 127 124 115 120 130 131 117 113 121 122 123 129 125 109 112 190 188 127 119 110 110 132 119 118 111 194 W W O O O O O O O O O O O O O O O O O O O O W W O O O O O O O O W -8.637 2.00 831 A 3.13 2.88 2.69 2.59 2.53 2.35 2.34 2.18 2.08 2.08 2.04 2.01 1.93 1.93 1.81 1.76 1.75 1.70 1.61 1.58 1.54 1.54 1.49 1.49 1.49 1.37 1.35 1.30 1.28 1.27 1.26 1.25 1.24 1.23 1.20 1.16 1.16 1.15 1.14 1.08 1.07 1.02 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:y P:y P:x P:y P:x P:z P:x P:z P:z P:z P:y P:z P:x P:y P:z P:z P:y P:z P:z P:y P:x P:y P:x P:x P:y P:x P:x P:x P:x P:y P:z P:z P:y P:z P:y P:z P:z P:z P:z P:y P:x P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 111 118 119 110 127 126 116 128 114 113 121 125 129 132 121 124 132 124 115 131 122 112 117 129 130 120 144 131 109 135 123 122 138 143 137 140 139 130 123 136 142 127 141 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -8.633 2.00 832 A 3.88 3.79 3.37 3.05 2.93 2.86 2.47 2.30 2.25 2.12 1.95 1.95 1.91 1.83 1.75 1.73 1.70 1.70 1.69 1.57 1.52 1.52 1.51 1.44 1.38 1.37 1.27 1.27 1.26 1.25 1.24 1.24 1.20 1.16 1.14 1.09 1.05 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:z P:z P:z P:x P:z P:y P:z P:y D:x2-y2 D:x2-y2 D:x2-y2 P:y D:x2-y2 P:x P:y P:z D:x2-y2 D:x2-y2 P:x D:x2-y2 P:y D:x2-y2 P:y P:y P:x P:z P:x P:z P:x P:z P:x D:xz P:y P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 120 117 110 111 109 112 118 130 119 123 122 122 185 193 186 120 195 131 126 123 194 187 112 192 117 196 128 118 111 130 109 132 110 131 120 195 124 132 O O O O O O O O O O O O W W W O W O O O W W O W O W O O O O O O O O O W O O -8.621 2.00 833 A 5.95 2.76 2.61 2.29 1.96 1.80 1.72 1.51 1.35 1.33 1.30 1.15 1.13 1.12 1.08 2 2 1 1 2 2 2 2 2 1 1 2 1 2 2 P:y P:x D:x2-y2 P:y P:z P:y S P:y P:x P:y D:xz P:y D:xy P:y P:y -7.014 -7.014 -3.733 -9.089 -7.014 -7.014 -4.108 -7.014 -7.014 -9.089 -3.733 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 91 47 6 102 91 33 13 60 72 104 1 47 25 83 77 S S Mo O S S Mo S S O Mo S Mo S S -8.606 2.00 834 A 5.01 4.80 4.42 3.64 2.53 2.17 1.85 1.66 1.54 1.52 1.47 1.35 1.35 1.33 1.16 1.09 1.02 1.01 1.00 2 2 1 1 1 2 2 2 2 2 1 1 2 2 2 1 2 1 1 P:y P:y D:yz D:xz D:xz P:z P:x P:x P:y P:z P:z D:yz P:x P:y P:x D:xz P:z D:xz D:yz -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -9.089 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 47 70 23 16 23 48 49 47 90 71 100 24 70 76 30 8 30 3 22 S S Mo Mo Mo S S S S S O Mo S S S Mo S Mo Mo -8.576 2.00 835 A 4.43 3.86 2.46 2.14 1.89 1.77 1.70 1.53 1.50 1.44 1.43 1.32 1.29 1.26 1.14 1.14 1.07 1.06 1.05 1.01 1.00 2 2 2 2 2 2 1 2 2 1 2 2 1 1 1 1 1 1 2 1 1 P:z P:x P:z P:x P:y P:x D:yz P:x P:y P:z P:z P:x D:xy D:xz D:xz D:yz D:xz P:z P:y D:xy P:y -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -9.089 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -9.089 -7.014 -3.733 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 96 96 71 70 70 90 23 69 95 103 30 30 28 8 16 8 1 101 47 22 101 S S S S S S Mo S S O S S Mo Mo Mo Mo Mo O S Mo O -8.537 2.00 836 A 3.16 2.81 2.68 2.28 2.07 2.02 1.82 1.78 1.63 1.56 1.53 1.53 1.51 1.34 1.27 1.25 1.24 1.14 1.10 1.08 1.04 1 2 2 2 2 2 1 1 2 2 1 2 2 1 2 2 1 2 1 2 2 P:y P:y P:y P:y P:y P:x D:yz D:xz P:x P:y D:x2-y2 P:z P:y D:yz P:x P:z D:xz P:x D:yz P:y P:z -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.33 1.33 102 64 91 32 98 55 3 6 98 56 1 98 97 5 32 96 15 36 8 60 54 O S S S S S Mo Mo S S Mo S S Mo S S Mo S Mo S S -8.502 2.00 837 A 9.49 4.95 4.86 2.41 2.27 2.13 2.06 1.97 1.93 1.70 1.64 1.64 1.31 1.22 1.19 1.14 1.13 1.08 1.05 1.04 1.03 2 2 2 2 2 1 1 2 1 2 2 2 2 2 1 1 2 1 2 2 2 P:y P:x P:z P:x P:x D:xz D:x2-y2 P:x D:xy P:x P:z P:y P:y P:z D:yz D:xz P:y D:yz P:z P:y S -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -4.108 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.00 90 89 94 94 74 21 28 46 27 90 73 88 69 74 20 20 47 26 46 64 28 S S S S S Mo Mo S Mo S S S S S Mo Mo S Mo S S Mo -8.493 2.00 838 A 4.38 3.21 2.72 2.44 2.06 2.04 1.99 1.78 1.78 1.63 1.62 1.57 1.51 1.42 1.17 1.15 1.07 1.05 1.03 2 2 1 2 2 2 2 1 2 2 2 2 2 1 2 2 1 2 2 P:z P:y D:xz P:y P:z P:x P:x D:xz P:y P:y P:x P:x S D:yz P:y P:z P:z P:y P:z -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -4.108 -3.733 -7.014 -7.014 -9.089 -7.014 -7.014 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 94 90 21 35 75 89 94 28 58 93 74 46 26 15 50 52 103 88 98 S S Mo S S S S Mo S S S S Mo Mo S S O S S -8.472 2.00 839 A 4.04 3.77 2.71 2.27 2.26 2.15 1.73 1.59 1.32 1.30 1.28 1.28 1.26 1.23 1.22 1.14 1.14 1.10 1.09 1.09 1.07 1.07 2 2 1 1 2 1 2 1 2 2 1 1 2 2 2 2 1 2 2 2 2 1 P:x P:x D:yz D:xz P:y D:xz P:x D:yz P:z P:x D:xz D:xz P:y P:z P:y P:z P:z P:z P:z P:y P:y D:xz -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -9.089 -7.014 -0.555 -7.014 -7.014 -3.733 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.00 69 45 20 27 52 20 92 15 75 36 16 9 90 89 70 40 103 69 15 69 91 14 S S Mo Mo S Mo S Mo S S Mo Mo S S S S O S Mo S S Mo -8.456 2.00 840 A 9.70 6.69 6.37 3.32 2.63 2.59 1.80 1.68 1.43 1.19 1.18 1.06 1.02 2 2 2 2 1 1 1 2 2 2 1 2 2 P:y P:y P:x P:y D:z2 D:x2-y2 D:xy P:y P:x P:y D:xz P:z P:x -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.33 90 76 90 64 28 28 28 58 45 35 1 63 50 S S S S Mo Mo Mo S S S Mo S S -8.437 2.00 841 A 2.42 2.29 1.96 1.73 1.56 1.56 1.55 1.50 1.47 1.44 1.33 1.20 1.18 1.14 1.14 1.14 1.14 1.12 1.07 1.07 1.07 1.05 1.03 2 2 2 1 2 1 2 2 1 1 2 2 2 2 1 2 1 2 2 2 2 1 1 P:y P:x P:x D:xz P:x D:xz P:z P:y D:xz D:xz P:x P:z P:y P:y D:yz P:y D:yz P:y P:y P:y P:y D:yz D:yz -7.014 -7.014 -7.014 -3.733 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93 9 96 20 36 S S Mo S S Mo S Mo S S S S S S S S S S S S Mo S Mo S -8.398 2.00 843 A 3.12 3.00 2.98 2.39 2.10 2.06 1.67 1.59 1.58 1.57 1.44 1.33 1.31 1.29 1.26 1.20 1.19 1.16 1.14 1.12 1.12 1.07 1.04 1.02 1.02 1 1 2 2 2 2 1 2 2 2 1 1 2 2 2 2 1 2 1 1 2 2 1 2 2 P:z D:xz P:y P:x P:z P:y D:xz P:z P:y P:z D:xz D:yz P:x P:x P:z P:y P:y P:z P:y P:x P:x P:z D:yz P:z P:y -9.089 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -9.089 -7.014 -9.089 -9.089 -7.014 -7.014 -3.733 -0.555 -7.014 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 0.00 1.33 103 4 54 30 54 56 6 30 33 73 3 3 53 70 37 29 103 50 102 102 29 71 9 5 31 O Mo S S S S Mo S S S Mo Mo S S S S O S O O S S Mo Mo S -8.373 2.00 844 A 3.64 2.53 2.34 2.08 1.77 1.58 1.48 1.41 1.35 1.30 1.19 1.13 1.11 1.09 1.09 1.07 1.06 1.04 2 2 2 2 2 2 2 2 1 2 2 1 2 2 1 2 2 2 P:y P:y P:y P:y P:y P:z P:z P:z D:xz P:x P:z D:xz P:x P:x D:xz 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52 20 34 59 20 5 58 15 Mo Mo S S Mo S Mo S S S S S S Mo S Mo S Mo S S Mo S S Mo Mo S Mo -8.312 2.00 848 A 9.16 8.80 4.12 4.11 3.17 3.14 2.83 2.72 2.66 2.58 2.46 2.39 2.27 2.27 2.27 2.21 2.19 2.12 2.12 2.06 2.06 2.03 2.02 1.96 1.65 1.58 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y P:x P:y P:x P:x P:y P:y P:x P:y P:x P:z P:x P:z P:x P:x P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 108 105 144 135 141 142 106 105 136 138 106 108 138 108 107 139 105 137 136 125 139 127 107 137 133 134 O O O O O O O O O O O O O O O O O O O O O O O O O O -8.302 2.00 849 A 3.17 2.73 2.38 2.10 1.96 1.56 1.39 1.38 1.37 1.36 1.34 1.30 1.24 1.24 1.23 1.18 1.13 1.10 1.06 1.05 2 2 2 2 2 2 2 1 2 2 2 1 2 2 2 2 2 1 2 1 P:y P:y P:z P:x P:y P:x P:y D:xz P:y P:x P:x D:yz P:y P:x P:y P:y P:y P:z P:z P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -9.089 -7.014 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 76 58 98 98 98 92 47 27 89 89 95 20 65 53 97 54 75 106 96 107 S S S S S S S Mo S S S Mo S S S S S O S O -8.301 2.00 850 A 7.18 6.20 5.85 5.42 4.88 4.88 4.76 4.68 4.46 4.28 4.20 4.08 3.94 3.60 3.21 2.79 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:x P:y P:x P:y P:x P:x P:y P:y P:x P:y P:x P:x P:y P:x P:y P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 106 105 107 108 133 143 140 134 144 142 135 141 107 105 106 108 131 O O O O O O O O O O O O O O O O O -8.298 2.00 851 A 2.11 1.91 1.84 1.77 1.76 1.74 1.63 1.61 1.47 1.35 1.34 1.32 1.23 1.22 1.21 1.20 1.18 1.15 1.13 1.11 1.07 1.06 1.05 1 2 2 2 2 2 1 2 2 1 2 2 2 2 2 2 2 1 2 2 2 2 1 D:xz P:x P:x P:x P:y P:y D:xz P:y P:y D:xz P:y P:y P:x P:z P:z P:x P:z D:xz P:x P:x P:x P:x D:xz -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 22 70 40 35 45 74 17 64 71 15 88 89 73 51 39 87 50 13 55 36 29 75 10 Mo S S S S S Mo S S Mo S S S S S S S Mo S S S S Mo -8.294 2.00 852 A 9.32 8.67 3.61 3.37 3.03 2.91 2.79 2.77 2.66 2.50 2.36 2.34 2.30 2.18 1.91 1.90 1.86 1.66 1.64 1.63 1.57 1.55 1.55 1.41 1.13 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:x P:x P:z P:z P:x P:y P:x P:y P:y P:x P:x P:y P:y P:x P:x P:y P:z P:z P:y P:y P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 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S S S S Mo S S S S S Mo S Mo Mo S S S S S S Mo -8.251 2.00 854 A 4.85 2.45 2.36 2.18 1.89 1.86 1.72 1.67 1.65 1.60 1.52 1.52 1.48 1.47 1.40 1.38 1.36 1.21 1.14 1.14 1.11 1.06 1.05 1.03 1.02 1.01 2 1 1 2 2 2 1 1 1 2 2 2 2 2 2 2 2 2 2 2 2 1 1 1 2 1 P:x D:xy D:xy P:x P:y P:z D:xy D:xy D:xz P:x P:y P:x P:x P:x P:x P:x P:y P:y P:z P:x P:x D:xy D:xy D:yz P:x D:xy -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.00 90 15 27 45 40 74 21 26 20 89 88 68 52 39 73 69 45 51 69 74 97 19 28 8 51 20 S Mo Mo S S S Mo Mo Mo S S S S S S S S S S S S Mo Mo Mo S Mo -8.241 2.00 855 A 3.39 1.96 1.67 1.66 1.58 1.53 1.50 1.42 1.36 1.30 1.29 1.24 1.12 1.07 1.05 1.02 1.01 1 2 2 2 2 2 2 2 1 2 1 2 2 1 2 2 2 D:yz P:x P:z P:x P:z P:y P:x P:x D:xz P:x D:xz P:x P:z D:yz P:y P:z P:z -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 19 67 73 50 98 43 38 30 14 98 20 46 69 12 89 63 45 Mo S S S S S S S Mo S Mo S S Mo S S S -8.206 2.00 856 A 2.71 2.56 2.42 1.78 1.72 1.70 1.39 1.39 1.29 1.26 1.20 1.14 1.14 1.06 1.04 1.01 2 2 2 2 2 2 2 2 1 2 2 2 2 1 2 2 P:y P:x P:y P:x P:z P:y P:x P:y D:yz P:y P:y P:z P:z D:yz P:x P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -0.555 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 0.00 1.00 1.33 1.33 29 29 32 96 96 97 31 33 5 83 48 62 2 22 73 71 S S S S S S S S Mo S S S Mo Mo S S -8.200 2.00 857 A 1.98 1.97 1.71 1.71 1.71 1.63 1.60 1.55 1.54 1.48 1.38 1.33 1.26 1.22 1.22 1.22 1.14 1.12 1.12 1.09 1.06 1.06 1.01 1.00 2 2 2 2 2 2 2 2 2 2 1 2 1 1 2 2 2 1 2 1 1 1 1 2 P:y P:x P:z P:x P:y P:x P:y P:x P:y P:x D:xy P:x D:yz D:xz P:y P:x P:y D:xz P:x D:xy D:xz D:xy D:xz P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 64 89 98 90 58 44 98 45 60 69 27 31 4 22 63 54 88 17 98 15 11 26 1 71 S S S S S S S S S S Mo S Mo Mo S S S Mo S Mo Mo Mo Mo S -8.173 2.00 858 A 5.93 2.77 2.52 2.26 2.12 2.07 1.88 1.79 1.74 1.64 1.40 1.35 1.13 1.07 1.07 1.01 1.00 1 2 2 2 2 2 1 2 1 2 1 2 1 1 1 1 2 P:y P:y P:x P:x P:y P:y D:yz P:y D:yz P:y D:xz P:z D:yz D:xz D:xz D:xz P:y -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 102 64 67 43 35 59 20 68 13 60 18 50 9 25 19 17 44 O S S S S S Mo S Mo S Mo S Mo Mo Mo Mo S -8.170 2.00 859 A 10.10 7.49 7.41 6.73 4.76 3.43 3.31 3.19 3.09 3.02 2.65 2.14 2.04 1.99 1.92 1.74 1.43 1.40 1.24 1.22 1.14 1.12 1.06 1.05 1.03 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:x P:z P:y P:x P:x P:y P:z P:x P:y P:x P:y P:y P:z P:y P:z P:x P:x P:z P:z P:y P:x P:z P:x P:y P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 125 122 127 132 112 123 118 115 109 129 118 115 119 112 130 118 124 119 119 113 141 132 109 115 125 113 O O O O O O O O O O O O O O O O O O O O O O O O O O -8.163 2.00 860 A 7.16 5.88 5.81 5.10 4.20 3.64 3.26 2.84 2.81 2.77 2.59 2.55 2.50 1.70 1.63 1.63 1.53 1.46 1.34 1.20 1.15 1.05 1.04 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:y P:y P:x P:y P:x P:z P:z P:x P:z P:z P:x P:y P:y P:y P:z P:x P:y P:z P:x P:x P:y P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 123 131 129 121 130 124 113 127 122 114 116 109 132 113 119 115 119 120 136 116 114 110 113 129 O O O O O O O O O O O O O O O O O O O O O O O O -8.149 2.00 861 A 2.56 2.50 2.02 1.60 1.46 1.29 1.29 1.29 1.23 1.20 1.19 1.11 1.10 1.07 2 2 2 2 1 1 2 2 2 2 2 2 1 1 P:x P:y P:x P:y D:yz D:yz P:x P:x P:z P:y P:y P:x D:xz D:yz -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 53 58 59 29 3 13 92 29 71 61 86 89 2 6 S S S S Mo Mo S S S S S S Mo Mo -8.143 2.00 862 A 8.22 8.12 5.61 5.53 4.91 4.76 4.50 4.47 3.90 3.54 2.76 2.59 1.56 1.56 1.53 1.29 1.28 1.26 1.20 1.15 1.13 1.13 1.12 1.10 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:y P:y P:y P:y P:x P:x P:x P:x P:z P:z P:y P:y P:x P:y P:z P:y P:x P:x P:z P:z P:z P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 128 126 131 130 117 120 124 121 110 111 114 116 110 111 126 121 111 124 116 128 110 120 117 114 O O O O O O O O O O O O O O O O O O O O O O O O -8.131 2.00 863 A 3.65 2.23 1.99 1.91 1.81 1.81 1.77 1.64 1.59 1.59 1.58 1.49 1.43 1.40 1.39 1.24 1.23 1.22 1.19 1.17 1.15 1.14 1.13 1.11 1.11 1.08 2 2 1 2 2 2 1 1 2 2 2 2 1 2 2 1 2 2 1 2 2 2 2 1 2 1 P:x P:y D:yz P:x P:y P:y D:xz P:y P:x S P:x P:x D:yz P:x P:y D:xz P:y P:x D:x2-y2 P:y P:y P:y P:y D:xz P:z D:yz -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -9.089 -7.014 -4.108 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 43 38 13 89 91 65 13 102 85 11 41 29 5 30 57 5 30 56 11 48 80 54 37 25 34 1 S S Mo S S S Mo O S Mo S S Mo S S Mo S S Mo S S S S Mo S Mo -8.117 2.00 864 A 2.81 2.26 2.18 1.91 1.82 1.66 1.30 1.30 1.30 1.26 1.20 1.19 1.18 1.16 1.14 1.09 1 2 2 2 1 2 1 2 2 2 1 2 2 2 2 2 D:xz P:y P:x P:y D:yz P:x D:xz P:x P:y P:y D:yz P:y P:y P:x P:x P:y -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 5 29 57 63 12 32 9 34 83 85 20 56 64 97 36 69 Mo S S S Mo S Mo S S S Mo S S S S S -8.099 2.00 865 A 3.76 3.30 1.96 1.93 1.86 1.71 1.57 1.49 1.40 1.33 1.17 1.15 1.13 1.06 1.05 1.01 2 2 2 1 1 2 2 2 1 2 2 2 2 2 2 2 P:x P:y P:z D:yz P:y P:x 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1.74 1.55 1.53 1.47 1.30 1.26 1.17 1.11 1.02 1.00 2 1 2 1 2 2 2 2 2 2 2 2 1 1 1 2 2 1 2 P:y D:yz P:y D:xz P:z P:x P:y P:y P:y P:z P:x P:x D:yz D:xz D:yz P:y P:z D:yz P:x -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -0.555 -3.733 -7.014 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 0.00 1.00 1.33 43 12 49 13 37 72 67 58 39 60 50 61 26 9 14 62 19 19 42 S Mo S Mo S S S S S S S S Mo Mo Mo S Mo Mo S -8.063 2.00 868 A 4.06 2.77 2.17 2.12 1.93 1.81 1.78 1.69 1.64 1.55 1.34 1.33 1.32 1.28 1.27 1.24 1.22 1.20 1.15 1.13 1.08 1.06 1.01 1 2 2 2 2 2 2 2 2 2 1 2 1 1 1 2 2 2 2 2 2 2 2 D:xz P:x P:y P:y P:x P:x P:y P:x P:z P:y D:yz P:x D:xy P:y D:yz P:x P:x P:z P:y P:x P:x P:x P:y -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -9.089 -3.733 -7.014 -7.014 -0.555 -7.014 -7.014 -7.014 -7.014 -7.014 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 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121 124 130 120 131 122 123 117 129 132 106 107 105 108 110 111 110 111 126 136 138 117 128 110 111 128 120 126 133 124 134 121 131 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -8.045 2.00 870 A 3.54 3.30 3.29 2.96 2.59 2.58 2.52 2.47 2.41 2.41 2.26 2.25 2.22 2.14 2.11 1.90 1.79 1.73 1.66 1.58 1.56 1.51 1.41 1.34 1.28 1.25 1.16 1.16 1.15 1.14 1.12 1.07 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:y P:z P:x P:z P:z P:x P:z P:z P:z P:y P:z P:y P:x P:z P:z P:x P:x P:z P:z P:z P:y P:x P:y P:x P:x P:y P:y P:z P:x P:y P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 119 127 125 109 105 108 111 107 129 106 113 123 117 126 130 124 127 116 127 128 126 128 114 135 141 128 114 120 113 113 115 110 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -8.043 2.00 871 A 3.60 3.54 3.19 3.01 2.76 2.58 2.52 2.43 2.34 2.20 2.11 2.05 1.93 1.66 1.66 1.63 1.61 1.54 1.53 1.50 1.33 1.31 1.31 1.28 1.27 1.25 1.22 1.21 1.18 1.17 1.13 1.11 1.02 1.02 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:y P:x P:y P:x P:z P:y P:x P:x P:y P:y P:z P:z P:y P:y P:y P:y P:y P:z P:x P:z P:y P:y P:x P:y P:z P:x P:y P:y P:z P:y P:x P:z P:z P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 115 118 132 125 112 113 122 129 124 130 112 132 122 107 123 105 106 108 127 125 131 131 109 121 120 118 110 139 115 121 126 123 134 112 118 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -8.033 2.00 872 A 4.02 3.35 2.77 2.52 2.42 2.07 1.93 1.91 1.74 1.69 1.60 1.48 1.31 1.22 1.21 1.19 2 1 2 1 1 2 2 1 2 2 1 1 2 2 2 2 P:x D:xz P:y D:xz D:yz P:x P:x D:yz P:y P:x D:xz D:xz P:x P:z P:x P:x -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 60 7 56 17 18 38 37 11 66 46 12 14 42 48 61 66 S Mo S Mo Mo S S Mo S S Mo Mo S S S S -8.019 2.00 873 A 5.43 2.31 1.93 1.84 1.78 1.71 1.67 1.62 1.62 1.44 1.39 1.35 1.32 1.22 1.20 1.11 2 2 1 1 2 2 1 1 1 1 1 2 2 2 2 2 P:y P:y D:yz D:xy P:x P:z D:yz D:yz D:xz D:xz D:yz P:x P:x P:z P:y P:y -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.00 1.00 1.33 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1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 88 93 88 89 26 69 87 26 27 85 21 26 67 13 43 86 64 90 53 61 S S S S Mo S S Mo Mo S Mo Mo S Mo S S S S S S -7.978 2.00 876 A 4.95 3.63 2.41 2.24 2.23 2.02 1.93 1.73 1.63 1.57 1.53 1.40 1.38 1.36 1.33 1.28 1.25 1.22 1.20 1.17 1.01 1 2 2 2 2 2 1 2 2 2 2 2 2 2 1 2 2 2 2 1 2 D:yz P:y P:y P:x P:x P:x D:yz P:x P:y P:y P:x P:y P:z P:y D:xz P:y P:x P:y P:y D:yz P:z -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 17 49 72 74 42 34 25 51 41 55 85 71 94 48 23 45 94 94 52 7 65 Mo S S S S S Mo S S S S S S S Mo S S S S Mo S -7.959 2.00 877 A 3.32 1.97 1.92 1.88 1.87 1.79 1.72 1.59 1.48 1.42 1.42 1.30 1.29 1.24 1.22 1.20 1.20 1.17 1.16 1.12 1.02 2 1 2 1 2 2 2 2 2 2 1 2 2 1 2 1 2 1 1 2 2 P:y D:yz P:x D:xz P:x P:y P:z P:x P:y P:x D:yz P:x P:y D:yz P:z 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1 2 2 2 2 2 2 2 P:x P:y P:y P:y P:y P:y P:x D:xz P:x P:y P:y P:x P:x P:y P:y -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 86 52 87 95 90 64 51 23 71 53 54 87 41 89 85 S S S S S S S Mo S S S S S S S -7.864 2.00 883 A 8.10 7.03 4.38 2.39 2.24 1.89 1.77 1.54 1.43 1.26 1.25 1.08 1.07 1.04 2 2 2 2 2 1 2 2 2 2 2 1 2 2 P:x P:x P:x P:x P:y D:xz P:x P:y P:y P:y P:x D:xy P:x P:y -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 87 85 49 70 48 18 74 75 85 87 71 25 84 86 S S S S S Mo S S S S S Mo S S -7.800 2.00 884 A 2.96 2.64 1.95 1.90 1.75 1.75 1.68 1.57 1.37 1.32 1.32 1.27 1.13 1.13 1.10 2 2 1 1 2 2 2 2 2 2 2 1 1 2 2 P:x P:x D:xy D:xz P:x P:x P:x P:y P:y P:y P:x D:xz D:xz P:x P:z -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -0.555 -7.014 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 0.00 1.33 54 87 25 2 35 96 86 96 85 87 55 7 4 9 96 S S Mo Mo S S S S S S S Mo Mo Mo S -7.793 2.00 885 A 8.92 4.84 3.73 2.16 2.16 1.86 1.67 1.57 1.44 1.33 1.25 1.21 1.19 1.15 1.08 1.03 1.02 1.00 2 2 2 2 1 1 1 2 1 1 2 2 2 1 2 2 2 2 P:x P:x P:x P:y D:xy D:xy D:xy P:y D:z2 D:xz P:x P:z P:y D:yz P:y P:x P:z P:y -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 86 88 87 49 25 24 26 55 24 23 36 98 53 24 98 30 30 97 S S S S Mo Mo Mo S Mo Mo S S S Mo S S S S -7.781 2.00 886 A 7.82 7.06 6.30 6.30 6.20 5.87 5.50 5.43 4.75 4.49 3.15 2.92 1.70 1.62 1.61 1.53 1.37 1.32 1.19 1.16 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:y P:y P:x P:x P:x P:x P:y P:y P:x P:x P:y P:y P:z P:x P:x P:z P:x P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 137 139 142 141 135 144 112 109 119 118 116 114 116 114 114 111 110 116 120 117 119 O O O O O O O O O O O O O O O O O O O O O -7.776 2.00 887 A 3.88 3.67 2.60 2.21 1.82 1.67 1.66 1.38 1.28 1.11 1.08 1.08 1.08 1.05 1.02 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 P:y P:y P:x P:y P:z P:y P:x P:y P:z P:x P:x P:x P:y P:x D:xy -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 87 93 85 77 60 76 86 80 90 31 87 53 37 36 11 S S S S S S S S S S S S S S Mo -7.772 2.00 888 A 6.91 6.80 6.71 4.93 4.82 4.82 4.61 4.53 4.46 4.35 2.12 1.74 1.62 1.34 1.29 1.26 1.21 1.18 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:x P:x P:y P:y P:z P:z P:z P:y P:x P:z P:y P:x P:z P:z P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 116 114 138 144 135 142 141 127 125 136 117 134 115 140 111 111 117 113 O O O O O O O O O O O O O O O O O O -7.761 2.00 889 A 8.68 7.17 6.41 6.23 5.87 5.85 5.16 4.41 4.30 3.51 2.43 2.40 1.84 1.47 1.36 1.34 1.19 1.13 1.12 1.05 1.03 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:x P:y P:z P:y P:x P:y P:y P:x P:x P:y P:y P:y P:x P:x P:z P:x P:y P:y P:z P:y P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 136 134 143 138 117 110 120 140 133 111 115 113 119 115 112 115 113 110 118 113 112 109 O O O O O O O O O O O O O O O O O O O O O O -7.759 2.00 890 A 18.29 7.29 5.95 1.74 1.52 1.43 1.34 1.32 1.22 1.21 2 1 2 2 2 1 1 1 1 2 P:y D:x2-y2 P:x P:y P:y D:z2 D:xz D:xy D:x2-y2 D:x2-y2 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 3.575 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 0.00 80 6 85 85 38 6 7 23 23 6 S Mo S S S Mo Mo Mo Mo Mo -7.756 2.00 891 A 6.23 6.03 5.91 5.67 5.07 4.94 4.84 4.73 4.72 3.87 3.72 3.65 3.21 2.74 2.34 1.89 1.87 1.86 1.75 1.31 1.29 1.26 1.07 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:x P:y P:x P:y P:x P:x P:x P:y P:y P:y P:y P:x P:x P:y P:x P:x P:x P:y P:x P:x P:y P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 131 124 130 122 129 121 123 133 132 140 141 142 144 135 120 134 111 109 118 138 136 143 112 140 O O O O O O O O O O O O O O O O O O O O O O O O -7.753 2.00 892 A 4.43 3.26 2.44 2.37 1.99 1.67 1.65 1.54 1.54 1.44 1.42 1.39 1.35 1.28 1.17 1.10 1.08 1.04 2 2 2 2 2 2 2 2 1 2 1 1 1 1 2 1 2 1 P:x P:x P:y P:y P:x P:y P:y P:x D:z2 P:y D:xy D:yz D:z2 D:yz P:x D:xz P:y D:xy -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 88 87 93 75 85 64 88 30 25 87 26 24 26 5 56 7 31 25 S S S S S S S S Mo S Mo Mo Mo Mo S Mo S Mo -7.738 2.00 893 A 7.84 7.36 5.91 5.50 5.41 5.36 4.14 4.07 3.29 2.42 2.35 1.78 1.68 1.63 1.49 1.41 1.39 1.38 1.32 1.23 1.22 1.22 1.16 1.05 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:x P:x P:z P:z P:z P:y P:z P:x P:x P:y P:y P:y P:x P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 139 137 113 125 127 115 126 128 143 140 133 134 112 118 119 132 109 123 122 129 130 131 124 121 109 O O O O O O O O O O O O O O O O O O O O O O O O O -7.713 2.00 894 A 3.69 3.39 3.06 2.59 2.44 2.43 2.21 1.96 1.89 1.79 1.75 1.70 1.53 1.51 1.27 1.22 1.19 1.16 1.15 1 1 2 2 2 2 1 1 2 2 2 2 1 2 1 1 2 2 2 D:xz D:xz P:x P:y P:y P:y D:xz D:xz P:y P:x P:x P:z D:xz P:x P:y D:xz P:x P:z P:x -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -9.089 -3.733 -7.014 -7.014 -7.014 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 5 11 65 97 80 58 6 9 95 34 41 60 7 97 102 16 62 88 37 Mo Mo S S S S Mo Mo S S S S Mo S O Mo S S S -7.708 2.00 895 A 2.90 2.69 2.21 1.93 1.60 1.57 1.54 1.50 1.28 1.27 1.26 1.24 1.21 1.15 1.15 1.09 1.07 1.07 1.05 1.04 1.03 2 1 1 2 2 2 2 1 2 2 2 1 2 1 2 2 2 2 2 1 1 P:x D:yz D:xz P:y P:x P:x P:x D:xz P:y P:x P:z D:xz P:z D:yz P:y P:y P:x P:y P:z D:xz D:yz -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.00 88 6 2 75 92 60 31 24 95 66 86 12 61 14 34 76 54 80 45 4 9 S Mo Mo S S S S Mo S S S Mo S Mo S S S S S Mo Mo -7.694 2.00 896 A 5.21 4.18 3.87 2.59 1.69 1.62 1.62 1.49 1.47 1.44 1.40 1.39 1.38 1.32 1.29 1.26 1.20 1.19 1.16 1.15 1.14 1.14 1.09 1.03 1.00 2 2 2 1 1 2 2 1 2 2 1 1 1 2 1 1 2 2 2 2 1 2 2 2 1 P:y P:y P:y D:x2-y2 D:x2-y2 P:z P:x D:x2-y2 P:x P:y D:x2-y2 D:xz D:xz P:x D:xz D:x2-y2 P:y P:z P:x P:y D:x2-y2 P:y P:x P:y D:xz -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 93 76 86 20 14 90 89 26 93 55 15 28 21 63 27 19 69 89 75 45 21 44 86 80 20 S S S Mo Mo S S Mo S S Mo Mo Mo S Mo Mo S S S S Mo S S S Mo -7.676 2.00 897 A 5.32 4.09 3.33 2.59 2.58 2.53 2.46 2.39 2.04 2.01 1.88 1.84 1.82 1.71 1.43 1.31 2 2 2 1 1 2 2 2 1 2 1 1 2 2 2 2 P:x P:y P:x D:yz D:x2-y2 P:x P:y P:y D:xy P:y D:xy D:z2 P:x P:y P:y P:x -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.33 86 86 84 22 23 85 76 85 24 83 22 24 83 75 88 87 S S S Mo Mo S S S Mo S Mo Mo S S S S -7.669 2.00 898 A 4.76 4.50 4.26 4.03 3.80 3.69 3.67 3.62 3.28 3.25 3.24 3.21 3.01 2.92 2.82 2.64 2.16 2.14 2.04 1.91 1.88 1.80 1.76 1.67 1.45 1.43 1.41 1.35 1.16 1.16 1.14 1.11 1.05 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:y P:y P:y P:x P:y P:x P:y P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:z P:z P:x P:x P:x P:x P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 129 132 131 130 124 123 121 122 141 127 142 125 144 135 122 123 115 113 136 138 132 127 125 129 123 129 132 122 115 113 118 119 109 112 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.664 2.00 899 A 5.39 4.62 4.49 4.40 4.17 4.10 3.94 3.71 3.23 2.93 2.86 2.80 2.72 2.71 2.59 2.37 2.35 2.31 2.26 2.23 1.93 1.89 1.62 1.60 1.59 1.57 1.55 1.43 1.30 1.28 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:x P:x P:y P:x P:y P:x P:y P:x P:x P:x P:y P:x P:y P:z P:x P:x P:z P:y P:y P:y P:z P:z P:y P:z P:y P:z P:y P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 121 124 123 122 129 130 132 131 131 128 134 126 130 133 143 137 114 116 139 140 124 121 124 131 128 130 126 121 116 114 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.651 2.00 900 A 10.85 10.36 5.27 5.16 3.52 3.34 2.18 2.09 1.93 1.88 1.87 1.86 1.82 1.79 1.61 1.47 1.42 1.42 1.39 1.39 1.38 1.37 1.29 1.25 1.22 1.19 1.18 1.17 1.16 1.12 1.07 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:x P:y P:z P:z P:z P:z P:x P:y P:z P:z P:z P:y P:y P:y P:z P:y P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 126 128 127 125 138 136 131 124 121 117 111 110 130 120 133 140 122 129 123 132 134 143 119 112 109 125 141 142 118 127 128 144 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.628 2.00 901 A 2.50 1.79 1.71 1.71 1.46 1.35 1.31 1.25 1.25 1.22 1.21 1.21 1.19 1.17 1.15 1.12 1.07 1.06 1.05 2 1 2 2 2 2 1 2 2 2 1 2 2 1 2 2 1 2 1 P:x D:yz P:x P:y P:y P:z D:yz P:z P:y P:z D:z2 P:x P:z D:yz P:z P:y D:xy P:x D:yz -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.00 85 11 84 77 70 75 23 37 82 65 23 31 70 19 81 93 18 66 26 S Mo S S S S Mo S S S Mo S S Mo S S Mo S Mo -7.611 2.00 902 A 4.14 3.06 2.39 2.15 2.04 1.94 1.69 1.47 1.40 1.37 1.28 1.22 1.21 1.13 1.08 1.04 1.03 2 2 2 2 2 2 1 2 1 2 2 1 2 2 2 2 2 P:x P:y P:x P:z P:z P:x D:x2-y2 P:x D:yz P:y P:z P:y P:y P:z P:y P:y P:x -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 30 30 80 56 30 60 22 81 7 75 41 102 98 31 83 31 37 S S S S S S Mo S Mo S S O S S S S S -7.596 2.00 903 A 8.82 3.25 3.08 2.96 2.83 2.34 2.28 2.15 2.12 1.64 1.60 1.42 1.07 1.03 1.01 2 1 1 1 2 2 2 2 1 2 1 1 2 1 2 P:y D:x2-y2 D:xy D:xy P:y P:x P:x P:y D:xy P:y D:xy D:x2-y2 P:x D:xy P:z -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.33 80 6 3 5 97 32 55 29 8 58 2 10 53 9 54 S Mo Mo Mo S S S S Mo S Mo Mo S Mo S -7.552 2.00 904 A 8.36 8.00 5.04 4.06 3.74 3.65 3.16 3.07 2.77 2.70 2.66 2.59 2.30 2.28 1.91 1.82 1.70 1.69 1.65 1.46 1.39 1.35 1.30 1.24 1.19 1.15 1.05 1.05 1.04 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:x P:x P:z P:z P:x P:y P:y P:z P:x P:z P:z P:z P:z P:z P:y P:x P:y P:y P:y P:x P:y P:y P:x P:x P:y P:y P:y P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 125 127 142 141 105 108 135 144 135 144 144 142 141 135 136 138 130 112 131 108 141 121 105 142 109 124 119 125 127 118 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.547 2.00 905 A 2.27 2.05 1.93 1.72 1.65 1.61 1.59 1.54 1.38 1.31 1.29 1.18 1.07 1.05 1.03 1.02 1.00 1 2 1 2 1 1 2 1 1 1 1 2 2 2 2 2 1 D:x2-y2 P:y D:xy P:y D:x2-y2 P:y P:x D:xy D:x2-y2 D:xy D:xy P:y P:y P:x P:x P:x D:x2-y2 -3.733 -7.014 -3.733 -7.014 -3.733 -9.089 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.00 24 86 18 66 11 102 42 22 16 12 13 31 41 38 84 53 17 Mo S Mo S Mo O S Mo Mo Mo Mo S S S S S Mo -7.543 2.00 906 A 5.65 5.28 4.58 4.33 4.29 4.10 3.36 3.27 3.12 2.87 2.70 2.58 2.29 2.29 2.20 2.17 2.07 1.93 1.79 1.65 1.60 1.56 1.38 1.25 1.18 1.17 1.06 1.04 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:y P:y P:z P:x P:x P:z P:z P:y P:x P:x P:z P:z P:y P:y P:x P:y P:y P:x P:z P:x P:x P:x P:y P:y P:x P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 114 137 130 135 135 138 124 142 139 141 142 121 116 141 142 138 136 144 131 135 144 112 111 114 132 136 141 128 110 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.540 2.00 907 A 5.62 4.96 4.43 3.97 3.61 3.43 3.27 3.21 3.05 2.75 2.60 2.58 2.45 2.40 2.31 2.26 2.14 2.04 1.91 1.83 1.80 1.78 1.70 1.63 1.55 1.54 1.51 1.50 1.45 1.37 1.25 1.07 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:y P:y P:x P:y P:x P:x P:y P:y P:y P:x P:y P:y P:y P:x P:x P:x P:x P:y P:x P:y P:y P:z P:y P:x P:x P:y P:y P:x P:y P:y P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 123 136 137 131 105 132 121 138 136 130 107 134 142 143 129 137 108 133 122 121 107 106 108 144 140 132 129 105 138 124 124 139 135 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.536 2.00 908 A 4.76 4.56 3.45 2.50 2.40 2.34 2.26 2.23 2.07 2.06 1.59 1.57 1.50 1.50 1.50 1.35 1.25 1.22 1.12 1 1 2 1 1 1 1 1 1 1 1 1 2 1 1 1 1 2 2 P:z P:z P:z P:z P:y P:y P:z P:z P:x P:z P:y P:x P:x P:z P:z P:x P:y P:z P:y -9.089 -9.089 -7.014 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -7.014 -9.089 -9.089 -9.089 -9.089 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 116 114 90 141 144 135 144 139 141 135 119 142 30 142 137 109 118 29 30 O O S O O O O O O O O O S O O O O S S -7.535 2.00 909 A 6.08 4.68 2.95 2.94 2.89 2.89 2.56 2.33 2.30 2.10 2.07 2.00 1.99 1.63 1.42 1.25 1.13 1.10 1.04 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 P:z P:z P:y P:z P:z P:z P:z P:y P:x P:z P:y P:x P:x P:z P:z P:x P:z P:y P:x -9.089 -9.089 -9.089 -7.014 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -7.014 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 116 114 144 90 141 144 139 118 141 142 135 142 112 135 137 30 127 141 124 O O O S O O O O O O O O O O O S O O O -7.531 2.00 910 A 12.00 11.99 10.91 6.53 3.27 3.07 2.78 2.54 2.28 2.22 2.16 2.15 2.10 2.08 1.80 1.79 1.76 1.73 1.70 1.51 1.44 1.43 1.35 1.19 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:y P:y P:x P:x P:y P:y P:z P:x P:z P:x P:x P:y P:y P:y P:y P:x P:z P:z P:z P:y P:x P:z P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 112 137 119 137 122 129 139 105 123 108 135 108 105 132 142 106 119 112 135 119 131 139 142 106 O O O O O O O O O O O O O O O O O O O O O O O O -7.527 2.00 911 A 16.37 13.82 10.86 7.53 3.68 3.53 3.19 3.04 2.45 2.31 2.29 1.94 1.89 1.87 1.69 1.65 1.58 1.48 1.32 1.25 1.21 1.11 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:y P:y P:x P:x P:x P:z P:x P:x P:z P:z P:z P:y P:x P:y P:y P:x P:y P:y P:x P:x P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 109 139 118 139 118 144 141 112 105 109 118 144 141 141 108 119 119 137 129 108 122 142 O O O O O O O O O O O O O O O O O O O O O O -7.520 2.00 912 A 4.98 2.74 2.12 2.09 2.09 2.04 2.00 1.98 1.54 1.39 1.39 1.35 1.25 1.21 1.17 2 2 1 1 2 2 1 2 2 1 1 1 2 2 2 P:y P:x P:z P:z P:y P:x P:z P:x P:x D:x2-y2 P:z P:y P:y P:y P:x -7.014 -7.014 -9.089 -9.089 -7.014 -7.014 -9.089 -7.014 -7.014 -3.733 -9.089 -9.089 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 81 87 116 114 90 90 107 88 75 28 106 120 85 93 92 S S O O S S O S S Mo O O S S S -7.518 2.00 913 A 5.39 4.85 4.79 4.44 2.66 2.02 1.64 1.63 1.62 1.61 1.61 1.56 1.50 1.43 1.40 1.36 1.34 1.28 1.28 1.19 1.16 1.16 1.13 1.12 1.11 1.01 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 P:z P:z P:z P:z P:z P:z P:x P:y P:x P:y P:x P:x P:x P:x P:x P:y P:y P:x P:y P:y P:x P:x P:x P:x P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -7.014 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -7.014 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 116 114 106 107 128 126 138 144 109 81 106 105 136 141 107 135 117 108 118 119 116 142 87 110 112 111 O O O O O O O O O S O O O O O O O O O O O O S O O O -7.499 2.00 914 A 3.07 2.72 2.68 2.51 2.01 1.62 1.50 1.43 1.33 1.32 1.32 1.27 1.24 1.21 1.18 1.17 1.16 1.14 1.01 2 2 2 1 1 1 1 2 2 2 1 1 2 1 2 2 1 2 2 P:x P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:y P:x P:y P:z P:z P:y P:x P:z P:y D:xy P:y P:y -7.014 -7.014 -7.014 -9.089 -9.089 -3.733 -3.733 -7.014 -7.014 -7.014 -9.089 -9.089 -7.014 -9.089 -7.014 -7.014 -3.733 -7.014 -0.555 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 0.00 85 88 86 117 120 11 22 80 47 54 134 115 53 110 29 68 22 81 23 S S S O O Mo Mo S S S O O S O S S Mo S Mo -7.496 2.00 915 A 15.09 12.41 11.21 7.54 5.95 5.42 4.10 2.22 1.76 1.76 1.62 1.59 1.45 1.40 1.24 1.18 1.13 1.04 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:z P:y P:z P:y P:z P:x P:y P:z P:z P:y P:y P:z P:y P:x P:x P:z P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 117 134 134 115 140 126 138 143 138 143 132 138 117 115 143 110 128 115 133 O O O O O O O O O O O O O O O O O O O -7.495 2.00 916 A 10.98 8.46 6.06 5.45 4.70 4.30 3.98 3.60 3.29 2.85 2.51 2.47 2.41 2.27 2.24 2.14 2.05 1.96 1.93 1.82 1.55 1.43 1.31 1.16 1.13 1.06 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:z P:x P:x P:z P:y P:y P:z P:x P:x P:y P:y P:x P:y P:x P:y P:x P:z P:x P:y P:y P:z P:x P:y P:x P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 111 140 110 140 115 111 120 143 138 136 107 117 134 138 122 110 107 111 106 106 136 138 123 115 143 120 O O O O O O O O O O O O O O O O O O O O O O O O O O -7.493 2.00 917 A 7.37 6.95 5.97 5.59 4.32 4.19 3.62 3.28 3.08 3.06 2.78 2.75 2.38 2.19 2.19 1.96 1.66 1.55 1.41 1.34 1.31 1.25 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:x P:x P:z P:z P:x P:z P:y P:x P:x P:x P:x P:y P:y P:y P:y P:z P:z P:z P:y P:y P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 115 140 110 140 143 134 128 120 111 133 143 136 110 115 143 136 138 133 126 133 106 110 O O O O O O O O O O O O O O O O O O O O O O -7.486 2.00 918 A 18.17 11.40 9.77 9.59 6.26 5.42 5.10 4.03 2.78 1.88 1.80 1.63 1.56 1.24 1.24 1.14 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:y P:y P:x P:z P:z P:y P:x P:y P:z P:y P:x P:z P:x P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 113 133 133 120 143 136 143 113 113 143 128 129 133 120 110 105 O O O O O O O O O O O O O O O O -7.474 2.00 919 A 21.11 4.62 2.79 1.99 1.71 1.49 1.48 1.36 1.27 1.24 1.22 1.21 1.19 1.18 1.14 2 1 1 2 1 2 2 2 2 2 2 2 2 2 1 P:y D:x2-y2 D:z2 P:z D:xy P:x P:x P:x P:y P:x P:x S P:z D:x2-y2 D:yz -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -17.266 -7.014 3.575 -3.733 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 2.00 1.33 0.00 1.00 81 11 11 81 6 37 80 65 85 75 55 81 65 11 23 S Mo Mo S Mo S S S S S S S S Mo Mo -7.468 2.00 920 A 5.35 4.87 4.64 4.59 4.11 4.09 4.09 4.03 3.99 3.90 3.89 3.62 1.38 1.36 1.26 1.22 1.14 1.12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:y P:y P:z P:z P:z P:x P:y P:y P:x P:x P:z P:y P:z P:y P:x P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 133 143 140 138 137 139 135 141 142 134 144 136 125 128 127 116 123 114 O O O O O O O O O O O O O O O O O O -7.442 2.00 921 A 5.39 4.42 4.18 3.77 2.90 2.47 2.39 2.33 2.04 1.36 1.19 1.11 1.07 2 2 2 2 1 1 2 1 1 2 2 2 1 P:y P:z P:z P:x D:xz D:yz P:z D:xz D:x2-y2 P:x P:y P:z D:xz -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.00 83 85 47 47 17 23 70 23 22 84 29 83 6 S S S S Mo Mo S Mo Mo S S S Mo -7.413 2.00 922 A 4.12 3.44 2.87 2.58 2.32 1.97 1.95 1.69 1.57 1.43 1.36 1.28 1.18 1.16 1.06 2 2 2 2 2 2 1 1 1 1 2 2 2 2 1 P:x P:z P:z P:z P:z P:x D:xz D:xz D:xz D:xz P:x P:z P:y P:y D:z2 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 80 53 90 29 88 81 2 19 26 25 29 87 64 44 4 S S S S S S Mo Mo Mo Mo S S S S Mo -7.401 2.00 923 A 3.17 2.79 2.23 2.19 2.16 1.71 1.51 1.50 1.45 1.25 1.24 1.17 1.15 1.14 1.10 1.03 1.03 1.01 2 2 2 1 2 2 2 1 2 1 2 1 2 2 2 2 2 2 P:x P:y P:z D:x2-y2 P:z P:y P:y D:xz P:z D:xz P:y D:yz P:z P:z P:z P:z P:y P:y -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 47 83 47 22 37 77 58 24 70 16 51 16 88 60 86 72 69 82 S S S Mo S S S Mo S Mo S Mo S S S S S S -7.372 2.00 924 A 3.47 2.83 2.12 1.95 1.74 1.62 1.60 1.51 1.47 1.44 1.29 1.22 1.21 1.21 1.20 1.15 1.12 1.04 1.03 1.03 1.02 2 2 1 2 2 1 2 2 2 2 1 1 2 2 2 2 2 2 1 2 2 P:z P:y D:xy P:z P:x D:xz P:z P:y P:y P:x D:xz D:xz P:x P:x P:y P:x P:y P:x D:x2-y2 P:y P:x -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 90 86 22 29 41 4 53 80 83 72 6 24 86 81 70 29 71 83 22 68 84 S S Mo S S Mo S S S S Mo Mo S S S S S S Mo S S -7.334 2.00 925 A 3.10 2.91 2.65 2.37 2.12 2.11 2.08 2.00 1.99 1.68 1.64 1.62 1.43 1.42 1.31 1.27 1.21 1.20 1.12 1.07 1.02 2 2 2 2 1 2 1 2 1 2 2 1 2 2 2 2 2 1 1 2 2 P:z P:z P:y P:x D:xz P:z D:xz P:z D:xz P:z P:z D:yz P:z P:z P:z P:x P:y D:yz D:xz P:x P:z -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 53 88 77 29 25 80 26 29 19 63 45 6 40 87 69 50 74 1 14 51 89 S S S S Mo S Mo S Mo S S Mo S S S S S Mo Mo S S -7.297 2.00 926 A 8.77 3.78 2.96 2.81 2.71 2.60 2.04 1.63 1.59 1.43 1.38 1.36 1.29 1.28 1.20 1.18 1.16 1.08 1.07 1.02 1.01 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 P:z P:z P:z P:x P:y P:y P:y P:y P:y P:z P:x P:y P:z P:x P:z D:xz P:z P:y P:y P:x P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 90 52 75 69 63 44 81 76 64 89 80 77 63 53 73 28 40 74 54 29 45 S S S S S S S S S S S S S S S Mo S S S S S -7.269 2.00 927 A 4.87 2.85 2.78 2.44 2.15 1.79 1.76 1.73 1.68 1.60 1.48 1.48 1.38 1.34 1.24 1.17 1.04 2 2 2 2 2 2 1 2 2 2 2 1 1 2 2 2 2 P:z P:z P:z P:z P:z P:y D:yz P:y P:y P:z P:x D:yz D:yz P:z P:z P:y P:x -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 89 73 50 51 74 77 26 49 80 80 74 27 6 77 54 74 55 S S S S S S Mo S S S S Mo Mo S S S S -7.247 2.00 928 A 4.73 4.66 4.42 4.32 4.28 4.19 4.16 4.00 3.73 3.61 3.36 3.28 3.22 3.20 3.04 2.96 2.77 2.52 2.49 2.29 1.60 1.29 1.27 1.23 1.15 1.12 1.08 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:z P:z P:z P:y P:z P:z P:z P:z P:z P:y P:z P:z P:z P:z P:y P:x P:x P:x P:x P:x P:x P:x P:y P:x P:y P:z P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 127 113 121 124 113 110 111 115 127 125 125 130 120 131 117 115 127 113 125 115 111 128 121 126 110 132 123 123 O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.247 2.00 929 A 5.13 4.96 4.94 4.94 4.43 4.29 4.04 3.98 3.94 3.56 3.20 3.19 3.18 3.07 3.06 2.86 2.71 2.68 2.46 2.39 2.22 2.19 2.03 2.01 1.51 1.31 1.22 1.06 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:x P:x P:y P:x P:y P:x P:y P:y P:y P:x P:x P:x P:x P:x P:x P:y P:y P:y P:x P:y P:y P:y P:x P:x P:x P:y P:y P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 123 130 120 109 131 122 117 124 112 110 132 129 110 118 124 119 118 132 121 121 111 129 119 111 122 112 130 120 110 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.241 2.00 930 A 8.23 8.09 7.46 6.78 3.49 3.03 3.01 2.79 2.55 2.54 2.50 2.40 2.24 2.18 2.05 1.96 1.85 1.77 1.75 1.60 1.57 1.39 1.33 1.29 1.24 1.17 1.14 1.12 1.12 1.11 1.11 1.05 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:z P:z P:z P:y P:z P:y P:x P:z P:x P:z P:x P:z P:x P:y P:y P:y P:x P:y P:x P:y P:y P:y P:x P:x P:z P:y P:x P:z P:y P:z P:z P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 129 119 132 118 119 126 114 128 128 114 114 129 116 119 118 128 125 132 131 118 116 121 129 126 116 138 130 134 136 115 121 111 111 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.238 2.00 931 A 7.77 7.06 4.97 4.48 3.93 3.93 3.37 3.35 3.31 3.16 3.10 3.08 2.60 2.59 2.48 2.30 2.12 2.02 1.88 1.86 1.71 1.71 1.37 1.35 1.26 1.22 1.18 1.16 1.12 1.08 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:z P:z P:x P:y P:y P:y P:z P:z P:x P:y P:y P:z P:y P:y P:y P:y P:z P:y P:y P:x P:x P:z P:y P:z P:x P:x P:z P:x P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 116 126 122 109 125 126 113 127 123 112 115 116 140 116 125 112 115 142 128 122 109 130 134 120 123 131 144 120 138 109 121 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.237 2.00 932 A 5.85 4.73 4.47 3.94 3.50 3.36 3.23 3.11 3.10 3.01 2.94 2.85 2.81 2.76 2.70 2.66 2.34 2.29 2.16 2.06 2.01 1.93 1.87 1.73 1.59 1.37 1.36 1.30 1.28 1.25 1.19 1.10 1.08 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:z P:z P:y P:y P:y P:x P:y P:y P:y P:y P:z P:y P:y P:z P:y P:y P:y P:x P:x P:y P:y P:y P:z P:z P:z P:x P:y P:z P:x P:x P:x P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 114 128 123 112 125 143 115 127 127 109 128 113 122 141 123 109 112 114 124 126 113 110 122 121 124 111 114 133 116 136 115 116 135 126 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.235 2.00 933 A 5.44 5.01 4.84 4.39 4.28 3.85 3.60 3.59 3.03 2.93 2.78 2.67 2.55 2.54 2.23 2.16 2.11 2.02 2.01 1.99 1.96 1.77 1.70 1.50 1.45 1.38 1.27 1.24 1.24 1.22 1.14 1.14 1.10 1.08 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:z P:z P:z P:x P:x P:z P:x P:z P:y P:z P:z P:x P:x P:z P:x P:z P:z P:y P:x P:y P:x P:y P:x P:x P:y P:x P:y P:y P:y P:x P:y P:x P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 117 131 117 130 120 131 120 132 139 111 137 121 130 129 124 118 110 111 122 111 121 128 110 110 133 128 119 117 112 115 114 124 135 123 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.232 2.00 934 A 2.52 2.50 2.16 1.97 1.91 1.90 1.78 1.75 1.70 1.58 1.34 1.28 1.28 1.25 1.18 1.04 1.03 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 1 2 P:x P:z P:y P:y P:y P:z P:y P:z P:x D:xy P:z P:x P:y P:z P:z D:xz P:y -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 80 75 40 51 31 90 43 69 45 6 52 44 68 45 85 4 97 S S S S S S S S S Mo S S S S S Mo S -7.216 2.00 935 A 5.33 4.68 3.31 2.58 2.44 1.90 1.80 1.52 1.50 1.43 1.38 1.37 1.33 1.27 1.26 1.24 1.15 1.07 1.07 1.04 2 2 2 2 1 2 2 2 2 1 1 2 2 2 2 2 2 2 1 2 P:z P:z P:z P:z D:yz P:z P:z P:y P:z D:xz D:xz P:z P:z P:z P:z P:x P:z P:x D:xz P:y -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 89 90 51 74 27 59 35 80 69 27 28 29 47 31 45 75 63 42 23 79 S S S S Mo S S S S Mo Mo S S S S S S S Mo S -7.177 2.00 936 A 2.85 2.25 2.01 1.99 1.78 1.78 1.62 1.61 1.56 1.52 1.41 1.34 1.32 1.28 1.17 1.16 1.14 1.13 1.11 1.02 2 1 2 1 2 1 2 2 1 2 2 2 2 2 1 2 2 1 2 2 P:y D:xy P:y D:xy P:y D:x2-y2 P:y P:y D:yz P:y P:x P:x P:x P:y D:x2-y2 P:y P:y D:x2-y2 P:x P:y -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 79 20 59 7 31 18 77 73 4 50 37 63 38 80 9 35 65 1 68 67 S Mo S Mo S Mo S S Mo S S S S S Mo S S Mo S S -7.152 2.00 937 A 4.77 4.27 1.97 1.85 1.74 1.67 1.57 1.52 1.46 1.44 1.36 1.26 1.23 1.20 1.17 1.11 1.09 1.05 1.05 1.04 1.00 2 2 2 1 2 1 2 2 2 2 1 2 2 1 1 1 2 2 2 1 2 P:y P:y P:x D:x2-y2 P:y D:x2-y2 P:x P:z P:z P:x D:xy P:z P:z D:xy D:x2-y2 D:xy P:x P:z P:x D:yz P:z -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 82 77 29 16 73 4 61 40 63 37 18 77 89 22 18 20 42 90 32 1 80 S S S Mo S Mo S S S S Mo S S Mo Mo Mo S S S Mo S -7.129 2.00 938 A 6.74 6.10 4.58 4.39 3.24 2.26 2.06 2.02 1.57 1.48 1.35 1.21 1.18 1.06 1.06 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 P:z P:z P:z P:z P:y P:y P:z D:yz P:x P:x P:z P:x P:x P:x P:x -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 63 40 35 59 62 35 69 15 34 38 45 39 45 80 40 S S S S S S S Mo S S S S S S S -7.118 2.00 939 A 4.94 4.03 2.99 2.07 2.05 1.98 1.82 1.48 1.47 1.41 1.41 1.40 1.33 1.33 1.23 1.22 1.19 1.19 1.17 1.12 1.10 1.09 1.03 1.03 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 2 1 2 2 2 1 P:x P:y P:y P:x P:y P:x P:x P:z P:z P:y D:x2-y2 P:z P:y P:z P:z P:z P:y P:y P:z D:x2-y2 P:z P:y P:y D:x2-y2 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -0.555 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 0.00 1.00 52 74 51 87 69 44 75 54 31 45 22 45 66 90 69 86 82 89 35 15 84 57 27 27 S S S S S S S S S S Mo S S S S S S S S Mo S S Mo Mo -7.097 2.00 940 A 3.17 3.16 2.16 2.08 1.88 1.83 1.82 1.70 1.61 1.59 1.52 1.46 1.45 1.43 1.35 1.31 1.24 1.18 1.18 1.15 1.15 1.08 1.00 2 2 2 2 2 2 2 1 2 1 1 2 2 1 2 2 2 2 1 2 2 2 1 P:x P:x P:y P:z P:x P:x P:z D:xy P:y D:x2-y2 D:xy P:z P:z D:xy P:y P:x P:x P:y D:x2-y2 P:x P:z P:x D:xy -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -0.555 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 0.00 1.33 1.00 1.33 1.33 1.33 1.00 62 81 59 90 35 57 40 14 32 5 11 59 63 7 38 32 13 39 3 39 49 61 5 S S S S S S S Mo S Mo Mo S S Mo S S Mo S Mo S S S Mo -7.068 2.00 941 A 4.31 3.19 3.16 2.84 2.13 2.13 2.05 2.03 2.02 2.02 1.82 1.81 1.67 1.63 1.52 1.46 1.39 1.30 1.29 1.13 1.01 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 1 1 2 2 1 2 P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:z P:z D:xz P:x P:z D:xz D:yz P:z P:z P:y P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -9.089 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 87 69 45 50 89 71 68 88 73 51 44 72 19 75 48 24 25 49 86 102 83 S S S S S S S S S S S S Mo S S Mo Mo S S O S -7.050 2.00 942 A 5.03 4.22 3.27 2.20 2.04 1.84 1.56 1.42 1.35 1.30 1.29 1.27 1.21 1.19 1.10 1.06 1.03 1.02 2 2 1 1 2 2 2 2 2 2 2 2 2 1 2 2 2 2 P:y P:z D:yz D:x2-y2 P:z P:y P:z P:z P:y P:z P:z P:z P:y D:yz P:z P:z P:z P:y -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 79 79 4 4 87 82 33 62 39 90 56 39 77 11 53 35 34 85 S S Mo Mo S S S S S S S S S Mo S S S S -7.046 2.00 943 A 3.26 2.42 2.34 1.97 1.91 1.89 1.81 1.70 1.70 1.70 1.60 1.55 1.46 1.39 1.30 1.16 1.03 2 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 1 P:z P:y D:z2 P:x P:z P:y P:x P:y P:z P:z P:y P:y P:y P:y P:z P:z D:yz -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 84 82 22 70 41 72 66 85 83 65 42 50 59 31 54 61 6 S S Mo S S S S S S S S S S S S S Mo -7.029 2.00 944 A 4.90 4.43 3.02 2.86 2.59 2.35 2.33 2.32 2.10 1.78 1.71 1.67 1.39 1.32 1.25 1.22 1.19 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 P:z P:z P:z P:z P:z P:y P:z P:z P:z P:z P:z P:z P:z P:z P:z D:yz P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 32 55 45 69 85 82 90 88 59 62 39 35 83 82 49 11 72 S S S S S S S S S S S S S S S Mo S -6.990 2.00 945 A 14.31 10.05 9.03 5.65 4.45 2.04 1.92 1.88 1.79 1.57 1.55 2 2 2 2 1 2 1 2 2 1 2 P:z P:z P:y P:x D:z2 P:z D:xy P:z P:x D:x2-y2 P:y -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -0.555 -3.733 -7.014 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 0.00 1.00 1.33 84 83 84 83 22 85 22 70 22 22 83 S S S S Mo S Mo S Mo Mo S -6.983 2.00 946 A 3.74 3.65 2.76 2.20 1.84 1.75 1.60 1.53 1.36 1.28 1.28 1.23 1.21 1.21 1.16 1.12 1.12 1.06 1.05 1.00 2 2 2 2 2 2 1 1 2 1 2 1 2 1 2 2 2 1 2 1 P:z P:z P:z P:z P:y P:z D:xz D:xz P:x D:yz P:z D:xz P:z D:xy P:z P:z P:y D:yz P:z D:xz -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 86 89 47 70 79 90 24 18 39 27 31 12 84 22 63 54 45 20 80 17 S S S S S S Mo Mo S Mo S Mo S Mo S S S Mo S Mo -6.955 2.00 947 A 7.09 5.45 2.92 2.10 1.86 1.72 1.41 1.39 1.28 1.28 1.19 1.19 1.16 1.15 1.14 1.07 1.06 1.05 1.04 1.02 2 2 2 2 2 2 2 1 2 2 2 1 2 1 2 2 2 2 2 2 P:z P:z P:z P:z P:z P:x P:y D:yz P:z P:y P:z D:xz P:x D:xy P:z P:z P:z P:y P:z P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 32 55 80 88 67 34 82 6 53 78 85 3 59 1 62 43 66 34 44 68 S S S S S S S Mo S S S Mo S Mo S S S S S S -6.943 2.00 948 A 3.24 3.08 2.19 2.02 1.98 1.68 1.60 1.57 1.48 1.48 1.40 1.39 1.39 1.32 1.16 1.14 1.13 1.04 1.02 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 P:x P:y P:y P:x P:x P:y P:z P:z P:x P:x P:y P:x P:z P:x P:z P:y P:x P:z P:x -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -0.555 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 43 88 61 50 74 87 88 86 69 48 56 86 40 72 72 31 19 43 73 S S S S S S S S S S S S S S S S Mo S S -6.918 2.00 949 A 3.42 3.37 3.35 3.34 3.32 3.27 3.24 3.15 3.12 3.10 3.10 3.08 3.04 3.00 2.98 2.98 2.91 2.90 2.89 2.70 2.34 2.28 2.27 2.25 2.17 2.14 2.12 2.09 2.06 2.05 1.97 1.86 1.84 1.71 1.69 1.60 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:y P:z P:y P:z P:z P:z P:z P:x P:z P:y P:x P:z P:z P:x P:y P:y P:y P:x P:x P:z P:z P:z P:z P:z P:z P:z P:y P:x P:z P:y P:x P:x P:y P:y P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 130 122 124 123 131 129 122 123 131 121 109 120 130 132 132 112 124 121 117 129 117 110 109 119 112 111 118 111 118 120 110 119 111 119 118 110 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.916 2.00 950 A 2.26 1.89 1.57 1.54 1.43 1.40 1.38 1.31 1.16 1.16 1.15 1.10 1.08 1.08 1.07 1.05 1.03 2 2 2 2 2 2 2 1 2 2 2 2 1 1 2 2 1 P:x P:x P:x P:y P:y P:y P:y D:x2-y2 P:y P:x P:y P:x D:z2 D:xy P:z P:z D:xy -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -0.555 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 68 73 50 62 49 45 14 13 35 75 32 44 15 19 89 31 11 S S S S S S Mo Mo S S S S Mo Mo S S Mo -6.914 2.00 951 A 5.30 5.19 4.87 4.83 3.82 3.80 3.69 3.50 2.86 2.84 2.70 2.63 2.19 1.99 1.98 1.95 1.70 1.57 1.54 1.29 1.18 1.08 1.06 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:y P:y P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x P:y P:y P:z P:z P:z P:z P:x P:z P:x P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 128 126 127 125 115 113 114 116 128 126 125 127 115 113 114 116 113 115 116 114 130 131 131 129 O O O O O O O O O O O O O O O O O O O O O O O O -6.890 2.00 952 A 3.73 2.72 2.64 2.40 2.00 1.93 1.79 1.67 1.62 1.56 1.37 1.33 1.31 1.30 1.26 1.26 1.20 1.20 1.13 1.12 1.09 1.06 1.03 1.00 2 2 2 2 1 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 P:z P:z P:y P:z D:yz P:x D:yz P:y P:z P:y P:x P:z P:z P:z P:z P:x P:z P:z P:z P:z P:z D:x2-y2 P:z P:x -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 80 31 78 54 6 77 2 29 55 32 34 88 78 38 59 57 65 68 32 56 37 2 35 45 S S S S Mo S Mo S S S S S S S S S S S S S S Mo S S -6.881 2.00 953 A 2.91 2.77 2.75 2.71 2.32 2.21 2.12 1.84 1.81 1.65 1.63 1.58 1.55 1.50 1.35 1.26 1.24 1.20 1.16 1.15 1.12 1.10 1.05 1.04 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 1 2 2 2 P:z P:z P:z P:z P:z P:z P:z P:z P:x P:z P:z P:x P:z P:x P:z P:z P:z P:x D:xz P:y D:xz P:z P:z P:y -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 43 67 44 88 33 62 68 56 56 59 35 48 87 63 61 39 34 37 7 81 13 38 47 85 S S S S S S S S S S S S S S S S S S Mo S Mo S S S -6.839 2.00 954 A 4.03 3.45 3.43 3.27 2.99 2.89 2.63 2.45 2.03 1.66 1.61 1.57 1.50 1.45 1.33 1.27 1.20 1.16 1.13 1.12 1.11 1.09 2 2 2 2 2 2 2 2 2 2 1 1 2 2 1 1 2 1 2 2 2 2 P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y D:xz D:yz P:x P:x D:yz D:yz P:x D:yz P:z P:y P:z P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 57 80 34 61 38 67 43 87 66 78 7 9 43 81 7 19 66 6 88 33 33 66 S S S S S S S S S S Mo Mo S S Mo Mo S Mo S S S S -6.833 2.00 955 A 3.17 3.01 2.83 2.57 1.57 1.55 1.50 1.49 1.38 1.33 1.32 1.29 1.28 1.26 1.16 1.10 1.08 1.04 2 2 2 2 2 2 1 2 2 2 2 1 2 2 2 2 2 1 P:z P:x P:y P:z P:z P:z D:x2-y2 P:z P:z P:y P:x D:xy P:y P:y P:x P:x P:z D:xz -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 83 67 82 85 39 62 7 32 57 66 37 19 78 42 42 70 55 17 S S S S S S Mo S S S S Mo S S S S S Mo -6.816 2.00 956 A 4.82 4.73 3.68 3.10 2.29 2.26 2.11 2.02 1.77 1.65 1.52 1.41 1.40 1.29 1.26 1.23 1.17 1.10 1.10 1.07 2 2 2 2 1 2 2 2 2 1 2 1 2 1 2 2 2 2 2 1 P:z P:z P:z P:z D:z2 P:z P:z P:z P:z D:yz P:y D:yz P:z P:z P:x P:x P:z P:y P:y D:xy -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 44 68 87 81 22 39 62 60 66 12 38 19 42 100 71 82 83 57 71 4 S S S S Mo S S S S Mo S Mo S O S S S S S Mo -6.800 2.00 957 A 3.83 2.99 2.37 2.05 1.88 1.87 1.86 1.62 1.48 1.44 1.43 1.36 1.33 1.29 1.19 1.15 1.14 1.12 1.12 1.11 1.08 1.06 1.04 1.02 2 2 2 1 2 2 2 2 2 2 2 2 1 1 2 2 2 2 2 1 2 2 2 2 P:z P:z P:z D:z2 P:y P:y P:z P:y P:y P:z P:x P:x D:x2-y2 P:z P:z P:z P:y P:x P:y D:x2-y2 P:x P:y P:z P:y -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -9.089 -7.014 -7.014 -7.014 -7.014 -0.555 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 0.00 1.00 1.33 1.33 1.33 1.33 83 86 39 22 57 81 85 44 71 44 74 56 22 100 55 62 70 65 20 16 42 83 47 82 S S S Mo S S S S S S S S Mo O S S S S Mo Mo S S S S -6.765 2.00 958 A 3.33 3.12 2.27 2.27 2.25 2.12 2.03 1.95 1.91 1.87 1.82 1.75 1.66 1.65 1.43 1.42 1.32 1.16 1.16 1.02 2 2 1 2 2 2 2 1 2 2 2 2 2 2 2 2 2 2 1 2 P:z P:z D:yz P:z P:y P:z P:z D:yz P:z P:x P:z P:z P:y P:y P:z P:z P:y P:y D:z2 P:y -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 81 86 18 39 37 85 62 11 34 77 45 69 65 43 42 57 78 72 22 34 S S Mo S S S S Mo S S S S S S S S S S Mo S -6.739 2.00 959 A 6.90 6.25 1.97 1.94 1.89 1.69 1.64 1.58 1.49 1.46 1.41 1.40 1.39 1.34 1.34 1.24 1.21 1.19 1.08 1.07 1.04 1.03 1.01 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 P:z P:z P:z P:z P:z P:y P:z D:xy P:z P:y P:y P:x P:x P:z P:z P:z P:x D:xz P:z P:x P:x P:z P:y -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 89 88 43 42 80 44 84 4 67 49 51 38 66 60 66 50 53 26 85 79 77 70 78 S S S S S S S Mo S S S S S S S S S Mo S S S S S -6.731 2.00 960 A 3.69 2.12 2.05 1.78 1.73 1.66 1.66 1.62 1.57 1.54 1.53 1.51 1.48 1.47 1.44 1.40 1.31 1.27 1.26 1.24 1.10 1.10 1.09 1.08 1.06 1.05 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 2 2 1 2 2 2 P:z P:y P:z P:z P:x P:x P:z P:x P:z P:z P:y P:z D:xz P:z P:y P:z P:z P:z P:z P:z P:x P:z D:yz P:z P:z P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 89 68 66 73 51 32 56 66 88 33 72 31 4 86 34 59 67 29 42 35 60 55 7 68 45 43 S S S S S S S S S S S S Mo S S S S S S S S S Mo S S S -6.724 2.00 961 A 5.52 4.55 3.58 3.17 2.49 2.18 2.07 2.03 1.96 1.63 1.58 1.36 1.36 1.28 1.23 1.13 1.07 1.04 1.04 1.01 2 2 2 2 2 2 2 2 1 2 2 1 2 2 2 2 2 1 2 2 P:z P:z P:z P:z P:z P:z P:y P:z D:z2 P:z P:x D:xz P:z P:x P:x P:z P:z D:xz P:z P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 89 87 85 61 38 59 48 35 22 42 72 12 74 77 57 66 51 25 32 40 S S S S S S S S Mo S S Mo S S S S S Mo S S -6.693 2.00 962 A 4.64 3.50 3.34 2.76 2.24 2.18 2.04 1.92 1.62 1.60 1.37 1.37 1.26 1.22 1.22 1.20 1.11 1.07 1.07 1.06 1.04 1.04 2 2 2 1 2 2 2 2 2 1 2 2 1 2 2 2 1 2 2 2 2 1 P:x P:y P:z D:z2 P:z P:x P:z P:z P:y P:z P:z P:y D:x2-y2 P:x P:y P:y D:x2-y2 P:y P:z P:z P:y D:x2-y2 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -9.089 -7.014 -7.014 -3.733 -0.555 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 0.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 84 70 89 22 81 65 83 80 82 100 87 43 24 16 66 48 25 39 69 40 71 12 S S S Mo S S S S S O S S Mo Mo S S Mo S S S S Mo -6.676 2.00 963 A 4.50 3.68 2.76 2.61 2.57 2.49 2.17 2.14 2.13 1.88 1.85 1.81 1.78 1.50 1.49 1.47 1.44 1.38 1.33 1.31 1.25 1.17 1.12 1.04 1.04 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 P:z P:z P:z P:z P:z P:y P:z P:z P:z P:z P:x P:z P:z P:y P:y P:z P:z P:z P:z P:y P:z P:z P:y P:x P:y -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 88 89 85 34 87 78 48 32 71 57 50 86 45 57 82 69 55 63 40 38 70 81 72 62 62 S S S S S S S S S S S S S S S S S S S S S S S S S -6.655 2.00 964 A 3.75 3.51 3.48 3.07 2.22 1.99 1.87 1.66 1.59 1.37 1.35 1.34 1.24 1.24 1.10 1.09 1.09 1.03 1.01 2 2 1 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 2 P:z P:z D:z2 P:x P:x P:y P:y P:z P:y P:x P:x P:z D:yz P:y P:y P:y P:y P:x P:y -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -0.555 -7.014 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 0.00 1.33 81 86 22 73 33 49 61 88 34 84 88 38 11 84 60 44 38 12 67 S S Mo S S S S S S S S S Mo S S S S Mo S -6.636 2.00 965 A 12.25 4.89 3.45 1.92 1.66 1.54 1.53 1.43 1.41 1.17 1.09 1.07 1.05 1.01 2 1 2 2 2 2 2 2 2 2 2 2 2 2 P:x D:xy P:z P:x P:y P:z P:y P:z P:y P:y P:z P:z P:y P:z -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 77 1 85 54 77 56 83 57 78 79 54 78 81 53 S Mo S S S S S S S S S S S S -6.606 2.00 966 A 2.88 2.46 2.21 2.17 2.14 1.93 1.86 1.86 1.86 1.71 1.70 1.64 1.53 1.52 1.46 1.37 1.28 1.16 1.16 1.09 1.06 1.05 1.02 1.01 1.01 2 1 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 P:z D:z2 P:x P:z P:y P:z P:z P:z P:y P:z P:z P:z P:z P:z P:y P:z P:x P:x P:y P:z P:x P:y P:z D:x2-y2 P:x -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 29 22 49 56 78 82 77 53 86 44 68 86 81 66 31 42 70 66 77 33 71 83 35 24 51 S Mo S S S S S S S S S S S S S S S S S S S S S Mo S -6.566 2.00 967 A 4.74 3.86 3.24 2.79 2.56 1.98 1.86 1.85 1.76 1.69 1.57 1.39 1.35 1.34 1.27 1.24 1.21 1.20 1.18 1.17 1.15 1.14 1.14 1.07 1.05 2 2 2 1 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 1 2 2 2 1 2 P:z P:z P:z D:z2 P:z P:x P:x P:x P:z P:z P:x P:z P:z P:z D:xy P:z P:y P:z P:y P:z P:z P:z P:y D:z2 P:x -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -9.089 -7.014 -7.014 -7.014 -3.733 -7.014 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 77 79 29 1 84 81 31 78 82 70 29 51 74 59 11 53 77 62 79 101 89 34 53 16 66 S S S Mo S S S S S S S S S S Mo S S S S O S S S Mo S -6.543 2.00 968 A 7.58 2.78 2.12 2.00 2.00 1.99 1.90 1.88 1.85 1.75 1.71 1.67 1.65 1.63 1.60 1.56 1.51 1.31 1.16 1.14 1.07 1.04 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 1 2 2 2 2 P:z P:z P:y P:x P:z P:x P:z P:y P:x P:z P:z P:z D:z2 P:z P:y P:z P:z D:x2-y2 P:x P:y P:x P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 85 79 60 50 88 83 47 82 48 83 65 48 4 70 71 41 80 22 38 83 72 33 S S S S S S S S S S S S Mo S S S S Mo S S S S -6.496 2.00 969 A 11.84 5.06 3.22 2.49 1.86 1.77 1.63 1.51 1.43 1.41 1.38 1.38 1.33 1.24 1.23 1.17 1.15 2 1 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 P:x D:xy P:z P:z P:y P:y P:z P:x P:z P:y P:x P:z D:x2-y2 P:x P:z P:z P:x -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 77 1 80 85 78 82 86 72 77 86 42 68 2 37 53 34 74 S Mo S S S S S S S S S S Mo S S S S -6.480 2.00 970 A 4.78 4.23 4.05 3.75 3.75 2.61 2.33 1.86 1.81 1.74 1.73 1.59 1.58 1.41 1.32 1.27 1.13 1.10 1.04 1.02 1.01 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:z P:x P:z P:x P:y P:x P:x P:x P:z P:z P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 57 74 34 51 38 61 87 63 40 82 86 60 44 31 33 51 61 43 48 71 73 S S S S S S S S S S S S S S S S S S S S S -6.456 2.00 971 A 6.96 6.92 3.82 3.75 3.55 3.21 2.82 2.68 2.59 2.15 1.89 1.66 1.47 1.44 1.37 1.27 1.25 1.24 1.23 1.12 1.09 1.04 1.02 1.02 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 2 2 2 P:z P:z P:z P:z P:x P:z P:z P:z P:y P:x P:z P:x P:x D:xz P:z P:x P:z P:z P:y P:z P:z P:y P:y P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 87 86 37 60 33 80 66 42 65 77 81 65 42 24 73 37 50 48 82 55 71 81 78 32 S S S S S S S S S S S S S Mo S S S S S S S S S S -6.448 2.00 972 A 5.18 4.70 4.18 4.16 3.22 3.02 2.92 2.09 1.60 1.52 1.28 1.19 1.19 1.18 1.12 1.09 1.04 1.03 1.02 1.00 1.00 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:x P:x P:z P:x P:z P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 67 86 43 85 34 87 57 35 59 84 31 83 79 83 54 39 44 79 68 68 44 S S S S S S S S S S S S S S S S S S S S S -6.436 2.00 973 A 4.95 4.44 4.31 4.19 3.85 3.47 2.62 2.29 2.10 1.97 1.92 1.78 1.73 1.54 1.21 1.20 1.17 1.09 1.09 1.06 1.01 1 2 2 1 2 2 1 2 2 2 2 1 2 2 1 2 1 1 2 1 2 D:x2-y2 P:y P:y D:x2-y2 P:x P:y D:x2-y2 P:x P:x P:x P:x D:z2 P:x P:y D:xy P:z D:xy D:xy P:x D:z2 P:x -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.33 28 89 90 27 89 87 25 51 87 49 90 28 47 83 16 39 18 27 41 21 71 Mo S S Mo S S Mo S S S S Mo S S Mo S Mo Mo S Mo S -6.405 2.00 974 A 3.39 2.76 2.51 2.26 2.21 2.09 1.84 1.77 1.75 1.71 1.66 1.60 1.57 1.44 1.30 1.24 1.22 1.19 1.16 1.10 1.09 2 2 2 1 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 P:y P:x P:y D:xy P:z P:y P:x P:z P:z P:z P:x P:z P:z P:x P:z D:z2 P:z P:z P:y P:x P:y -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 33 80 79 6 62 37 61 81 42 68 77 88 44 73 39 4 50 86 66 72 34 S S S Mo S S S S S S S S S S S Mo S S S S S -6.320 2.00 975 A 7.97 6.37 6.28 4.24 1.71 1.61 1.58 1.56 1.52 1.42 1.30 1.28 1.24 1.20 1.14 1.07 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 P:z P:z P:z P:y P:z P:x P:z P:z P:y P:z P:z P:z P:y P:z P:y P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 74 51 88 78 85 84 89 42 50 84 82 66 60 80 37 67 S S S S S S S S S S S S S S S S -6.297 2.00 976 A 5.64 5.02 4.60 2.70 2.53 2.31 2.26 1.99 1.72 1.61 1.49 1.39 1.38 1.22 1.18 1.08 1.06 1.06 1.04 2 2 2 2 1 2 2 2 2 2 2 2 2 2 2 1 1 1 2 P:z P:y P:z P:x D:x2-y2 P:z P:x P:z P:z P:z P:x P:z P:z P:z P:z D:xy D:xy D:z2 P:y -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 51 78 74 82 2 88 77 80 31 54 54 72 56 49 89 16 1 1 85 S S S S Mo S S S S S S S S S S Mo Mo Mo S -6.251 2.00 977 A 4.85 3.71 2.55 2.36 2.23 2.21 2.07 1.92 1.90 1.80 1.57 1.52 1.50 1.47 1.47 1.41 1.41 1.40 1.31 1.29 1.26 1.20 1.18 1.14 1.14 1.11 1.07 1.04 1.00 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 1 1 2 1 2 2 2 2 2 2 2 2 1 P:x P:y P:x P:z P:z P:z P:y P:y P:y P:x P:x D:x2-y2 P:y P:z P:z P:x D:xy D:z2 P:y D:x2-y2 P:x P:y P:y P:y P:z P:z P:y P:y D:z2 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 82 86 83 80 31 41 60 78 85 86 61 24 84 54 79 81 16 16 49 27 33 72 56 79 82 83 82 37 28 S S S S S S S S S S S Mo S S S S Mo Mo S Mo S S S S S S S S Mo -6.236 2.00 978 A 4.79 4.19 3.43 3.38 2.82 2.63 2.51 2.18 2.11 1.93 1.83 1.70 1.65 1.61 1.53 1.52 1.51 1.47 1.43 1.37 1.34 1.33 1.30 1.09 1.06 1.03 2 2 2 1 1 2 2 2 2 1 2 2 2 1 2 2 2 2 2 2 1 2 2 2 2 2 P:x P:z P:z D:z2 D:z2 P:z P:y P:x P:z D:xy P:x P:y P:z D:xy P:y P:y P:z P:z P:x P:y P:z P:z P:y P:z P:x P:x -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -9.089 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 81 33 79 1 4 77 37 78 39 16 71 41 56 2 56 85 43 67 47 65 104 62 54 74 41 82 S S S Mo Mo S S S S Mo S S S Mo S S S S S S O S S S S S -6.207 2.00 979 A 5.25 3.91 3.57 3.34 2.85 2.73 2.34 2.22 2.21 2.07 1.96 1.90 1.84 1.73 1.67 1.52 1.48 1.48 1.41 1.30 1.21 1.17 1.13 1.12 1.12 1.07 1.01 1.00 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 2 2 2 1 1 2 2 2 2 P:z P:x P:z P:y P:z P:z P:z P:y P:z P:z P:x P:z P:z P:x P:z P:y D:xy P:y P:y P:x P:x P:y D:xy D:z2 P:z P:y P:z P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 61 81 43 60 38 67 80 56 54 39 49 65 62 79 87 79 11 78 41 72 73 82 4 1 31 49 41 74 S S S S S S S S S S S S S S S S Mo S S S S S Mo Mo S S S S -6.187 2.00 980 A 16.91 5.25 4.02 3.24 2.47 2.35 2.27 2.05 1.93 1.67 1.66 1.55 1.43 1.39 1.38 1.36 1.25 1.16 1.08 2 2 2 2 2 2 2 2 2 2 2 2 2 2 1 2 2 1 2 P:z P:z P:z P:x P:x P:z P:z P:y P:z P:z P:y P:z P:x P:z D:z2 P:x P:z D:z2 P:z -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -0.555 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 81 65 41 71 82 42 66 47 60 37 81 11 38 47 15 37 82 4 79 S S S S S S S S S S S Mo S S Mo S S Mo S -6.184 2.00 981 A 3.79 3.18 3.08 2.55 2.01 1.93 1.88 1.77 1.62 1.61 1.60 1.50 1.36 1.29 1.22 1.17 1.14 1.12 1.10 1.06 1.05 1.04 1 2 2 2 2 2 2 1 1 1 1 2 1 2 2 1 1 2 2 2 2 1 D:z2 P:z P:z P:x P:z P:x P:z D:z2 D:xy D:z2 D:z2 P:x D:x2-y2 P:y P:x D:xy D:xy P:x P:z P:x P:z D:xy -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 8 80 33 80 56 77 38 14 6 1 21 81 5 82 78 11 10 34 60 84 47 3 Mo S S S S S S Mo Mo Mo Mo S Mo S S Mo Mo S S S S Mo -6.156 2.00 982 A 8.73 4.07 3.40 2.90 2.25 2.15 1.86 1.83 1.63 1.60 1.58 1.53 1.46 1.42 1.41 1.39 1.23 1.18 1.17 1.15 1.01 1 1 1 1 2 2 1 1 1 2 2 1 2 2 2 2 1 1 1 1 2 D:z2 D:x2-y2 D:xy D:x2-y2 P:x P:y D:z2 D:xy D:z2 P:z P:z D:z2 P:z P:y P:x P:z D:z2 D:xy D:x2-y2 D:x2-y2 P:x -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 15 14 20 20 44 89 21 15 9 81 72 10 86 78 74 49 14 21 15 10 62 Mo Mo Mo Mo S S Mo Mo Mo S S Mo S S S S Mo Mo Mo Mo S -6.142 2.00 983 A 5.08 4.22 2.64 2.58 2.51 2.40 2.35 1.90 1.81 1.77 1.74 1.59 1.51 1.43 1.22 1.19 1.18 1.17 1.11 1.09 1.05 1.03 1.03 1 1 1 1 1 1 2 2 1 1 1 2 1 2 2 2 2 2 1 2 2 1 1 D:z2 D:x2-y2 D:z2 D:z2 D:z2 D:z2 P:x P:x D:x2-y2 D:z2 D:x2-y2 P:x D:xy P:y P:z P:z P:x P:y D:z2 P:z P:y D:xy D:xy -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.00 10 9 21 14 28 20 80 84 14 8 21 82 10 33 80 47 57 56 5 84 83 28 4 Mo Mo Mo Mo Mo Mo S S Mo Mo Mo S Mo S S S S S Mo S S Mo Mo -6.100 2.00 984 A 7.67 5.61 5.34 5.19 4.78 3.07 2.84 2.41 2.13 2.04 1.91 1.49 1.36 1.31 1.30 1.27 1.26 1.23 1.22 1.11 1 2 2 2 2 2 2 1 1 2 2 2 1 2 1 2 2 2 2 1 D:z2 P:z P:y P:z P:z P:z P:y P:z D:xy P:z P:z P:z D:xy P:x D:z2 P:z P:z P:z P:z D:xy -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -9.089 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1 72 77 49 77 86 78 104 3 87 33 78 1 77 15 53 79 29 80 2 Mo S S S S S S O Mo S S S Mo S Mo S S S S Mo -6.063 2.00 985 A 11.13 9.37 3.78 3.49 3.41 3.17 2.13 1.94 1.78 1.66 1.60 1.38 1.29 1.17 1.17 1.12 2 2 2 2 2 2 2 1 2 2 2 2 2 2 2 2 P:z P:z P:z P:z P:z P:z P:y D:z2 P:z P:y P:y P:z P:y P:y P:z P:y -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 49 72 86 87 80 33 78 1 56 77 42 85 65 48 67 71 S S S S S S S Mo S S S S S S S S -6.019 2.00 986 A 6.66 4.10 3.63 3.08 2.60 2.37 2.28 2.08 1.80 1.61 1.59 1.52 1.49 1.47 1.43 1.43 1.39 1.20 1.19 1.18 1.17 1.15 1.10 1.09 1.04 1 1 1 1 2 1 1 1 2 2 1 2 1 1 2 1 1 2 2 1 2 2 1 1 2 D:z2 D:z2 D:z2 D:z2 P:x D:xy D:x2-y2 D:x2-y2 P:y P:x D:x2-y2 P:z D:xy D:z2 P:z D:z2 D:xy P:x P:x D:x2-y2 P:y P:y D:x2-y2 D:z2 P:z -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.33 28 8 20 21 84 28 27 5 87 83 21 77 8 16 82 3 9 82 89 26 90 83 25 9 72 Mo Mo Mo Mo S Mo Mo Mo S S Mo S Mo Mo S Mo Mo S S Mo S S Mo Mo S -5.964 2.00 987 A 5.80 5.71 5.13 4.16 3.82 3.17 2.76 2.73 2.23 1.74 1.60 1.53 1.49 1.41 1.41 1.37 1.25 1.22 1.18 1.16 1.13 1.08 2 2 2 1 1 1 1 2 1 1 1 2 1 1 1 1 2 2 1 2 1 1 P:x P:x P:y D:z2 D:z2 D:z2 D:xy P:z D:xy D:xy D:xy P:z D:z2 D:xy D:x2-y2 D:z2 P:z P:z D:z2 P:z D:z2 P:x -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -9.089 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.33 79 78 79 14 9 4 14 56 4 2 10 34 7 20 9 13 77 78 19 31 10 103 S S S Mo Mo Mo Mo S Mo Mo Mo S Mo Mo Mo Mo S S Mo S Mo O -5.917 2.00 988 A 3.72 3.05 3.03 2.95 2.84 2.74 2.58 2.57 2.18 2.17 2.13 1.73 1.62 1.57 1.55 1.55 1.54 1.46 1.28 1.25 1.11 1.04 1 1 1 2 2 2 2 2 2 1 2 1 1 1 2 2 2 2 1 1 1 1 D:z2 D:z2 D:xy P:z P:y P:y P:z P:x P:x D:x2-y2 P:x D:x2-y2 D:z2 D:x2-y2 P:y P:z P:x P:z D:z2 D:z2 D:z2 D:xy -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 14 3 5 84 79 78 56 78 84 5 79 9 4 10 84 47 82 81 9 8 28 3 Mo Mo Mo S S S S S S Mo S Mo Mo Mo S S S S Mo Mo Mo Mo -5.899 2.00 989 A 10.58 6.26 5.49 4.87 3.97 3.91 2.93 2.82 2.44 2.43 2.16 1.99 1.60 1.53 1.32 1.28 1.24 1.10 1.06 1.02 2 2 2 2 2 2 1 2 2 1 2 2 1 1 1 1 2 2 2 2 P:x P:y P:z P:z P:z P:z D:xy P:z P:x D:z2 P:x P:y D:z2 D:x2-y2 D:xy D:z2 P:x P:z P:y P:x -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -0.555 -7.014 -7.014 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 0.00 1.33 1.33 84 83 84 70 47 83 4 80 81 3 79 82 9 5 5 8 83 22 47 48 S S S S S S Mo S S Mo S S Mo Mo Mo Mo S Mo S S -5.882 2.00 990 A 5.41 4.79 4.73 4.55 3.23 3.23 3.01 2.50 1.94 1.74 1.56 1.48 1.38 1.34 1.30 1.30 1.30 1.25 1.18 1.15 1.09 1.08 1.03 1 1 1 1 1 1 1 2 1 2 2 1 2 2 1 2 1 2 1 2 2 1 1 D:z2 D:xy D:z2 D:x2-y2 D:xy D:z2 D:z2 P:x D:x2-y2 P:y P:x D:x2-y2 P:z P:z D:z2 P:x D:xy P:x D:x2-y2 P:z P:x D:z2 D:x2-y2 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 13 14 19 13 19 20 10 82 14 89 79 9 73 82 18 39 4 86 21 50 62 17 19 Mo Mo Mo Mo Mo Mo Mo S Mo S S Mo S S Mo S Mo S Mo S S Mo Mo -5.815 2.00 991 A 7.10 4.79 4.46 4.09 3.97 3.09 3.07 3.06 3.05 2.97 2.38 1.80 1.68 1.57 1.48 1.29 1.28 1.18 1.14 1.14 1.13 1.09 1 1 1 1 1 1 1 1 1 2 2 1 1 2 1 2 1 1 1 2 2 1 D:xy D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 P:z P:z D:z2 D:z2 P:y D:xy P:z D:xy D:z2 D:xy P:z P:x D:z2 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 9 5 19 7 13 7 2 15 13 77 78 8 14 78 3 31 13 9 18 68 34 3 Mo Mo Mo Mo Mo Mo Mo Mo Mo S S Mo Mo S Mo S Mo Mo Mo S S Mo -5.800 2.00 992 A 4.82 3.79 3.47 3.18 3.16 2.38 2.23 2.00 1.87 1.76 1.60 1.48 1.46 1.42 1.39 1.36 1.36 1.33 1.28 1.26 1.23 1.22 1.20 1.15 1.14 1.06 1.03 1.03 1.01 1 1 1 1 1 1 1 1 1 1 2 1 2 2 1 1 2 1 1 1 2 2 2 2 1 2 1 1 2 D:z2 D:z2 D:z2 D:xy D:z2 D:xy D:x2-y2 D:z2 D:x2-y2 D:z2 P:y D:z2 P:x P:z D:x2-y2 D:xy P:y D:z2 D:xy D:x2-y2 P:z P:z P:z P:z D:xy P:z D:z2 D:x2-y2 P:x -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 12 7 19 13 13 18 12 2 5 18 79 8 79 82 18 4 82 5 20 4 77 56 78 39 7 62 20 20 85 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo S S Mo Mo S Mo Mo Mo S S S S Mo S Mo Mo S -5.745 2.00 993 A 6.66 4.47 4.09 3.30 2.93 2.77 2.72 2.71 2.68 2.64 1.96 1.71 1.69 1.49 1.43 1.41 1.26 1.25 1.18 1.16 1.16 1.16 1.13 1.06 1 1 2 1 1 1 1 1 1 1 1 2 1 2 1 2 1 1 2 1 1 1 1 2 D:z2 D:z2 P:z D:xy D:z2 D:z2 D:z2 D:xy D:x2-y2 D:x2-y2 D:z2 P:y D:z2 P:x D:xy P:y D:z2 D:xy P:z D:xy D:x2-y2 D:xy D:z2 P:y -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 14 13 82 19 5 20 10 15 7 10 25 84 16 85 8 89 21 17 62 9 13 21 26 82 Mo Mo S Mo Mo Mo Mo Mo Mo Mo Mo S Mo S Mo S Mo Mo S Mo Mo Mo Mo S -5.740 2.00 994 A 10.45 4.16 4.04 4.01 3.97 3.90 3.27 2.84 2.74 2.53 2.18 2.08 1.90 1.86 1.57 1.47 1.33 1.22 1.20 1.08 1.08 1.07 1 1 1 1 1 1 1 1 1 2 1 2 2 1 1 1 1 1 1 2 1 2 D:z2 D:z2 D:x2-y2 D:xy D:z2 D:x2-y2 D:xy D:x2-y2 D:z2 P:x D:z2 P:z P:z D:z2 D:x2-y2 D:z2 D:xy D:xy D:z2 P:y D:z2 P:z -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 9 5 8 13 10 3 10 7 3 78 12 77 57 19 15 2 5 2 8 79 28 78 Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo S S Mo Mo Mo Mo Mo Mo S Mo S -5.669 2.00 995 A 5.00 3.63 3.11 2.45 2.42 2.21 2.11 2.04 1.96 1.81 1.68 1.61 1.57 1.54 1.51 1.49 1.45 1.44 1.33 1.27 1.26 1.25 1.13 1.12 1.07 1.02 1 1 1 2 1 1 2 1 1 1 1 1 1 1 1 2 1 1 2 1 2 1 2 2 2 1 D:z2 D:x2-y2 D:x2-y2 P:x D:z2 D:xy P:x D:x2-y2 D:z2 D:x2-y2 D:z2 D:xy D:z2 D:xy D:z2 P:x D:z2 D:x2-y2 P:y D:x2-y2 P:z D:xy P:x P:z P:x D:z2 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.00 21 19 7 80 27 7 82 9 2 20 18 20 14 6 9 88 15 21 79 17 52 5 38 75 79 4 Mo Mo Mo S Mo Mo S Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo S Mo S Mo S S S Mo -5.629 2.00 996 A 7.00 5.85 3.60 3.59 2.46 2.34 2.19 2.11 1.97 1.95 1.95 1.63 1.52 1.44 1.25 1.15 1.10 1.09 1.06 1.05 1.05 1.00 2 1 1 2 1 1 1 1 1 2 2 1 1 2 1 2 2 1 1 2 1 1 P:x D:z2 D:z2 P:x D:z2 D:xy D:z2 D:z2 D:z2 P:z P:y D:xy D:x2-y2 P:z D:xy P:z P:y D:x2-y2 D:xy P:z D:xy D:z2 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 78 3 8 82 21 2 14 5 7 82 77 16 5 77 5 83 84 1 8 61 19 6 S Mo Mo S Mo Mo Mo Mo Mo S S Mo Mo S Mo S S Mo Mo S Mo Mo -5.609 2.00 997 A 10.31 5.83 4.82 3.84 3.52 3.41 2.82 2.74 2.13 2.11 1.87 1.63 1.36 1.36 1.36 1.32 1.29 1.28 1.21 1.21 1.21 1.18 1.18 1.04 1.02 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 1 2 1 2 1 1 1 2 D:z2 D:xy D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:xy D:x2-y2 D:z2 D:x2-y2 D:z2 P:z P:z D:z2 D:z2 P:z D:z2 P:z D:z2 P:x D:z2 D:z2 D:x2-y2 P:y -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.33 15 21 20 27 28 10 19 28 15 3 21 21 74 51 7 19 82 2 78 12 87 18 10 1 89 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S S Mo Mo S Mo S Mo S Mo Mo Mo S -5.593 2.00 998 A 4.74 4.32 3.61 3.51 3.27 3.07 3.07 2.71 2.45 2.12 1.97 1.85 1.65 1.64 1.58 1.47 1.41 1.40 1.39 1.39 1.28 1.22 1.17 1.09 1.03 1 1 2 1 1 1 2 1 1 2 2 2 1 1 1 1 2 2 1 2 1 1 1 1 2 D:z2 D:z2 P:y D:z2 D:z2 D:x2-y2 P:y D:z2 D:z2 P:z P:x P:x D:z2 D:z2 D:z2 D:xy P:x P:z D:xy P:z D:x2-y2 D:z2 D:x2-y2 D:x2-y2 P:y -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 27 18 84 17 28 17 82 9 23 82 82 83 21 19 13 28 81 52 7 75 12 5 20 16 85 Mo Mo S Mo Mo Mo S Mo Mo S S S Mo Mo Mo Mo S S Mo S Mo Mo Mo Mo S -5.517 2.00 999 A 11.03 6.53 4.90 3.34 3.25 3.18 2.98 2.70 1.88 1.86 1.78 1.61 1.56 1.49 1.45 1.34 1.15 1.13 1.13 1.12 1.11 1.07 2 2 2 1 1 2 1 1 1 1 1 2 1 2 2 2 1 1 2 1 1 2 P:x P:x P:y D:z2 D:z2 P:z D:z2 D:z2 D:x2-y2 D:x2-y2 D:xy P:y D:x2-y2 P:x P:z P:y D:z2 D:z2 P:x D:x2-y2 D:xy P:z -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.33 83 82 84 3 20 78 12 2 1 15 21 77 17 47 82 86 8 27 78 8 16 47 S S S Mo Mo S Mo Mo Mo Mo Mo S Mo S S S Mo Mo S Mo Mo S -5.512 2.00 1000 A 5.86 5.79 3.67 3.41 3.14 2.80 2.57 2.54 2.50 1.98 1.94 1.87 1.65 1.64 1.54 1.54 1.37 1.22 1.15 1.15 1.14 1.11 1.09 1.09 1.08 1.03 1.01 1 1 2 1 1 1 1 1 1 2 1 1 2 1 1 1 1 1 2 2 2 1 1 1 1 1 2 D:x2-y2 D:z2 P:z D:z2 D:xy D:xy D:x2-y2 D:xy D:z2 P:y D:xy D:z2 P:y D:xy D:z2 D:x2-y2 D:z2 D:x2-y2 P:x P:z P:x D:z2 D:x2-y2 D:z2 D:xy D:x2-y2 P:x -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 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1002 A 7.27 5.98 5.33 5.04 3.89 3.89 3.33 2.95 1.98 1.96 1.87 1.72 1.63 1.50 1.45 1.31 1.22 1.16 1.10 1.01 1 1 1 1 1 1 1 2 1 1 1 1 2 2 2 1 1 1 1 1 D:z2 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:z2 P:x D:xy D:x2-y2 D:x2-y2 D:xy P:x P:x P:x D:x2-y2 D:z2 D:z2 D:x2-y2 D:x2-y2 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 17 20 10 15 27 21 19 83 8 15 19 18 86 82 78 10 9 18 11 16 Mo Mo Mo Mo Mo Mo Mo S Mo Mo Mo Mo S S S Mo Mo Mo Mo Mo -5.380 2.00 1003 A 9.17 9.07 4.82 3.24 2.85 2.84 2.46 2.38 2.22 2.03 1.93 1.82 1.77 1.73 1.45 1.34 1.21 1.17 1.17 1.12 1.00 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 2 D:z2 D:z2 D:z2 D:z2 P:y D:z2 D:z2 D:xy D:xy D:xy D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:x2-y2 D:xy P:z D:x2-y2 P:z P:y P:z -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 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2.57 2.53 2.24 2.17 2.10 2.07 1.99 1.90 1.83 1.77 1.72 1.61 1.59 1.56 1.52 1.51 1.46 1.43 1.35 1.12 1.09 1.07 1.04 2 2 2 1 2 1 1 1 1 1 1 1 2 2 1 2 1 1 1 2 2 2 1 1 1 1 1 2 P:y P:y P:x D:z2 P:y D:z2 D:z2 D:x2-y2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:y D:x2-y2 P:x D:z2 D:x2-y2 D:xy P:z P:x P:y D:x2-y2 D:x2-y2 D:z2 D:xy D:xy P:x -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 88 89 82 24 85 26 28 20 7 21 26 10 86 87 25 89 12 17 28 82 88 84 15 28 8 14 27 70 S S S Mo S Mo Mo Mo Mo Mo Mo Mo S S Mo S Mo Mo Mo S S S Mo Mo Mo Mo Mo S -5.231 2.00 1006 A 6.75 3.76 3.34 2.82 2.47 2.43 2.40 2.12 2.01 1.93 1.75 1.69 1.66 1.63 1.53 1.45 1.34 1.29 1.28 1.24 1.23 1.22 1.12 1.11 1.04 1.04 1.00 1 2 1 1 1 1 2 2 2 1 1 2 2 1 1 2 2 2 2 2 1 1 2 2 1 2 1 D:z2 P:x D:z2 D:xy D:z2 D:z2 P:x P:z P:x D:x2-y2 D:z2 P:z P:z D:x2-y2 D:z2 P:y P:x P:z P:x P:y D:z2 D:x2-y2 P:y P:x D:x2-y2 P:z D:z2 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.00 11 82 19 17 7 18 79 66 81 11 12 82 42 15 26 80 80 65 83 85 23 6 88 87 16 78 27 Mo S Mo Mo Mo Mo S S S Mo Mo S S Mo Mo S S S S S Mo Mo S S Mo S Mo -5.207 2.00 1007 A 9.32 7.03 5.75 4.81 2.60 2.58 2.54 2.53 2.25 2.24 2.17 2.06 1.93 1.68 1.63 1.54 1.44 1.43 1.38 1.25 1.24 1.24 1.20 1.11 1.09 1 1 2 1 1 1 1 2 1 2 1 2 1 1 1 1 1 2 2 1 1 1 2 1 1 D:z2 D:z2 P:x D:x2-y2 D:z2 D:z2 D:xy P:x D:x2-y2 P:z D:x2-y2 P:z D:z2 D:x2-y2 D:z2 D:xy D:x2-y2 P:x P:y D:z2 D:xy D:z2 P:x D:x2-y2 D:xy -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.00 21 28 78 21 20 3 8 90 19 45 15 69 19 3 15 15 8 88 89 18 14 4 79 9 7 Mo Mo S Mo Mo Mo Mo S Mo S Mo S Mo Mo Mo Mo Mo S S Mo Mo Mo S Mo Mo -5.176 2.00 1008 A 7.35 6.77 6.36 3.88 3.49 3.45 2.86 2.72 2.64 2.39 2.35 2.10 1.97 1.79 1.53 1.49 1.46 1.23 1.19 1.15 2 1 1 1 1 1 2 1 1 2 1 1 1 1 1 1 1 1 1 1 P:x D:z2 D:x2-y2 D:x2-y2 D:z2 D:xy P:x D:z2 D:xy P:x D:x2-y2 D:z2 D:x2-y2 D:z2 D:z2 D:z2 D:xy D:x2-y2 D:xy D:x2-y2 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 78 21 21 8 28 8 79 3 12 90 18 25 3 7 27 4 15 15 10 9 S Mo Mo Mo Mo Mo S Mo Mo S Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo -5.144 2.00 1009 A 9.23 8.41 4.73 4.60 3.35 3.32 3.05 2.90 2.72 2.46 2.36 2.15 2.04 2.04 1.90 1.84 1.58 1.31 1.27 1.17 1.16 1.14 1.12 1.07 1.07 1.04 1 1 1 1 2 1 1 1 1 1 1 1 2 1 2 1 1 1 2 1 2 1 1 2 2 1 D:x2-y2 D:xy D:xy D:z2 P:x D:z2 D:x2-y2 D:z2 D:z2 D:xy D:z2 D:x2-y2 P:y D:xy P:y D:x2-y2 D:z2 D:x2-y2 P:z D:x2-y2 P:x D:xy D:x2-y2 P:y P:x D:z2 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.00 18 12 17 24 87 11 19 25 12 13 23 17 81 19 86 13 17 8 81 23 43 9 14 66 67 19 Mo Mo Mo Mo S Mo Mo Mo Mo Mo Mo Mo S Mo S Mo Mo Mo S Mo S Mo Mo S S Mo -5.117 2.00 1010 A 6.50 5.31 3.92 3.40 3.21 3.11 3.04 2.65 2.25 2.25 2.00 1.90 1.75 1.69 1.68 1.57 1.44 1.43 1.24 1.23 1.16 1 1 1 1 2 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 2 D:z2 D:z2 D:z2 D:z2 P:z D:xy D:xy D:x2-y2 D:xy D:z2 D:x2-y2 D:z2 D:x2-y2 D:z2 P:z D:xy D:x2-y2 D:xy D:xy D:xy P:z -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 25 26 6 12 79 17 7 8 26 11 10 23 12 7 78 10 3 15 25 8 82 Mo Mo Mo Mo S Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo Mo Mo Mo S -5.072 2.00 1011 A 7.50 6.13 4.60 4.31 3.87 3.86 3.54 3.19 2.62 1.84 1.67 1.67 1.66 1.60 1.58 1.48 1.29 1.27 1.23 1.23 1.17 1.17 1.05 1.01 1.01 1 1 1 1 2 1 1 1 1 1 2 2 1 2 2 1 2 1 1 2 2 2 1 1 1 D:z2 D:z2 D:x2-y2 D:z2 P:z D:x2-y2 D:z2 D:z2 D:z2 D:z2 P:z P:x D:xy P:x P:z D:x2-y2 P:z D:xy D:z2 P:z P:z P:z D:z2 D:z2 D:x2-y2 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 18 24 21 26 82 17 25 19 12 17 72 86 17 79 49 20 50 20 27 73 67 43 7 13 10 Mo Mo Mo Mo S Mo Mo Mo Mo Mo S S Mo S S Mo S Mo Mo S S S Mo Mo Mo -4.969 2.00 1012 A 6.90 6.17 5.24 4.53 4.33 4.08 3.38 2.87 2.25 2.23 1.88 1.84 1.79 1.77 1.66 1.63 1.55 1.55 1.34 1.23 1.23 1.12 1.11 1.11 1.08 1.02 1 1 1 1 1 1 1 2 1 2 1 1 1 1 1 2 2 2 2 1 1 2 1 2 1 1 D:x2-y2 D:x2-y2 D:z2 D:z2 D:xy D:x2-y2 D:xy P:x D:x2-y2 P:y D:xy D:x2-y2 D:z2 D:xy D:xy P:y P:y P:y P:z D:xy D:z2 P:z D:xy P:x D:x2-y2 D:xy -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.00 21 15 25 26 26 10 21 88 20 89 14 25 21 15 25 88 51 74 73 28 27 50 12 86 27 20 Mo Mo Mo Mo Mo Mo Mo S Mo S Mo Mo Mo Mo Mo S S S S Mo Mo S Mo S Mo Mo -4.930 2.00 1013 A 12.86 9.99 4.90 4.20 3.77 3.15 2.54 1.94 1.81 1.77 1.62 1.52 1.41 1.40 1.33 1.32 1.30 1.29 1.29 1.07 1.01 2 2 2 2 1 1 2 1 1 1 1 1 2 1 1 1 2 2 1 2 1 P:x P:z P:z P:x D:z2 D:z2 P:x D:x2-y2 D:xy D:xy D:xy D:z2 P:z D:z2 D:x2-y2 D:x2-y2 P:z P:x D:x2-y2 P:y P:x -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -9.089 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 79 78 82 78 1 6 80 8 17 2 8 11 33 24 6 1 77 31 3 77 103 S S S S Mo Mo S Mo Mo Mo Mo Mo S Mo Mo Mo S S Mo S O -4.893 2.00 1014 A 9.85 8.80 8.71 4.96 4.66 4.56 4.18 3.17 2.38 1.71 1.62 1.61 1.56 1.51 1.34 1.17 1.08 1 1 2 1 1 2 2 2 2 1 1 2 1 1 2 2 1 D:z2 D:z2 P:y D:xy D:x2-y2 P:x P:y P:z P:z D:x2-y2 D:xy P:y D:xy D:x2-y2 P:y P:x D:xy -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 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P:x D:z2 D:xy D:x2-y2 P:x D:x2-y2 P:x D:z2 P:x -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 79 82 78 17 5 77 79 23 78 16 6 3 82 7 81 1 17 3 85 16 54 11 31 S S S Mo Mo S S Mo S Mo Mo Mo S Mo S Mo Mo Mo S Mo S Mo S -4.735 2.00 1017 A 19.28 7.50 5.64 4.16 3.26 3.16 3.14 3.14 2.27 2.13 1.96 1.63 1.53 1.52 1.46 1.40 1.38 1.37 1.37 1.37 1.19 1.15 1.00 2 1 1 2 2 1 1 1 1 1 1 2 1 2 1 1 1 1 1 2 2 1 1 P:z D:z2 D:z2 P:y P:z D:x2-y2 D:z2 D:z2 D:z2 D:xy D:xy P:z D:x2-y2 P:y P:z D:z2 D:x2-y2 D:z2 D:z2 P:z P:x D:xy D:xy -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -9.089 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 78 2 1 78 82 1 11 6 17 2 5 79 11 77 103 23 6 3 16 29 82 4 1 S Mo Mo S S Mo Mo Mo Mo Mo Mo S Mo S O Mo Mo Mo Mo S S Mo Mo -4.655 2.00 1018 A 11.81 4.71 4.62 4.40 4.11 4.00 3.69 3.48 2.92 2.74 2.24 2.09 2.02 2.00 1.76 1.67 1.66 1.53 1.48 1.47 1.39 1.31 1.17 1.11 2 1 2 2 2 1 1 1 1 1 1 1 1 2 1 1 2 1 1 1 1 2 2 2 P:z D:z2 P:x P:z P:y D:z2 D:x2-y2 D:z2 D:z2 D:z2 D:x2-y2 D:xy D:x2-y2 P:x D:xy D:z2 P:x D:xy D:x2-y2 D:x2-y2 D:xy P:y P:z P:x -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 79 11 78 78 79 5 1 1 7 6 11 2 6 80 7 2 79 5 5 3 3 78 33 33 S Mo S S S Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo S Mo Mo Mo Mo S S S -4.353 2.00 1019 A 14.42 8.98 6.95 6.62 6.62 5.48 5.45 5.32 4.12 3.87 1.62 1.55 1.38 1.30 1.22 1.16 1.09 1.03 1.02 1.01 1 1 1 2 2 2 1 1 2 2 1 1 1 2 2 1 2 2 1 2 D:z2 D:xy D:x2-y2 P:x P:z P:y D:z2 D:x2-y2 P:x P:x D:yz D:x2-y2 D:xy P:x P:z P:y P:z P:x D:x2-y2 P:y -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -9.089 -7.014 -7.014 -3.733 -7.014 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 4 2 4 79 79 79 2 2 80 78 4 3 6 31 31 102 56 32 1 54 Mo Mo Mo S S S Mo Mo S S Mo Mo Mo S S O S S Mo S -4.203 2.00 1020 A 21.06 13.01 5.95 5.68 4.71 3.76 3.11 3.02 2.92 2.89 2.40 2.19 1.97 -1.45 1.41 1.12 1.05 1 2 1 1 1 1 2 2 1 2 2 1 2 2 2 1 1 D:z2 P:x D:xy D:x2-y2 D:xy D:z2 P:y P:z D:z2 P:z P:x D:x2-y2 P:y D:z2 P:z D:z2 D:x2-y2 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 3.575 -7.014 -3.733 -3.733 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 0.00 1.33 1.00 1.00 16 81 11 16 22 6 85 84 24 82 82 6 84 16 47 12 22 Mo S Mo Mo Mo Mo S S Mo S S Mo S Mo S Mo Mo -4.184 0.00 1021 A 5.32 5.29 4.67 4.40 4.28 4.04 3.40 3.36 2.41 2.38 2.05 2.04 1.97 1.85 1.81 1.72 1.66 1.66 1.56 1.48 1.48 1.37 1.34 1.31 1.27 1.24 1.15 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:xz D:yz D:yz D:yz D:yz D:z2 D:z2 D:xz D:xz D:z2 D:z2 D:z2 D:z2 D:z2 D:xy D:z2 D:xy D:xy D:xy -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 186 185 194 193 192 195 187 196 192 195 186 185 196 187 195 186 193 194 185 193 192 196 187 195 194 192 187 196 W W W W W W W W W W W W W W W W W W W W W W W W W W W W -4.151 0.00 1022 A 8.47 8.37 8.22 8.10 2.53 2.52 2.49 2.44 1.53 1.41 1.39 1.37 1.37 1.34 1.17 1.12 1.01 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:xy D:xy D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:y P:y -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 188 191 190 189 189 190 188 191 194 193 186 185 187 196 192 195 125 127 W W W W W W W W W W W W W W W W O O -4.144 0.00 1023 A 14.20 9.70 8.73 7.60 4.07 3.92 3.57 3.45 3.22 3.00 2.85 2.65 2.54 2.20 1.54 1.52 1.51 1.45 1.34 1.24 -1.22 1.16 -1.16 1.11 1.02 1 1 2 1 1 2 1 1 2 1 2 2 2 1 2 1 2 1 2 1 2 1 2 2 2 D:x2-y2 D:x2-y2 P:y D:xy D:xy P:z D:xz D:x2-y2 P:y D:xy P:x P:x P:z D:z2 P:y D:z2 P:z D:z2 P:x D:x2-y2 D:xy D:xy D:x2-y2 P:y P:y -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 3.575 -3.733 3.575 -7.014 -7.014 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.00 0.00 1.00 0.00 1.33 1.33 28 27 90 27 28 52 28 26 88 20 88 89 75 25 89 27 90 20 90 21 27 25 28 76 69 Mo Mo S Mo Mo S Mo Mo S Mo S S S Mo S Mo S Mo S Mo Mo Mo Mo S S -4.063 0.00 1024 A 25.80 11.93 7.03 6.22 5.27 4.85 3.67 2.94 2.07 1.47 1.44 1.40 1.40 1.38 1.20 1.19 1.17 1.07 1 2 2 2 2 1 1 2 2 2 1 2 1 1 1 1 1 1 D:z2 P:z P:z P:y P:y D:xy D:xz P:x P:z P:x D:xy P:y D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:z2 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 22 83 84 85 83 23 28 84 90 82 16 84 23 23 22 16 17 24 Mo S S S S Mo Mo S S S Mo S Mo Mo Mo Mo Mo Mo -4.054 0.00 1025 A 28.51 17.09 8.68 5.97 5.63 2.58 2.10 1.87 1.75 -1.43 1.31 1.28 1.12 1 2 1 1 2 1 1 1 1 2 1 2 2 D:xz P:z D:xz D:xz P:z D:z2 D:x2-y2 D:xz D:yz D:xz D:yz P:z P:z -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 3.575 -3.733 -7.014 -7.014 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 0.00 1.00 1.33 1.33 28 90 27 21 89 22 28 26 28 28 27 83 75 Mo S Mo Mo S Mo Mo Mo Mo Mo Mo S S -3.890 0.00 1026 A 22.22 14.95 5.85 4.23 3.56 2.64 2.32 2.21 2.20 2.15 1.97 1.89 -1.81 1.74 1.63 1.59 1.51 1.25 1.21 1.06 1 2 1 2 1 1 1 1 2 1 2 2 2 1 2 1 1 1 2 1 D:x2-y2 P:y D:x2-y2 P:y D:z2 D:z2 D:x2-y2 D:z2 P:x D:z2 P:y P:y D:x2-y2 D:xy P:x D:z2 D:xy D:z2 P:y D:z2 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 3.575 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 0.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 28 90 26 89 26 27 24 25 90 28 88 87 28 27 88 20 25 18 86 24 Mo S Mo S Mo Mo Mo Mo S Mo S S Mo Mo S Mo Mo Mo S Mo -3.873 0.00 1027 A 4.91 4.70 4.47 3.60 3.18 3.11 3.11 3.09 2.99 2.73 2.25 2.09 2.02 1.81 1.81 1.79 1.77 1.71 1.65 1.60 1.58 1.52 1.43 1.40 1.37 1.32 1.29 1.18 1.15 1.14 1.10 1.08 1.01 1 1 1 1 1 2 1 2 2 2 1 1 1 1 1 2 2 1 2 2 1 1 2 1 1 1 1 1 1 2 2 1 1 D:x2-y2 D:x2-y2 D:x2-y2 D:xy D:x2-y2 P:y D:xy P:y P:x P:x D:xy D:z2 D:z2 D:x2-y2 D:x2-y2 P:z P:y D:z2 P:y P:y D:z2 D:xy P:x D:xy D:xy D:xy D:xy D:x2-y2 D:z2 P:x P:y D:z2 D:z2 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 25 26 28 16 24 87 4 90 80 81 25 11 6 22 6 84 88 18 86 89 23 19 82 18 26 27 23 11 24 79 85 27 7 Mo Mo Mo Mo Mo S Mo S S S Mo Mo Mo Mo Mo S S Mo S S Mo Mo S Mo Mo Mo Mo Mo Mo S S Mo Mo -3.819 0.00 1028 A 4.93 4.78 4.05 3.95 3.78 3.57 3.16 3.05 2.40 2.33 2.17 2.08 2.04 1.98 1.87 1.76 1.50 1.39 1.33 1.33 1.31 1.29 1.22 1.22 1.20 1.19 1.14 1.14 1.10 1.09 1.08 1.06 1.04 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:yz D:yz D:xz D:xz D:xz D:xz D:yz D:yz D:z2 D:z2 P:z P:z D:z2 D:z2 P:z D:z2 D:xy P:z D:z2 D:z2 P:z P:z P:z P:z P:y P:y -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 194 193 185 187 186 196 192 195 187 196 193 194 195 192 185 186 193 187 124 131 196 195 130 194 187 121 186 185 122 132 129 123 118 119 W W W W W W W W W W W W W W W W W W O O W W O W W O W W O O O O O O -3.796 0.00 1029 A 7.99 6.08 5.31 4.95 4.92 4.81 3.63 3.05 2.73 2.58 2.52 2.03 2.02 1.97 1.96 1.86 1.71 1.59 1.56 1.43 1.28 1.23 1.19 1.18 1.15 1.15 1.14 1 1 2 1 1 1 1 2 2 2 1 2 2 2 1 1 1 1 2 1 2 1 2 1 1 1 1 D:x2-y2 D:xy P:y D:x2-y2 D:x2-y2 D:xy D:x2-y2 P:y P:x P:y D:xy P:z P:z P:x D:xy D:xy D:xy D:xy P:x D:xy P:x D:z2 P:x D:x2-y2 D:x2-y2 D:x2-y2 D:z2 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 24 16 87 25 23 25 22 86 82 85 22 83 84 80 24 4 18 26 86 17 81 26 87 18 17 11 18 Mo Mo S Mo Mo Mo Mo S S S Mo S S S Mo Mo Mo Mo S Mo S Mo S Mo Mo Mo Mo -3.794 0.00 1030 A 10.85 10.53 3.83 3.72 2.41 2.15 2.05 2.04 1.81 1.81 1.77 1.68 1.68 1.66 1.62 1.53 1.45 1.35 1.21 1.17 1.16 1.13 1.12 1.09 1.07 1.02 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:xy D:xy D:x2-y2 P:x P:x D:x2-y2 D:x2-y2 P:x D:x2-y2 P:x D:x2-y2 D:x2-y2 P:z D:x2-y2 P:z D:x2-y2 D:xz D:yz P:x P:x P:y D:xz P:y D:xz D:yz -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 0.80 1.33 0.80 0.80 1.33 0.80 1.33 0.80 0.80 0.80 1.33 1.33 1.33 0.80 1.33 0.80 0.80 191 189 189 191 194 128 126 193 196 114 186 116 187 192 116 185 114 195 192 196 131 130 128 194 126 195 187 W W W W W O O W W O W O W W O W O W W W O O O W O W W -3.789 0.00 1031 A 11.05 10.97 3.93 3.84 2.22 2.18 2.12 1.93 1.86 1.85 1.73 1.71 1.68 1.67 1.62 1.60 1.59 1.54 1.31 1.23 1.19 1.13 1.07 1.04 1.03 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:xy D:xy P:y P:y D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:y D:x2-y2 P:y D:x2-y2 P:z D:x2-y2 P:z D:yz P:x D:yz P:x P:y D:z2 P:y D:xz -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.33 0.80 1.33 0.80 188 190 190 188 127 125 186 185 194 193 196 113 187 115 192 113 195 115 196 125 187 127 123 196 122 195 W W W W O O W W W W W O W O W O W O W O W O O W O W -3.673 0.00 1032 A 6.21 6.21 5.92 5.80 5.69 5.68 5.43 4.18 4.00 3.69 2.63 2.62 2.58 1.96 1.90 1.66 1.39 1.35 1.22 1.12 1.09 1.03 1.03 2 1 2 1 1 1 1 1 2 2 1 2 1 1 1 1 1 2 2 1 2 1 1 P:z D:xz P:z D:xz D:xz D:xz D:xz D:yz P:z P:z D:yz P:z D:xz D:xy D:yz D:xz D:xz P:x P:z D:yz P:x D:yz D:x2-y2 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 87 26 88 24 28 25 23 25 85 86 26 90 19 1 27 17 18 77 89 19 80 23 22 S Mo S Mo Mo Mo Mo Mo S S Mo S Mo Mo Mo Mo Mo S S Mo S Mo Mo -3.647 0.00 1033 A 20.89 14.32 3.63 3.28 2.91 2.82 2.72 1.94 1.89 1.83 1.78 1.43 1.40 1.33 1.29 1.10 1.02 1.00 1 2 2 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 D:xy P:x P:x D:xy D:xy D:xy D:xy D:z2 P:x D:x2-y2 D:x2-y2 D:x2-y2 P:z D:z2 D:z2 D:xz D:xz D:z2 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1 77 80 6 11 16 4 1 81 22 1 2 84 2 4 1 26 12 Mo S S Mo Mo Mo Mo Mo S Mo Mo Mo S Mo Mo Mo Mo Mo -3.568 0.00 1034 A 19.39 13.52 6.15 5.47 5.02 3.16 2.63 1.84 1.64 1.59 1.51 1.34 1.33 1.30 1.29 1.28 1.25 1.18 1.14 1.00 1 2 2 1 1 1 1 2 2 1 1 2 1 2 2 1 1 1 1 1 D:xy P:x P:x D:xy D:xy D:xy D:xy P:x P:z D:x2-y2 D:x2-y2 P:x D:x2-y2 P:z P:x D:z2 D:z2 D:x2-y2 D:xy D:xz -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1 77 80 4 6 11 2 79 53 22 3 81 7 29 78 4 12 12 16 1 Mo S S Mo Mo Mo Mo S S Mo Mo S Mo S S Mo Mo Mo Mo Mo -3.492 0.00 1035 A 9.49 8.09 7.44 7.20 7.15 4.51 3.85 3.74 2.70 2.56 2.52 2.43 1.72 1.61 1.56 1.54 1.43 1.28 1.22 1.01 1 2 2 1 1 1 2 1 1 1 2 1 2 2 1 1 1 1 2 1 D:xz P:z P:z D:xz D:xz D:yz P:z D:yz D:xz D:xz P:z D:xz P:y P:z D:yz D:xz D:yz D:z2 P:x D:yz -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.00 23 85 89 28 27 23 90 27 26 20 86 24 70 88 17 17 24 23 52 11 Mo S S Mo Mo Mo S Mo Mo Mo S Mo S S Mo Mo Mo Mo S Mo -3.396 0.00 1036 A 13.79 11.18 9.88 8.20 7.43 6.02 4.98 2.88 2.32 2.17 -2.10 1.87 1.62 1.60 -1.55 1.42 -1.40 1.26 1.26 1.21 -1.19 1.19 -1.11 1 1 1 2 2 1 1 1 1 2 2 2 1 1 2 2 2 1 2 2 2 2 2 D:x2-y2 D:x2-y2 D:z2 P:y P:y D:xy D:z2 D:z2 D:xy P:x D:z2 P:x S D:z2 D:x2-y2 P:z D:x2-y2 S P:z P:z D:z2 P:z D:z2 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 3.575 -7.014 -6.493 -3.733 3.575 -7.014 3.575 -6.493 -7.014 -7.014 3.575 -7.014 3.575 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 0.00 1.33 1.00 1.00 0.00 1.33 0.00 1.00 1.33 1.33 0.00 1.33 0.00 8 10 8 35 59 10 10 15 8 59 8 35 156 14 10 32 8 176 63 40 10 55 15 Mo Mo Mo S S Mo Mo Mo Mo S Mo S H Mo Mo S Mo H S S Mo S Mo -3.358 0.00 1037 A 6.90 4.96 3.26 2.96 2.59 2.59 2.54 2.46 2.23 2.21 2.11 2.11 2.08 1.85 1.83 1.79 1.70 1.64 1.59 1.28 1.25 1.24 1.20 1.17 1.13 1.09 1 1 1 1 1 1 1 2 1 2 1 1 2 1 2 1 1 2 1 1 2 1 1 1 2 1 D:xz D:xz D:xz D:xz D:xy D:xz D:z2 P:x D:xz P:z D:x2-y2 D:xz P:y D:x2-y2 P:z D:xy D:yz P:z D:yz D:xy P:z D:yz D:yz D:xz P:z D:xz -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 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Mo Mo Mo S S Mo Mo S Mo Mo S S S Mo -3.325 0.00 1039 A 9.67 8.61 5.70 4.81 4.47 3.39 3.22 2.73 2.58 2.34 2.25 1.88 1.77 1.67 1.47 1.31 1.19 -1.07 1.05 1.01 1 1 2 1 1 2 1 1 1 2 2 2 1 1 1 1 2 2 1 2 D:yz D:x2-y2 P:z D:yz D:xy P:z D:x2-y2 D:yz D:xy P:y P:y P:y D:z2 D:x2-y2 D:xy D:yz P:y D:x2-y2 D:x2-y2 P:x -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 3.575 -3.733 -7.014 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 0.00 1.00 1.33 11 15 81 6 21 80 10 12 23 45 69 40 21 21 22 17 63 15 11 69 Mo Mo S Mo Mo S Mo Mo Mo S S S Mo Mo Mo Mo S Mo Mo S -3.311 0.00 1040 A 6.16 5.33 3.95 3.87 3.62 3.55 2.65 2.52 2.29 2.04 1.93 1.75 1.62 1.57 1.54 1.46 1.42 1.40 1.30 1.25 1.21 1.21 1.18 1.14 1.08 1.05 1 2 1 1 1 1 1 2 1 2 2 1 1 1 2 1 1 1 1 1 1 1 1 2 2 2 D:xz P:z D:xz D:xz D:x2-y2 D:yz D:xz P:z D:yz P:z P:y D:yz D:xy D:yz P:x D:xz D:xz D:yz D:yz D:xz D:xy D:x2-y2 D:xz P:y P:z P:y -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 27 89 10 8 15 11 26 88 27 81 45 10 21 15 40 14 3 6 21 9 10 10 15 51 80 40 Mo S Mo Mo Mo Mo Mo S Mo S S Mo Mo Mo S Mo Mo Mo Mo Mo Mo Mo Mo S S S -3.273 0.00 1041 A 5.39 4.93 4.60 4.27 3.74 3.73 3.69 3.63 3.41 2.97 2.51 2.47 2.39 2.24 2.23 1.91 1.72 1.66 1.52 1.50 1.48 -1.45 1.43 1.30 1.20 1.18 1.12 1 2 1 1 1 1 1 1 1 1 1 2 2 1 1 2 1 1 1 2 2 2 1 1 1 1 2 D:z2 P:x D:z2 D:xy D:xy D:z2 D:xy D:z2 D:xy D:xy D:x2-y2 P:y P:y D:x2-y2 D:xy P:x D:xz D:x2-y2 D:xz P:z P:x D:z2 D:x2-y2 D:yz D:z2 D:xz P:y -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 3.575 -3.733 -3.733 -3.733 -3.733 -7.014 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 0.00 1.00 1.00 1.00 1.00 1.33 14 63 28 27 20 10 15 27 10 14 26 52 75 21 21 40 10 19 8 69 51 14 20 15 15 15 88 Mo S Mo Mo Mo Mo Mo Mo Mo Mo Mo S S Mo Mo S Mo Mo Mo S S Mo Mo Mo Mo Mo S -3.259 0.00 1042 A 7.07 6.97 5.24 2.75 2.69 2.32 2.29 2.24 1.99 1.95 1.82 1.79 1.55 1.50 1.41 -1.35 -1.35 1.34 1.31 1.22 1.21 1.18 1.17 -1.10 1.09 1.04 1.02 1.01 1.00 1 1 1 1 1 2 1 1 2 2 1 1 1 1 1 2 2 1 1 1 2 1 1 2 2 2 2 1 1 D:z2 D:z2 D:x2-y2 D:yz D:x2-y2 P:y D:yz D:xy P:y P:z D:x2-y2 D:xz D:xy D:z2 D:x2-y2 D:z2 D:z2 D:xz D:x2-y2 D:xy P:z D:z2 D:yz D:x2-y2 P:y P:x P:z D:z2 D:xy -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 3.575 3.575 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 3.575 -7.014 -7.014 -7.014 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 0.00 0.00 1.00 1.00 1.00 1.33 1.00 1.00 0.00 1.33 1.33 1.33 1.00 1.00 15 10 20 6 14 40 11 27 63 80 10 23 22 19 26 10 15 8 8 15 81 22 12 20 51 63 85 21 14 Mo Mo Mo Mo Mo S Mo Mo S S Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo Mo S S S Mo Mo -3.249 0.00 1043 A 11.85 5.39 4.13 3.66 3.41 3.23 2.70 2.60 2.48 2.07 2.02 1.97 1.96 1.72 1.68 1.61 1.43 1.25 1.24 1.15 1.10 1.07 1.02 1 2 1 1 1 1 2 1 1 1 1 2 2 2 1 2 1 1 1 1 2 2 1 D:xy P:x D:z2 D:z2 D:xz D:xy P:y D:yz D:z2 D:x2-y2 D:x2-y2 P:z P:x P:z D:yz P:z D:x2-y2 D:x2-y2 D:xz D:x2-y2 P:z P:y D:x2-y2 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 22 83 22 15 23 23 84 6 10 20 8 80 84 85 11 83 16 14 26 22 81 85 11 Mo S Mo Mo Mo Mo S Mo Mo Mo Mo S S S Mo S Mo Mo Mo Mo S S Mo -3.194 0.00 1044 A 14.01 4.03 3.78 3.77 3.22 3.08 3.05 2.83 2.70 2.43 2.40 2.39 2.21 1.94 1.89 -1.88 1.78 1.70 1.31 1.20 1.20 1.19 1.14 1.08 1.08 1.07 1.02 1 1 1 1 1 2 1 2 1 1 1 1 2 1 2 2 2 2 1 1 1 1 1 2 1 2 1 D:xy D:x2-y2 D:z2 D:z2 D:x2-y2 P:x D:x2-y2 P:y D:x2-y2 D:z2 D:z2 D:xy P:y D:x2-y2 P:y D:xy P:x P:x D:z2 D:xy D:z2 D:xy D:x2-y2 P:y D:x2-y2 P:x D:x2-y2 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 3.575 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.33 0.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 10 3 14 27 8 63 21 32 10 28 15 27 55 15 75 10 59 40 20 22 19 21 26 52 1 35 9 Mo Mo Mo Mo Mo S Mo S Mo Mo Mo Mo S Mo S Mo S S Mo Mo Mo Mo Mo S Mo S Mo -3.185 0.00 1045 A 9.25 6.48 5.70 5.36 4.97 4.21 4.07 3.60 3.41 3.04 2.97 2.38 2.06 1.84 -1.60 -1.60 1.55 1.52 1.51 1.40 -1.37 1.34 1.31 1.30 1.22 1.20 1.15 1.11 1.11 1.02 1 1 1 1 1 1 1 2 2 1 1 1 1 1 2 2 2 1 2 1 2 2 2 2 2 1 1 2 2 1 D:xy D:z2 D:z2 D:x2-y2 D:xy D:x2-y2 D:xy P:x P:x D:xy D:z2 D:z2 D:z2 D:x2-y2 D:z2 D:xy P:x D:xy P:x D:x2-y2 D:z2 P:y P:y P:x P:y D:x2-y2 D:z2 P:z P:x D:x2-y2 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 3.575 3.575 -7.014 -3.733 -7.014 -3.733 3.575 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 0.00 0.00 1.33 1.00 1.33 1.00 0.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 15 9 14 15 8 9 19 69 45 20 15 20 1 1 9 15 59 14 40 8 14 29 40 63 63 13 27 77 35 3 Mo Mo Mo Mo Mo Mo Mo S S Mo Mo Mo Mo Mo Mo Mo S Mo S Mo Mo S S S S Mo Mo S S Mo -3.140 0.00 1046 A 8.17 6.91 6.43 6.05 5.93 5.38 4.45 3.53 3.22 2.95 2.89 2.52 1.81 1.79 1.76 1.74 1.67 1.59 1.49 1.44 -1.38 1.36 1.18 -1.18 1.13 -1.08 1.07 1.02 1 1 1 1 1 1 1 1 1 2 2 1 2 2 2 1 1 2 2 2 2 1 2 2 1 2 2 1 D:xy D:xy D:x2-y2 D:z2 D:x2-y2 D:z2 D:z2 D:xy D:x2-y2 P:z P:y D:yz P:y P:x P:y D:x2-y2 D:z2 P:x P:y P:z D:z2 D:xy P:z D:xy D:xy D:z2 P:x D:xy -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 3.575 -3.733 -7.014 3.575 -3.733 3.575 -7.014 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 0.00 1.00 1.33 0.00 1.00 0.00 1.33 1.00 10 3 3 8 1 1 9 15 10 77 29 1 55 59 32 15 20 35 53 53 8 8 32 10 20 1 29 9 Mo Mo Mo Mo Mo Mo Mo Mo Mo S S Mo S S S Mo Mo S S S Mo Mo S Mo Mo Mo S Mo -3.115 0.00 1047 A 6.53 3.79 2.98 2.86 2.84 2.49 2.42 2.40 2.19 1.90 1.85 1.73 1.57 1.56 1.55 1.55 1.48 1.46 1.42 1.38 1.35 1.27 1.23 1.21 1.20 1.12 1.11 1.09 1.01 1 1 1 2 1 1 2 1 1 1 1 1 2 1 2 2 1 1 2 1 1 2 1 1 1 1 1 1 1 D:x2-y2 D:xy D:x2-y2 P:y D:x2-y2 D:x2-y2 P:x D:yz D:x2-y2 D:x2-y2 D:z2 D:xy P:z D:x2-y2 P:x P:y D:xy D:xy P:y D:xy D:z2 P:x D:z2 D:z2 D:x2-y2 D:z2 D:z2 D:z2 D:x2-y2 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 22 22 8 84 14 24 83 6 18 19 13 8 80 23 47 47 21 9 86 18 15 59 9 8 7 5 27 28 3 Mo Mo Mo S Mo Mo S Mo Mo Mo Mo Mo S Mo S S Mo Mo S Mo Mo S Mo Mo Mo Mo Mo Mo Mo -3.097 0.00 1048 A 5.88 5.85 5.82 5.67 4.21 3.42 3.17 3.07 3.02 2.99 2.98 1.61 1.23 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:xy D:xy D:xy D:xy D:xy D:xy D:z2 D:x2-y2 -4.498 -4.498 -4.498 -4.498 -3.733 -3.733 -3.733 -4.498 -4.498 -4.498 -4.498 -3.733 -3.733 0.80 0.80 0.80 0.80 1.00 1.00 1.00 0.80 0.80 0.80 0.80 1.00 1.00 188 191 189 190 8 15 8 190 191 188 189 9 22 W W W W Mo Mo Mo W W W W Mo Mo -3.095 0.00 1049 A 6.87 5.33 5.28 3.60 3.52 3.49 3.49 2.58 2.20 1.84 1.82 1.78 1.69 1.38 1.34 1.31 1.28 1.23 1.09 -1.08 1.07 1.06 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 1 2 1 2 D:x2-y2 D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:xy D:xy D:xy 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6.27 6.22 5.83 5.20 5.13 4.84 4.79 2.60 2.49 2.13 2.03 1.34 1.24 1.15 1.09 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:xz D:xz D:xz D:z2 D:z2 D:z2 D:z2 P:y P:y P:y P:y -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 192 195 194 193 192 195 193 194 193 195 192 194 127 125 113 115 W W W W W W W W W W W W O O O O -3.074 0.00 1052 A 10.16 8.28 8.21 7.26 3.38 2.75 2.61 2.04 1.88 1.84 1.78 1.75 1.68 1.62 1.57 1.41 1.41 1.35 1.32 1.20 1.14 1 1 2 2 1 1 1 2 2 2 1 1 1 1 1 1 1 1 1 2 1 D:xz D:xz P:z P:z D:yz D:yz D:xz P:z P:y P:y D:xz D:xz D:xz D:xz D:xz D:x2-y2 D:yz D:xz D:yz P:z D:yz -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 26 25 88 87 25 26 23 85 50 73 1 24 8 20 3 1 23 18 8 86 3 Mo Mo S S Mo Mo Mo S S S Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo -3.056 0.00 1053 A 5.61 3.96 3.85 2.96 2.80 2.39 2.28 2.21 2.18 2.08 1.80 1.79 1.77 1.77 1.75 1.69 1.67 1.47 1.39 1.25 1.17 1.12 1.10 1.04 1.03 1.03 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 2 1 1 2 1 1 1 1 D:z2 D:xy D:x2-y2 D:x2-y2 D:xy D:xy D:z2 D:xy D:xz D:z2 D:x2-y2 D:yz D:x2-y2 D:x2-y2 P:z D:z2 D:x2-y2 P:x D:yz P:x D:xy D:xz P:y D:xy D:xy D:x2-y2 D:xy -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 3 9 1 9 8 19 8 14 24 7 14 3 7 12 86 9 3 44 1 68 16 23 55 20 18 19 21 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo S Mo S Mo Mo S Mo Mo Mo Mo -3.048 0.00 1054 A 6.29 4.79 4.69 3.64 3.29 2.90 2.83 2.68 1.90 1.81 1.74 1.71 1.71 1.65 1.64 1.63 1.59 1.50 1.44 -1.34 1.28 1.21 1.17 1.14 1.11 1.10 1.06 1.04 1.01 1 1 1 1 2 1 1 1 2 1 1 2 1 1 1 2 1 1 2 2 1 1 2 1 1 1 1 1 1 D:xy D:z2 D:x2-y2 D:xz P:z D:xy D:x2-y2 D:xy P:x D:xz D:x2-y2 P:y D:z2 D:yz D:yz P:x D:z2 D:xy P:y D:xy D:x2-y2 D:xy P:z D:x2-y2 D:x2-y2 D:z2 D:z2 D:yz D:x2-y2 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 3.575 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.33 0.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 9 14 14 24 86 19 19 14 68 23 13 62 19 6 24 44 16 21 39 9 22 16 85 10 7 7 12 11 16 Mo Mo Mo Mo S Mo Mo Mo S Mo Mo S Mo Mo Mo S Mo Mo S Mo Mo Mo S Mo Mo Mo Mo Mo Mo -3.037 0.00 1055 A 4.81 4.60 4.53 4.12 2.75 2.75 2.63 2.58 2.44 2.18 1.92 1.92 1.84 1.82 1.80 1.63 1.49 1.47 1.44 1.32 1.25 1.22 1.17 1.10 1.07 1.05 1.04 1.01 1 2 1 1 1 1 1 1 1 1 2 1 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 D:xz P:z D:z2 D:xy D:x2-y2 D:xz D:xy D:x2-y2 D:yz D:xy P:z D:xy P:z D:xz D:x2-y2 D:x2-y2 D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:z2 P:y D:yz D:yz D:xz P:y -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 25 87 3 21 1 26 15 22 25 8 88 9 86 24 10 14 27 8 5 16 20 15 10 50 1 24 23 49 Mo S Mo Mo Mo Mo Mo Mo Mo Mo S Mo S Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo Mo S -3.017 0.00 1056 A 7.83 5.74 4.39 2.90 2.57 2.09 2.05 2.03 1.74 1.73 1.70 1.65 1.55 1.54 1.40 1.34 1.23 1.23 1.19 1.16 1.16 1.14 1.13 1.11 1.10 1.08 1.04 1.02 1 1 2 1 1 1 1 1 2 1 2 1 1 1 2 1 2 1 1 2 1 2 1 2 1 1 1 1 D:xy D:xz P:z D:z2 D:x2-y2 D:yz D:x2-y2 D:z2 P:y D:z2 P:x D:z2 D:xy D:z2 P:x D:z2 P:z 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1.00 1.00 1.00 1.00 1.33 1.00 0.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 14 9 4 15 3 8 8 39 13 14 1 44 55 26 3 21 21 21 79 20 22 Mo Mo Mo Mo Mo Mo Mo S Mo Mo Mo S S Mo Mo Mo Mo Mo S Mo Mo -2.989 0.00 1058 A 5.83 5.50 5.38 5.05 3.37 3.22 2.92 2.75 2.57 2.40 2.13 2.00 1.95 1.90 1.87 1.86 1.84 1.64 1.62 1.53 1.50 1.49 1.40 1.34 1.25 1.21 1.14 1.10 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 P:y P:x P:z P:z P:y D:x2-y2 D:z2 D:z2 P:x D:x2-y2 D:x2-y2 D:xy P:y P:z P:z P:y P:x P:x P:x -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 194 196 191 189 186 192 190 188 187 193 137 142 144 142 139 194 185 195 140 192 186 196 144 134 140 134 139 138 136 W W W W W W W W W W O O O O O W W W O W W W O O O O O O O -2.982 0.00 1059 A 3.40 2.63 2.63 2.56 2.55 2.01 1.94 1.81 1.80 1.65 1.57 1.42 1.39 1.38 1.34 1.26 1.23 1.21 1.20 1.17 1.16 1.13 1.09 1.05 1.01 1 2 1 2 1 1 1 1 1 1 1 2 1 1 2 1 1 1 1 1 1 1 1 1 1 D:xz P:z D:xz P:z D:z2 D:x2-y2 D:yz D:z2 D:x2-y2 D:z2 D:xz P:y D:yz D:xz P:x D:x2-y2 D:yz D:xy D:z2 D:xz D:z2 D:x2-y2 D:xy D:xy D:xy -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 24 86 25 87 3 3 8 13 22 1 15 32 25 3 39 9 6 14 8 21 9 4 8 3 13 Mo S Mo S Mo Mo Mo Mo Mo Mo Mo S Mo Mo S Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo -2.979 0.00 1060 A 3.47 3.43 3.19 3.11 2.93 2.78 2.76 2.44 2.43 2.33 2.33 2.32 2.30 2.30 2.29 2.29 2.06 1.82 1.78 1.74 1.51 1.50 1.30 1.24 1.19 1.13 1.05 1.04 1.01 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xy P:y D:yz D:x2-y2 D:xz D:x2-y2 P:x D:z2 P:y D:xy D:yz P:z P:x P:z D:xz D:xz D:xy D:z2 D:yz D:z2 D:x2-y2 D:xz D:xz D:z2 P:x D:z2 D:xy P:y P:x D:x2-y2 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -3.733 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 0.80 1.33 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 1.33 0.80 0.80 1.33 1.33 0.80 194 142 194 188 189 190 144 187 140 196 192 137 134 139 186 191 186 185 191 193 192 196 24 196 136 195 192 135 138 187 W O W W W W O W O W W O O O W W W W W W W W Mo W O W W O O W -2.973 0.00 1061 A 3.68 3.66 3.27 3.25 3.17 2.93 2.91 2.76 2.66 2.54 2.51 2.47 2.40 2.27 2.17 1.70 1.65 1.34 1.20 1.20 1.12 1.10 1.02 1.02 1.02 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x D:xy D:x2-y2 D:x2-y2 P:y D:x2-y2 D:xy P:x D:xz D:xz D:x2-y2 D:yz D:xy P:y D:yz D:xz D:x2-y2 D:yz D:z2 P:x P:y P:x D:z2 D:xy P:z P:z -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 1.33 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 135 193 189 190 141 188 187 133 185 187 191 193 185 143 195 191 195 189 193 138 139 136 187 195 137 139 O W W W O W W O W W W W W O W W W W W O O O W W O O -2.972 0.00 1062 A 5.51 5.13 4.78 4.71 3.15 2.79 2.68 2.40 2.38 2.35 2.09 2.06 2.01 1.96 1.96 1.91 1.83 1.74 1.72 1.64 1.53 1.46 1.44 1.41 1.34 1.28 1.25 1.25 1.20 1.16 1.13 1.12 1.11 1.06 1.03 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:yz D:yz P:z P:z D:xz D:x2-y2 D:xz D:xz D:yz D:z2 D:z2 D:z2 D:x2-y2 P:y D:z2 D:yz D:xz D:z2 D:z2 P:x D:xy D:xy P:y D:x2-y2 P:y D:xy 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-3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 11 4 3 6 3 21 81 80 20 5 19 23 22 9 9 14 6 60 Mo Mo Mo Mo Mo Mo S S Mo Mo Mo Mo Mo Mo Mo Mo Mo S -2.942 0.00 1064 A 6.12 6.08 4.37 3.98 3.46 3.43 2.68 2.45 2.41 2.19 2.08 1.91 1.88 1.86 1.73 1.71 1.71 1.60 1.59 1.53 1.31 1.15 1.06 1.06 1.05 1 1 1 1 2 2 1 1 1 1 1 1 2 2 2 2 2 2 1 2 2 2 2 1 2 D:yz D:yz D:xy D:x2-y2 P:z P:z D:z2 D:xz D:x2-y2 D:xy D:x2-y2 D:z2 P:y P:x P:x P:x P:x P:y D:x2-y2 P:z P:z P:x P:z D:z2 P:x -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 11 6 16 22 80 81 4 24 20 7 14 20 44 33 65 70 37 68 19 86 84 82 47 22 60 Mo Mo Mo Mo S S Mo Mo Mo Mo Mo Mo S S S S S S Mo S S S S Mo S -2.937 0.00 1065 A 5.25 5.05 4.33 4.28 4.27 3.80 3.19 2.96 2.63 2.63 2.44 2.28 2.21 2.11 1.86 1.62 1.60 1.49 1.44 1.36 1.29 1.27 1.23 1.21 1.14 1.11 1 1 1 1 1 1 1 2 1 1 2 2 1 2 1 1 1 1 1 2 2 1 2 2 1 1 D:xy D:x2-y2 D:xy D:xy D:z2 D:xy D:xz P:x D:z2 D:xy P:x P:x D:x2-y2 P:z D:z2 D:xy D:x2-y2 D:xy D:z2 P:x P:x D:x2-y2 P:y P:y D:xy D:xz -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 22 16 9 16 13 14 24 70 22 8 62 39 3 86 14 5 20 3 16 47 82 14 68 84 7 22 Mo Mo Mo Mo Mo Mo Mo S Mo Mo S S Mo S Mo Mo Mo Mo Mo S S Mo S S Mo Mo -2.900 0.00 1066 A 10.18 8.44 4.97 3.89 3.29 3.13 2.95 2.65 -2.44 -2.31 2.27 2.25 2.17 2.13 1.96 1.95 1.87 1.80 1.73 1.60 1.51 1.31 1.25 1.24 1.15 1.04 1.01 1 1 1 1 2 1 1 1 2 2 2 2 1 1 2 2 1 2 2 1 1 1 2 2 2 1 1 D:z2 D:x2-y2 D:xy D:xy P:x D:yz D:x2-y2 D:yz D:z2 D:x2-y2 P:y P:y D:z2 D:x2-y2 P:x P:y D:x2-y2 P:z P:y D:z2 D:xy D:x2-y2 P:x P:z S S D:xy -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 3.575 3.575 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -4.108 -6.493 -3.733 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 0.00 0.00 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 5 14 3 9 55 6 5 11 5 14 68 39 9 3 32 62 13 80 44 20 8 20 53 81 10 157 10 Mo Mo Mo Mo S Mo Mo Mo Mo Mo S S Mo Mo S S Mo S S Mo Mo Mo S S Mo H Mo -2.891 0.00 1067 A 5.16 4.90 4.20 3.71 3.32 3.16 3.04 2.66 2.56 2.43 2.17 2.15 1.90 1.90 1.81 1.61 1.53 1.48 1.42 1.28 1.26 1.24 1.24 1.18 1.15 1.13 1.12 1.11 1.06 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 2 2 2 2 1 2 1 1 2 2 D:xy D:x2-y2 D:z2 D:x2-y2 D:xy D:xy D:z2 D:z2 D:z2 D:xy D:xy D:z2 D:x2-y2 P:x P:x D:x2-y2 D:xy D:xy D:x2-y2 D:xy P:x P:x P:x P:y D:x2-y2 P:y D:x2-y2 D:xy P:y P:x -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.33 20 18 13 9 5 25 20 14 23 16 22 24 24 68 44 14 19 14 16 3 47 87 69 86 17 49 27 10 72 45 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S S Mo Mo Mo Mo Mo S S S S Mo S Mo Mo S S -2.863 0.00 1068 A 9.66 6.83 5.79 5.32 4.04 3.85 2.97 2.96 2.82 2.65 2.30 2.04 1.89 1.75 1.59 1.42 -1.36 -1.32 -1.20 1.15 1.07 1.04 1.02 1 1 1 1 1 1 2 1 2 1 1 1 2 2 1 1 2 2 2 1 2 1 1 D:xy D:z2 D:x2-y2 D:z2 D:xy D:z2 P:x D:x2-y2 P:x D:xy D:z2 D:z2 P:y P:y D:xy D:x2-y2 D:z2 D:xy D:x2-y2 D:x2-y2 P:y D:xy D:x2-y2 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 3.575 3.575 3.575 -3.733 -7.014 -3.733 -3.733 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1.00 1.33 1.33 1.33 1.00 0.00 1.33 5 14 14 13 3 13 7 9 57 5 34 7 5 15 9 18 3 34 43 19 14 67 32 61 57 20 55 38 67 2 14 43 Mo Mo Mo Mo Mo Mo Mo Mo S Mo S Mo Mo Mo Mo Mo Mo S S Mo Mo S S S S Mo S S S Mo Mo S -2.794 0.00 1070 A 6.90 3.78 3.59 3.13 2.76 2.54 2.26 2.11 2.10 2.09 2.07 2.00 1.94 1.77 1.67 1.62 1.59 1.55 1.52 1.52 1.25 1.24 1.23 1.17 1.13 1.12 1.09 1.07 1.04 1.03 1.02 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 2 1 2 2 1 1 1 1 2 D:xz D:xy D:xy D:x2-y2 D:yz D:z2 P:x D:yz D:x2-y2 D:xz D:xy D:xy D:x2-y2 D:x2-y2 D:yz D:xy D:xz P:y D:z2 D:z2 P:y D:x2-y2 P:y D:x2-y2 P:y P:x D:yz D:z2 D:z2 D:z2 P:y -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 21 2 7 13 2 1 29 3 9 1 13 18 2 5 10 12 10 53 26 25 35 27 75 14 54 43 1 13 20 18 61 Mo Mo Mo Mo Mo Mo S Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo S Mo S Mo S S Mo Mo Mo Mo S -2.777 0.00 1071 A 5.16 3.52 3.35 3.11 3.03 2.38 2.35 2.00 2.00 2.00 1.92 1.90 1.55 1.52 1.52 1.47 1.42 1.40 1.35 1.29 1.22 1.21 1.13 1.11 1.07 1.06 1 2 1 1 1 1 2 1 1 2 1 2 1 1 1 2 1 1 1 2 1 1 1 1 1 2 D:x2-y2 P:x D:z2 D:xy D:xy D:xy P:x D:xy D:z2 P:x D:x2-y2 P:y D:x2-y2 D:x2-y2 D:xy P:y D:x2-y2 D:x2-y2 D:xy P:y D:z2 D:xy D:z2 D:z2 D:x2-y2 P:x -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 5 41 18 18 16 17 43 13 7 67 27 34 4 13 19 31 16 9 11 54 13 12 12 11 6 34 Mo S Mo Mo Mo Mo S Mo Mo S Mo S Mo Mo Mo S Mo Mo Mo S Mo Mo Mo Mo Mo S -2.761 0.00 1072 A 7.38 5.69 4.71 4.04 3.76 2.78 2.41 2.27 2.27 2.00 1.64 1.61 1.57 1.47 1.46 1.43 1.42 1.32 1.32 1.31 1.19 1.19 1.11 1.05 1.04 1 1 1 1 2 2 1 1 1 1 1 2 2 1 1 1 1 2 1 2 2 1 2 1 1 D:z2 D:x2-y2 D:z2 D:x2-y2 P:y P:z D:x2-y2 D:yz D:z2 D:xy D:z2 P:y P:y D:z2 D:xy D:xy D:z2 P:y D:xy P:x P:z D:x2-y2 P:y D:x2-y2 D:xy -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.00 4 4 5 5 31 79 12 4 9 4 2 33 79 13 5 13 19 54 2 33 54 9 34 13 6 Mo Mo Mo Mo S S Mo Mo Mo Mo Mo S S Mo Mo Mo Mo S Mo S S Mo S Mo Mo -2.752 0.00 1073 A 6.11 3.80 3.44 2.97 2.57 2.13 2.08 2.07 1.88 1.85 1.74 1.71 1.54 1.41 1.18 1.05 1.05 1.04 1.03 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 2 1 1 1 D:xz D:xy D:x2-y2 D:x2-y2 D:z2 P:x D:x2-y2 D:xy D:xy D:x2-y2 D:xy D:yz D:yz D:z2 D:xy P:z D:xz D:z2 D:xy -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 21 7 9 5 4 56 13 9 18 12 10 6 11 13 12 80 1 25 25 Mo Mo Mo Mo Mo S Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo Mo -2.738 0.00 1074 A 4.02 3.85 2.96 2.79 2.73 2.65 2.62 2.56 2.23 2.15 2.06 2.04 1.93 1.77 1.69 1.66 1.66 1.64 1.55 1.38 1.35 1.24 1.19 1.13 1.07 1.01 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xz D:yz P:z D:xz P:z D:z2 D:yz P:z D:yz D:z2 D:xz P:z D:x2-y2 D:xy D:z2 D:xz D:yz D:x2-y2 D:yz D:xz D:z2 D:x2-y2 D:x2-y2 D:xy P:y D:x2-y2 P:y -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 0.80 0.80 1.33 0.80 1.33 0.80 0.80 1.33 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 191 190 138 189 139 192 188 137 189 186 190 136 196 190 194 188 191 189 187 193 196 195 194 187 144 186 134 W W O W O W W O W W W O W W W W W W W W W W W W O W O -2.736 0.00 1075 A 3.94 3.44 2.91 2.90 2.41 2.32 2.21 2.13 2.08 2.02 1.96 1.94 1.92 1.87 1.73 1.71 1.62 1.52 1.51 1.29 1.25 1.23 1.13 1.13 1.12 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:x2-y2 D:z2 D:xy D:x2-y2 D:xz P:x D:xy D:yz D:xy D:xz P:x D:xy P:x D:z2 D:yz D:z2 D:xz D:xz D:x2-y2 P:x D:xz P:y D:xz P:z P:y P:z -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.33 191 195 186 189 186 134 185 196 188 185 144 196 133 185 188 193 187 189 187 135 194 137 196 136 139 143 W W W W W O W W W W O W O W W W W W W O W O W O O O -2.734 0.00 1076 A 4.44 4.24 2.98 2.77 2.77 2.66 2.64 2.51 2.23 2.08 1.93 1.93 1.93 1.92 1.87 1.86 1.74 1.72 1.66 1.65 1.63 1.60 1.56 1.48 1.47 1.45 1.24 1.20 1.16 1.13 1.07 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:x2-y2 D:x2-y2 D:yz P:y P:y D:xy D:xy D:yz D:yz P:y D:xz P:y D:xz D:xy D:yz D:xz D:z2 D:z2 D:x2-y2 D:xz D:z2 D:xy D:z2 P:x D:xy P:x D:z2 D:xy P:x D:x2-y2 P:x -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 0.80 1.33 0.80 1.33 188 190 192 140 143 193 194 195 194 142 192 141 195 195 193 185 196 186 192 186 187 189 185 138 192 136 194 191 133 195 134 W W W O O W W W W O W O W W W W W W W W W W W O W O W W O W O -2.727 0.00 1077 A 8.24 4.42 3.08 3.06 3.03 2.53 2.45 2.28 2.22 1.82 1.76 1.72 1.53 1.50 1.49 -1.42 1.40 1.37 1.37 -1.36 1.16 1.04 1.04 1.03 1.00 1 1 1 2 1 1 1 1 1 1 2 1 1 1 1 2 2 1 1 2 1 1 1 1 2 D:xy D:xy D:z2 P:y D:x2-y2 D:x2-y2 D:z2 D:x2-y2 D:xz D:x2-y2 P:x D:x2-y2 D:z2 D:xy D:xy D:xy P:x D:yz D:x2-y2 D:xy D:z2 S D:xy D:z2 P:x -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 3.575 -7.014 -3.733 -3.733 3.575 -3.733 -6.493 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 0.00 1.33 1.00 1.00 0.00 1.00 1.00 1.00 1.00 1.33 20 21 21 75 4 20 18 27 21 19 75 17 20 25 14 20 51 16 16 21 9 153 16 28 74 Mo Mo Mo S Mo Mo Mo Mo Mo Mo S Mo Mo Mo Mo Mo S Mo Mo Mo Mo H Mo Mo S -2.701 0.00 1078 A 7.71 5.70 5.61 5.03 3.52 3.41 2.96 2.56 2.48 2.47 2.47 2.32 2.30 2.16 1.90 1.64 1.60 1.56 1.46 1.35 1.34 -1.30 1.25 1.14 -1.06 1.03 1 1 1 1 2 1 1 1 1 2 2 2 1 1 1 2 1 1 1 1 1 2 2 2 2 1 D:xy D:z2 D:x2-y2 D:xy P:y D:xy D:z2 D:xy D:z2 P:x P:x P:x D:x2-y2 D:z2 D:x2-y2 P:y D:x2-y2 D:z2 D:xy D:xy D:z2 D:xy P:y S D:xy 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38 61 88 18 73 17 20 25 24 12 12 34 25 50 7 4 57 17 38 19 12 Mo Mo Mo Mo Mo Mo Mo Mo Mo S S S Mo S Mo Mo Mo Mo Mo Mo S Mo S Mo Mo S Mo S Mo Mo -2.612 0.00 1083 A 6.74 6.05 3.47 3.37 2.84 2.65 2.64 2.41 2.41 2.20 2.16 1.69 1.65 1.64 1.64 1.64 1.41 1.26 1.12 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 2 1 2 2 D:xz D:xz D:x2-y2 D:xy D:yz P:y D:yz D:x2-y2 D:x2-y2 D:x2-y2 D:xy D:z2 D:xz D:xy D:x2-y2 P:x D:xz P:x P:y -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 21 15 13 7 28 52 2 19 2 20 19 4 8 5 27 57 1 53 45 Mo Mo Mo Mo Mo S Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo S S -2.603 0.00 1084 A 10.49 10.35 4.84 4.57 3.77 3.69 3.35 3.35 1.58 1.57 1.53 1.43 1.42 1.32 1.31 1.27 1.24 1.24 1.21 1.21 1.14 1.11 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 D:z2 P:y P:y P:x P:x P:y D:x2-y2 P:y D:z2 P:y P:z D:z2 D:x2-y2 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192 191 189 W W W W O O W W O O W W W O O O O W W W -2.585 0.00 1086 A 6.93 6.03 5.69 4.88 4.18 3.26 3.00 2.56 2.41 2.32 2.11 2.10 2.05 1.69 1.68 1.65 1.59 1.50 1.39 1.37 1.24 1.21 1.15 1.14 1.11 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:z D:z2 D:x2-y2 D:x2-y2 P:z P:z D:x2-y2 P:x P:z P:z D:x2-y2 P:x P:y P:z P:z D:x2-y2 D:x2-y2 P:y -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 1.33 0.80 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 195 193 185 187 186 196 192 143 194 193 185 141 133 195 143 135 134 186 141 133 144 140 187 194 135 W W W W W W W O W W W O O W O O O W O O O O W W O -2.565 0.00 1087 A 11.39 4.25 3.47 3.38 2.82 2.48 2.37 2.27 2.18 1.83 1.64 1.56 1.50 1.44 1.42 1.30 1.25 1.22 1.21 1.21 1.18 1.13 -1.12 1.11 1.08 1.07 1.05 1.03 1 1 1 1 1 1 1 1 2 1 1 2 2 2 1 1 1 2 1 2 1 2 2 1 1 1 1 1 D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:yz D:xz D:xy D:x2-y2 P:x D:z2 D:xy P:z P:x P:y D:x2-y2 D:z2 D:x2-y2 P:y D:xy P:z D:x2-y2 P:y D:xz D:yz D:yz D:xy D:xz D:yz -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 3.575 -3.733 -3.733 -3.733 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 0.00 1.00 1.00 1.00 1.00 1.00 10 5 4 2 10 15 5 7 56 5 6 36 95 43 3 6 13 63 3 95 12 40 10 4 15 4 8 6 Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo S S S Mo Mo Mo S Mo S Mo S Mo Mo Mo Mo Mo Mo -2.556 0.00 1088 A 6.31 4.64 3.71 3.10 3.06 2.62 2.50 2.31 2.07 1.82 1.82 1.75 1.72 1.57 1.54 1.52 1.48 1.47 1.43 1.40 -1.32 1.30 1.23 1.19 1.16 1.15 1.04 -1.02 1 1 1 1 1 1 2 2 1 2 1 1 2 1 1 1 1 1 2 1 2 2 2 1 1 1 1 2 D:z2 D:xy D:yz D:xy D:xy D:xy P:x P:x D:x2-y2 P:x D:xy D:x2-y2 P:x D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:x2-y2 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8 13 11 6 2 54 6 54 6 18 7 66 8 23 9 2 42 71 48 5 16 17 80 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo S Mo Mo Mo S Mo Mo Mo Mo S S S Mo Mo Mo S -2.495 0.00 1091 A 6.25 5.06 3.07 3.01 2.83 2.57 2.36 2.30 2.01 1.96 1.95 1.86 1.72 1.65 1.51 1.46 1.45 1.43 1.42 1.35 1.21 1.18 1.13 1.12 1.05 1 1 1 1 2 1 2 2 1 1 1 1 1 1 2 2 1 2 1 1 2 1 1 2 1 D:xz D:x2-y2 D:x2-y2 D:yz P:y D:yz P:y P:y D:xz D:xy D:z2 D:z2 D:xy D:xy P:y P:x D:xy P:y D:xy D:xy P:y D:yz D:yz P:y D:x2-y2 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 8 18 12 28 38 10 42 43 10 17 19 2 19 12 59 53 18 39 4 6 34 14 13 52 7 Mo Mo Mo Mo S Mo S S Mo Mo Mo Mo Mo Mo S S Mo S Mo Mo S Mo Mo S Mo -2.486 0.00 1092 A 3.42 3.23 2.98 2.98 2.92 2.34 2.24 2.24 2.21 2.16 2.02 1.75 1.74 1.70 1.58 1.50 1.37 1.14 1.08 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:yz D:yz D:xz D:xz D:xy P:z P:z P:z P:z D:z2 D:xz D:z2 D:yz D:xz D:yz D:x2-y2 D:xy D:xy -3.733 -4.498 -4.498 -4.498 -4.498 -3.733 -9.089 -9.089 -9.089 -9.089 -3.733 -4.498 -3.733 -4.498 -4.498 -4.498 -3.733 -3.733 -3.733 1.00 0.80 0.80 0.80 0.80 1.00 1.33 1.33 1.33 1.33 1.00 0.80 1.00 0.80 0.80 0.80 1.00 1.00 1.00 11 188 190 191 189 12 136 137 139 138 6 188 16 191 190 189 11 16 4 Mo W W W W Mo O O O O Mo W Mo W W W Mo Mo Mo -2.483 0.00 1093 A 3.54 3.17 2.18 2.17 1.93 1.65 1.53 1.47 1.44 1.41 1.38 1.36 1.33 1.26 1.22 1.18 1.17 1.12 1.08 1.01 1 1 2 1 1 2 1 1 1 1 1 1 1 1 1 1 2 1 1 1 D:x2-y2 D:xz P:y D:x2-y2 D:x2-y2 P:y D:xz D:xz D:yz D:z2 D:xy D:z2 D:z2 D:yz D:xz D:x2-y2 P:y D:z2 P:z P:z -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -4.498 -3.733 -4.498 -3.733 -3.733 -3.733 -3.733 -4.498 -4.498 -3.733 -7.014 -3.733 -9.089 -9.089 1.00 1.00 1.33 1.00 1.00 1.33 0.80 1.00 0.80 1.00 1.00 1.00 1.00 0.80 0.80 1.00 1.33 1.00 1.33 1.33 12 8 66 24 18 61 191 1 190 25 9 11 17 188 189 7 42 6 139 137 Mo Mo S Mo Mo S W Mo W Mo Mo Mo Mo W W Mo S Mo O O -2.475 0.00 1094 A 3.58 3.50 3.43 3.42 3.15 3.07 3.02 2.90 2.77 2.76 2.74 2.73 2.71 2.70 2.64 2.54 2.47 2.45 2.39 2.32 1.95 1.82 1.77 1.63 1.63 1.59 1.55 1.54 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xy D:xz D:xy D:xz D:xy P:x P:x D:yz D:xy D:xz P:y D:yz D:yz D:yz P:y P:x P:y P:x P:y D:xz D:xy D:xy D:xy D:x2-y2 D:xy D:x2-y2 D:x2-y2 D:x2-y2 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 186 185 185 186 193 133 134 194 194 187 143 192 193 195 140 135 141 144 142 196 195 187 196 192 192 195 187 196 W W W W W O O W W W O W W W O O O O O W W W W W W W W W -2.472 0.00 1095 A 5.14 3.11 2.58 2.47 2.43 2.40 1.85 1.60 1.54 1.52 1.38 1.36 1.34 1.30 1.23 1.23 1.18 1.11 1.02 1.01 1 1 1 1 1 1 1 1 1 1 2 2 1 1 2 1 1 1 2 1 D:xy D:xz D:z2 D:x2-y2 D:z2 D:xy D:xy D:x2-y2 D:z2 D:xy P:x P:x D:xy D:xy P:x D:x2-y2 D:xy D:z2 P:x D:z2 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 12 8 2 7 11 17 19 11 16 13 37 31 11 4 42 6 9 4 66 24 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S S Mo Mo S Mo Mo Mo S Mo -2.460 0.00 1096 A 3.95 3.95 3.58 3.20 2.93 2.80 2.63 2.45 2.39 2.28 2.12 2.03 1.97 1.86 1.66 1.58 1.51 1.29 1.27 1.26 1.24 1.23 1.21 1.14 1.14 1.13 1.07 1.04 1 1 1 1 1 1 1 1 1 1 2 1 1 2 2 1 1 1 1 2 1 2 2 1 2 1 2 2 D:z2 D:xy D:x2-y2 D:z2 D:z2 D:xy D:z2 D:z2 D:xy D:z2 P:x D:x2-y2 D:x2-y2 P:x P:x D:yz D:xy D:xy D:xy P:x D:x2-y2 P:y P:x D:z2 P:y D:xz P:x P:x -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.33 1.33 18 17 20 11 19 27 16 17 18 27 89 25 18 65 41 16 28 25 19 90 17 67 75 6 87 14 74 52 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo S S Mo Mo Mo Mo S Mo S S Mo S Mo S S -2.452 0.00 1097 A 6.64 6.08 4.83 4.41 3.03 2.82 2.22 1.99 1.90 1.89 1.74 1.69 1.63 1.55 1.34 1.30 -1.21 1.20 1.19 -1.18 1.09 1.08 1.07 1.05 1.04 1.03 1.01 1 1 1 1 2 1 1 2 1 1 2 1 1 2 1 1 2 1 1 2 1 1 2 1 2 1 2 D:xy D:x2-y2 D:z2 D:xy P:y D:z2 D:x2-y2 P:y D:xy D:x2-y2 P:y D:x2-y2 D:x2-y2 P:x D:x2-y2 D:xy D:xy D:xy D:xz D:x2-y2 D:yz D:z2 P:x D:z2 P:y D:x2-y2 S -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 3.575 -3.733 -3.733 3.575 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -4.108 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 0.00 1.00 1.00 0.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 18 17 17 13 42 18 24 48 2 23 66 19 12 42 9 19 18 28 15 17 20 23 49 24 71 18 17 Mo Mo Mo Mo S Mo Mo S Mo Mo S Mo Mo S Mo Mo Mo Mo Mo Mo Mo Mo S Mo S Mo Mo -2.422 0.00 1098 A 4.67 3.32 3.10 2.51 2.45 2.19 2.18 2.12 2.00 1.97 1.92 1.90 1.87 1.77 1.68 1.58 1.53 1.50 1.47 1.46 1.43 1.38 1.35 1.33 1.23 1.15 1.10 1.08 1.01 1 1 1 1 2 1 1 1 1 2 1 1 1 1 1 1 1 2 1 1 2 1 2 1 2 1 1 2 1 D:yz D:yz D:xz D:z2 P:z D:xz D:z2 D:x2-y2 D:xy P:x D:xy D:z2 D:x2-y2 D:xz D:xz D:x2-y2 D:z2 P:y D:z2 D:z2 P:y D:xz P:x D:xz P:y D:z2 D:xz P:y D:x2-y2 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.00 21 28 19 25 49 13 12 25 24 50 13 24 24 15 18 26 17 73 23 18 75 10 61 20 48 7 14 52 23 Mo Mo Mo Mo S Mo Mo Mo Mo S Mo Mo Mo Mo Mo Mo Mo S Mo Mo S Mo S Mo S Mo Mo S Mo -2.403 0.00 1099 A 9.50 9.20 3.39 3.27 3.23 2.99 2.81 2.72 1.72 1.66 1.56 1.50 1.39 1.22 1.21 1.17 1.08 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xy D:xy D:x2-y2 D:x2-y2 P:x D:x2-y2 P:x D:xz D:x2-y2 D:xz P:z P:z -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 0.80 0.80 1.33 1.33 188 190 196 187 194 193 190 188 186 185 121 192 124 195 195 192 124 131 W W W W W W W W W W O W O W W W O O -2.397 0.00 1100 A 4.12 4.06 3.56 3.55 2.89 2.43 2.32 2.24 2.15 2.05 1.52 1.39 1.38 1.23 1.19 1.18 1.18 1.10 1.09 1.03 1.03 1 1 1 1 1 2 1 1 1 1 1 2 1 1 1 1 2 1 1 1 2 D:xy D:xy D:z2 D:z2 D:x2-y2 P:x D:x2-y2 D:xy D:x2-y2 D:xy D:x2-y2 P:x D:x2-y2 D:z2 D:z2 D:x2-y2 P:y D:xy D:xy D:xy P:x -3.733 -3.733 -4.498 -4.498 -3.733 -7.014 -3.733 -3.733 -4.498 -3.733 -4.498 -7.014 -4.498 -3.733 -3.733 -4.498 -7.014 -4.498 -4.498 -3.733 -7.014 1.00 1.00 0.80 0.80 1.00 1.33 1.00 1.00 0.80 1.00 0.80 1.33 0.80 1.00 1.00 0.80 1.33 0.80 0.80 1.00 1.33 2 11 189 191 7 54 5 18 185 7 186 42 187 17 12 192 33 191 189 17 81 Mo Mo W W Mo S Mo Mo W Mo W S W Mo Mo W S W W Mo S -2.396 0.00 1101 A 5.67 4.79 4.62 2.92 2.41 2.15 1.76 1.60 1.56 1.44 1.44 1.36 1.17 -1.07 1.01 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 D:xy D:z2 D:z2 D:x2-y2 D:z2 D:x2-y2 D:x2-y2 D:xy D:xy D:xy P:x D:x2-y2 D:x2-y2 D:xy D:z2 -3.733 -4.498 -4.498 -4.498 -3.733 -4.498 -4.498 -4.498 -4.498 -3.733 -7.014 -4.498 -4.498 3.575 -3.733 1.00 0.80 0.80 0.80 1.00 0.80 0.80 0.80 0.80 1.00 1.33 0.80 0.80 0.00 1.00 11 191 189 195 12 192 193 189 191 17 81 194 186 11 2 Mo W W W Mo W W W W Mo S W W Mo Mo -2.393 0.00 1102 A 4.13 3.74 2.95 2.80 2.38 2.21 1.89 1.87 1.85 1.85 1.78 1.67 1.50 1.37 1.34 1.22 1.17 1.14 1.12 1.10 1.10 1.08 1 1 1 1 2 1 1 1 1 2 2 1 1 1 1 1 2 1 1 2 1 1 D:yz D:xz D:xy D:x2-y2 P:y D:z2 D:xy D:xy D:x2-y2 P:y P:y D:z2 D:z2 D:z2 D:x2-y2 D:xy P:x D:x2-y2 D:x2-y2 P:y D:z2 D:x2-y2 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -4.498 -4.498 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -4.498 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 0.80 0.80 1.00 1.00 1.33 1.00 1.00 1.33 1.00 0.80 28 3 7 23 71 24 2 24 17 52 48 12 189 191 2 11 38 24 3 29 23 186 Mo Mo Mo Mo S Mo Mo Mo Mo S S Mo W W Mo Mo S Mo Mo S Mo W -2.384 0.00 1103 A 2.00 2.00 1.96 1.94 1.94 1.82 1.82 1.80 1.78 1.75 1.73 1.69 1.67 1.66 1.65 1.48 1.46 1.42 1.40 1.35 1.32 1.13 1.12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:yz D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:xz D:z2 D:x2-y2 D:xz D:x2-y2 D:yz D:x2-y2 D:x2-y2 D:yz D:xz D:xz -4.498 -4.498 -3.733 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -3.733 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 0.80 0.80 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 193 195 20 192 192 194 187 194 185 186 187 196 9 196 185 194 186 187 195 193 196 192 193 W W Mo W W W W W W W W W Mo W W W W W W W W W W -2.373 0.00 1104 A 5.45 3.70 1.77 1.74 1.73 1.72 1.58 1.43 1.24 1.21 1.20 1.12 1.11 1.03 1 1 1 1 1 1 2 1 1 1 2 2 1 1 D:yz D:xz D:xz D:xz D:xz D:yz P:x D:yz D:xz D:yz P:y P:x D:z2 D:yz -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.00 20 9 8 5 15 8 62 9 7 5 44 39 17 19 Mo Mo Mo Mo Mo Mo S Mo Mo Mo S S Mo Mo -2.366 0.00 1105 A 4.96 3.83 3.51 2.61 2.39 2.24 2.04 1.73 1.57 1.57 1.43 1.38 1.36 1.31 1.30 1.30 1.25 1.24 1.23 1.20 1.19 1.18 1.17 1.17 1.06 1.03 1.01 1.01 1.00 1 2 1 1 1 1 1 1 2 1 2 2 1 1 1 1 1 2 1 1 1 1 1 1 1 2 2 2 2 D:xy P:x D:xz D:z2 D:z2 D:xy D:x2-y2 D:xy P:x D:xy P:x P:y D:xy D:xy D:z2 D:xy D:yz P:y D:xz D:xz D:yz D:x2-y2 D:yz D:x2-y2 D:yz P:y P:y P:z P:x -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 4 31 1 2 4 17 13 11 54 2 79 62 13 5 7 18 1 61 4 10 9 5 14 24 13 67 57 61 71 Mo S Mo Mo Mo Mo Mo Mo S Mo S S Mo Mo Mo Mo Mo S Mo Mo Mo Mo Mo Mo Mo S S S S -2.344 0.00 1106 A 8.18 6.62 5.40 3.84 3.44 2.32 2.10 1.97 1.67 1.60 1.49 1.40 1.36 1.27 1.26 1.20 1.17 1.12 1.10 1.04 1 1 1 1 1 2 2 1 2 2 2 2 1 1 1 2 2 2 2 1 D:xz D:yz D:yz D:yz D:yz P:y P:y D:yz P:y P:y P:y P:y D:yz D:yz D:yz P:y P:x P:z P:y D:yz -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 3 9 13 28 8 57 55 14 34 32 52 38 18 26 3 61 73 30 62 6 Mo Mo Mo Mo Mo S S Mo S S S S Mo Mo Mo S S S S Mo -2.321 0.00 1107 A 6.97 3.83 3.29 2.71 2.45 2.20 2.06 1.99 1.96 1.83 1.65 1.61 1.56 1.36 1.34 1.30 1.27 1.25 1.25 1.25 1.18 1.18 1.03 1.02 1 1 1 1 2 1 1 1 2 2 1 2 1 1 2 1 1 1 1 1 1 1 2 1 D:xz D:xz D:x2-y2 D:x2-y2 P:y D:yz D:x2-y2 D:x2-y2 P:y P:y D:xz P:y D:z2 D:yz P:z D:xy D:z2 D:x2-y2 D:yz D:z2 D:xy D:xz P:y D:xz -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 3 1 25 26 73 20 24 7 87 88 9 86 12 14 91 2 25 4 1 26 11 7 55 13 Mo Mo Mo Mo S Mo Mo Mo S S Mo S Mo Mo S Mo Mo Mo Mo Mo Mo Mo S Mo -2.290 0.00 1108 A 17.09 4.43 3.42 3.00 2.88 2.49 2.39 2.03 1.99 1.97 1.85 1.72 1.70 1.64 1.44 1.43 1.38 1.34 1.33 1.31 1.23 1.19 1.17 1.10 1 1 2 1 2 2 1 1 1 1 1 2 1 1 1 1 1 2 1 2 1 2 2 2 D:xz D:x2-y2 P:y D:xy P:z P:y D:xy D:z2 D:xy D:x2-y2 D:x2-y2 P:x D:xz D:yz D:yz D:yz D:x2-y2 P:z D:xy P:y D:yz P:x P:y P:y -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1 2 53 4 91 54 18 4 3 24 25 91 3 2 3 5 12 98 1 86 1 31 87 29 Mo Mo S Mo S S Mo Mo Mo Mo Mo S Mo Mo Mo Mo Mo S Mo S Mo S S S -2.281 0.00 1109 A 6.09 4.31 3.84 3.13 2.94 2.82 2.75 2.49 2.17 2.05 2.01 2.01 2.00 1.85 1.85 1.82 1.77 1.56 1.48 1.43 1.39 1.36 1.36 1.26 1.24 1.22 1 2 1 1 1 1 2 2 1 2 2 1 1 1 1 2 1 1 2 1 1 1 2 2 2 2 D:xy P:x D:xy D:x2-y2 D:x2-y2 D:xy P:x P:x D:xy P:y P:y D:xy D:x2-y2 D:yz D:z2 P:y D:x2-y2 D:xy P:x D:z2 D:yz D:xy P:x P:x P:y P:x -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 11 60 6 24 25 4 37 54 2 87 86 12 26 4 6 50 12 24 81 23 10 18 33 80 88 31 Mo S Mo Mo Mo Mo S S Mo S S Mo Mo Mo Mo S Mo Mo S Mo Mo Mo S S S S -2.271 0.00 1110 A 10.27 4.61 4.37 3.31 3.02 2.86 2.84 2.73 2.64 2.52 2.36 2.30 2.21 2.08 2.07 1.99 1.88 1.54 1.54 -1.50 1.43 1.29 1.21 1.14 1.11 1.05 1.01 1 2 2 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 2 1 2 2 2 1 2 1 D:xy P:x P:x D:x2-y2 D:x2-y2 D:yz D:z2 D:z2 D:z2 D:z2 D:xy D:xz D:yz D:xz P:y P:x D:xz D:yz D:yz D:xy D:yz P:y P:y P:z D:yz P:z D:x2-y2 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 3.575 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 0.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 6 37 80 7 12 10 7 11 12 6 11 19 3 10 56 60 7 21 5 6 27 78 31 56 2 57 5 Mo S S Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S S Mo Mo Mo Mo Mo S S S Mo S Mo -2.221 0.00 1111 A 5.82 5.68 4.29 4.04 3.75 3.21 2.29 2.12 1.94 1.88 1.88 1.63 1.53 1.43 1.37 1.37 1.29 -1.28 1.21 1.19 1.12 1.09 1.08 1.03 1.01 1 1 1 1 1 1 1 1 1 2 2 1 1 2 1 1 1 2 2 1 2 1 2 1 2 D:yz D:x2-y2 D:xy D:x2-y2 D:xz D:x2-y2 D:yz D:yz D:yz P:z P:x D:xz D:xy P:x D:z2 D:xy D:yz D:x2-y2 P:y D:z2 P:x D:x2-y2 P:y D:z2 P:y -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 3.575 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 0.00 1.33 1.00 1.33 1.00 1.33 1.00 1.33 10 7 6 2 19 12 27 21 3 33 80 10 4 75 7 5 2 7 35 12 52 4 29 11 33 Mo Mo Mo Mo Mo Mo Mo Mo Mo S S Mo Mo S Mo Mo Mo Mo S Mo S Mo S Mo S -2.171 0.00 1112 A 16.56 3.66 3.18 2.99 2.58 2.28 2.03 1.90 1.79 1.71 1.62 1.57 1.43 1.42 1.33 1.26 1.23 1.10 1.09 1.06 1.05 1 2 1 2 2 1 1 1 1 1 2 1 1 2 1 1 1 1 1 2 1 D:yz P:x D:xz P:y P:y D:xz D:xz D:yz D:xz D:yz P:x D:x2-y2 D:yz P:x D:yz D:z2 P:z D:yz D:xz P:x D:xz -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -9.089 -3.733 -3.733 -7.014 -3.733 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 22 84 22 83 71 14 23 28 16 25 83 23 10 47 23 16 100 21 12 40 8 Mo S Mo S S Mo Mo Mo Mo Mo S Mo Mo S Mo Mo O Mo Mo S Mo -2.110 0.00 1113 A 11.93 5.23 4.55 4.50 4.38 3.27 3.17 2.58 2.57 2.30 1.88 1.77 1.52 -1.47 1.39 1.34 1.32 1.31 1.29 1.24 1.23 1.20 1.18 1.09 -1.06 1 1 1 2 1 1 1 2 2 1 2 2 2 2 2 2 1 1 1 1 2 1 1 1 2 D:xy D:x2-y2 D:yz P:x D:x2-y2 D:xy S P:x P:y D:xy P:y P:x P:y D:x2-y2 P:y P:x D:yz D:xz S D:z2 S S D:z2 D:yz D:xy -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -6.493 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 3.575 -0.555 -7.014 -3.733 -3.733 -6.493 -3.733 -4.108 -6.493 -3.733 -3.733 3.575 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 0.00 0.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 0.00 28 27 22 90 21 27 152 46 74 21 89 92 92 27 28 89 14 5 155 21 28 160 28 20 28 Mo Mo Mo S Mo Mo H S S Mo S S S Mo Mo S Mo Mo H Mo Mo H Mo Mo Mo -2.102 0.00 1114 A 8.51 3.62 2.18 2.03 1.89 1.86 1.85 1.83 1.78 1.68 1.58 1.58 1.56 1.50 1.48 1.40 1.35 1.34 1.28 1.28 1.21 1.17 1.16 1.15 1.15 1.14 1.13 1.02 1.01 1.01 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 2 1 2 2 2 1 1 2 2 2 2 1 2 2 1 D:yz D:xy D:yz D:xz D:xz S P:x D:yz D:xy D:x2-y2 D:xz D:x2-y2 D:yz D:xz D:xz P:x D:xz P:y P:x P:y D:yz D:yz P:y P:x P:x P:y D:yz P:y P:x D:xz -3.733 -3.733 -3.733 -3.733 -3.733 -6.493 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 22 28 21 22 14 152 84 25 27 27 4 21 20 17 8 40 20 83 90 44 19 13 69 46 63 68 8 59 92 21 Mo Mo Mo Mo Mo H S Mo Mo Mo Mo Mo Mo Mo Mo S Mo S S S Mo Mo S S S S Mo S S Mo -2.078 0.00 1115 A 7.45 5.50 5.43 4.62 3.66 2.92 2.90 2.42 2.30 2.29 2.01 1.87 1.68 1.64 1.62 1.57 1.53 -1.42 1.40 1.24 1.23 1.21 1.05 1.03 1 1 1 1 1 2 2 1 1 1 1 2 2 2 1 2 1 2 1 1 2 2 1 2 D:yz D:xz D:xz D:yz D:yz P:y P:y D:yz D:xz D:yz D:yz P:x P:z P:z D:yz P:x D:xz D:yz D:xz D:yz P:x P:x D:yz P:y -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 3.575 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 0.00 1.00 1.00 1.33 1.33 1.00 1.33 14 18 5 20 12 62 39 25 9 22 5 57 49 72 21 34 24 14 13 19 40 67 10 37 Mo Mo Mo Mo Mo S S Mo Mo Mo Mo S S S Mo S Mo Mo Mo Mo S S Mo S -2.054 0.00 1116 A 7.01 5.42 4.80 4.02 3.88 3.27 2.56 2.40 2.34 1.96 1.85 1.81 1.69 1.68 1.67 1.62 1.55 1.34 1.28 1.28 1.13 1.11 1.09 -1.07 -1.04 1.03 1.02 1.02 1 1 1 1 1 2 2 1 1 2 1 1 1 1 1 2 2 2 1 2 2 1 2 2 2 2 1 2 D:yz D:yz D:yz D:yz D:yz P:x P:x D:xz D:xz P:y D:xz D:xz D:xz D:x2-y2 D:xz P:y P:y P:x D:xz P:x P:z D:yz P:y D:yz D:yz P:z D:xz P:z -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 3.575 3.575 -7.014 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 0.00 0.00 1.33 1.00 1.33 8 19 9 15 7 35 59 17 9 40 2 15 6 4 14 63 32 69 4 45 56 1 55 8 9 33 10 55 Mo Mo Mo Mo Mo S S Mo Mo S Mo Mo Mo Mo Mo S S S Mo S S Mo S Mo Mo S Mo S -2.042 0.00 1117 A 4.10 2.94 2.71 2.51 2.35 2.31 2.22 1.89 1.65 1.62 1.60 1.55 1.49 1.42 1.40 1.38 1.38 1.37 1.25 1.24 1.15 1.15 1.13 1.12 1.11 1.11 1.11 1.10 1.10 1.04 1 1 1 1 1 1 1 1 2 2 1 1 2 1 1 2 1 2 1 1 2 2 1 1 2 2 2 1 2 1 D:yz D:xz D:xz D:yz D:xz D:yz D:x2-y2 D:xz P:y P:y D:yz D:xz P:y D:yz D:xz P:y D:xz P:y D:yz D:xz P:x P:x D:yz D:xz P:y P:x P:y D:xz P:x D:x2-y2 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 15 6 15 18 9 19 2 12 51 67 27 7 31 5 3 78 18 40 26 8 69 60 1 22 41 44 43 2 45 1 Mo Mo Mo Mo Mo Mo Mo Mo S S Mo Mo S Mo Mo S Mo S Mo Mo S S Mo Mo S S S Mo S Mo -1.999 0.00 1118 A 13.34 3.72 3.61 3.34 2.64 2.51 2.32 2.05 2.00 -1.96 1.51 1.42 1.37 1.30 1.26 1.23 1.22 1.21 1.19 1.14 1.10 1.01 1 1 2 2 2 2 1 2 1 2 1 2 1 1 2 1 1 1 1 1 2 1 D:xz D:xz P:y P:y P:x P:x D:yz P:x D:xz D:xz D:yz P:y S D:xz P:z D:xz D:yz D:yz D:xz D:xz P:x S -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 3.575 -3.733 -7.014 -6.493 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -6.493 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 0.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 20 15 45 69 51 74 18 64 21 20 8 32 179 18 51 9 26 21 3 8 95 176 Mo Mo S S S S Mo S Mo Mo Mo S H Mo S Mo Mo Mo Mo Mo S H -1.994 0.00 1119 A 2.54 2.43 2.13 1.93 1.90 1.90 1.88 1.81 1.80 1.72 1.69 1.67 1.55 1.36 1.35 1.35 1.34 1.32 1.29 1.27 1.24 1.03 1.02 1.00 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:yz D:yz S D:xz D:xz D:xz D:xz D:xy D:xy D:x2-y2 D:xy D:xy D:x2-y2 D:yz D:yz D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:xy D:xy D:xz -4.498 -4.498 -13.975 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 0.80 0.80 2.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 186 185 197 192 194 193 195 191 188 192 190 189 195 196 187 190 189 196 187 188 191 193 194 187 W W P W W W W W W W W W W W W W W W W W W W W W -1.988 0.00 1120 A 7.64 4.82 3.42 2.96 2.90 2.38 2.06 1.98 1.89 1.79 1.74 1.55 1.49 1.49 1.39 1.37 1.37 1.36 1.27 1.10 1.08 1.06 1.05 1.03 1.02 1 1 1 1 1 1 2 2 2 2 2 2 1 2 2 1 1 1 1 1 1 2 1 1 2 D:xz D:yz D:xz D:xz D:xz D:xz P:x P:y P:x P:x P:x P:y D:yz P:y P:x D:xz D:yz D:xz D:xz S D:yz P:x D:yz D:yz P:z -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -6.493 -3.733 -7.014 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 14 8 20 15 4 12 40 32 59 63 35 69 28 45 61 7 1 9 21 157 14 54 25 27 52 Mo Mo Mo Mo Mo Mo S S S S S S Mo S S Mo Mo Mo Mo H Mo S Mo Mo S -1.936 0.00 1121 A 4.82 4.27 4.25 3.48 3.19 2.98 2.55 2.41 2.40 2.27 2.24 2.08 1.66 1.60 1.58 1.57 1.56 1.53 1.44 1.41 1.31 1.27 1.15 1.11 1.10 1.01 -1.00 1 1 1 1 2 1 1 1 2 1 2 1 2 1 1 2 1 1 2 1 1 2 1 2 2 1 2 D:yz D:xz D:xz D:yz P:x D:xz D:yz D:yz P:x D:yz P:y D:yz P:y D:yz D:xz P:y D:xz D:xz P:y D:yz D:yz P:y D:xz P:x P:y D:yz D:xz -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 3.575 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.00 0.00 19 17 19 9 50 6 14 7 73 25 72 18 34 17 7 66 5 2 57 15 27 49 26 62 68 24 19 Mo Mo Mo Mo S Mo Mo Mo S Mo S Mo S Mo Mo S Mo Mo S Mo Mo S Mo S S Mo Mo -1.894 0.00 1122 A 5.40 4.93 2.96 2.91 2.70 2.64 2.55 2.44 2.43 2.07 2.01 1.92 1.82 1.82 1.65 1.57 1.53 1.44 1.44 1.37 1.23 1.19 1.18 1.15 1.08 1.03 1.01 1 1 2 2 2 1 1 2 1 1 1 2 2 1 1 2 1 1 1 2 1 2 1 1 2 2 1 D:yz D:z2 P:x P:x P:y D:z2 D:xz P:y D:yz D:xz D:x2-y2 P:y P:x D:z2 D:xy P:x D:xy D:xz D:z2 P:x D:xz P:x D:xz D:xy P:x P:x D:xy -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.00 16 17 48 49 82 24 20 41 17 12 23 71 85 23 23 38 25 23 25 71 13 86 18 24 39 87 11 Mo Mo S S S Mo Mo S Mo Mo Mo S S Mo Mo S Mo Mo Mo S Mo S Mo Mo S S Mo -1.883 0.00 1123 A 8.24 8.23 8.06 8.00 2.47 2.30 1.99 1.94 1.75 1.72 1.72 1.71 1.64 1.62 1.21 1.15 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 D:z2 P:x P:y P:y P:x D:z2 D:z2 D:z2 D:z2 P:x -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 191 189 190 188 186 185 196 187 138 137 139 136 195 192 194 193 139 W W W W W W W W O O O O W W W W O -1.866 0.00 1124 A 3.26 3.07 2.93 2.46 2.24 2.14 2.11 2.01 1.94 1.93 1.83 1.79 1.77 1.70 1.50 1.48 1.44 1.42 1.28 1.17 1.14 1.13 1 1 1 2 1 1 2 1 1 1 1 1 1 2 1 1 1 2 2 2 2 1 D:xy D:z2 D:z2 P:x D:xy D:z2 P:x D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:z2 P:x D:z2 D:z2 D:z2 P:x P:y P:y P:x D:yz -3.733 -3.733 -3.733 -7.014 -3.733 -4.498 -7.014 -3.733 -3.733 -4.498 -4.498 -4.498 -4.498 -7.014 -4.498 -4.498 -4.498 -7.014 -7.014 -7.014 -7.014 -3.733 1.00 1.00 1.00 1.33 1.00 0.80 1.33 1.00 1.00 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.00 26 26 25 73 25 196 88 18 19 186 194 187 193 87 195 185 192 50 50 49 51 17 Mo Mo Mo S Mo W S Mo Mo W W W W S W W W S S S S Mo -1.859 0.00 1125 A 3.90 3.74 3.41 3.30 3.04 3.00 2.94 2.51 2.43 2.33 2.28 2.11 1.91 1.72 1.55 1.35 1.28 1.14 1.13 1.11 1.03 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 2 2 1 1 2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:xy D:z2 D:z2 D:z2 D:z2 P:x P:x D:xy D:z2 D:x2-y2 P:x P:x D:x2-y2 D:x2-y2 P:x -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -3.733 -4.498 -3.733 -4.498 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -4.498 -4.498 -7.014 0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 1.00 0.80 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 0.80 0.80 1.33 194 193 192 195 196 187 26 186 26 185 25 73 88 25 19 18 87 74 194 193 50 W W W W W W Mo W Mo W Mo S S Mo Mo Mo S S W W S -1.854 0.00 1126 A 4.64 2.57 2.49 2.42 2.21 2.06 1.95 1.94 1.73 1.52 1.33 1.32 1.19 1.18 1.10 1.06 1.03 1.02 1 1 1 1 1 1 1 1 1 1 1 2 2 2 1 1 1 2 D:xz D:xz D:xz D:xz D:xz D:yz D:yz D:xz D:xz D:yz D:yz P:y P:x P:y D:yz D:x2-y2 D:yz P:y -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.33 20 3 14 17 13 18 13 5 7 16 21 61 64 38 2 4 5 78 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S S S Mo Mo Mo S -1.817 0.00 1127 A 2.76 2.47 2.26 2.18 2.05 1.95 1.83 1.75 1.66 1.57 1.47 1.45 1.43 1.37 1.36 1.33 1.28 1.22 1.22 1.19 -1.17 1.16 1.15 1.14 1.14 1.13 1.12 -1.09 1.08 1.02 1.02 1.00 1 1 1 1 1 2 2 1 1 1 2 1 1 2 2 1 2 1 1 1 2 2 1 2 1 1 1 2 2 1 1 1 S D:xz S D:yz S P:x P:x D:yz S S P:z D:xz S P:x P:x S P:x D:yz S D:x2-y2 S P:z D:xy P:z D:z2 S D:xy S P:x D:xz D:yz S -6.493 -3.733 -6.493 -3.733 -6.493 -7.014 -7.014 -3.733 -6.493 -6.493 -7.014 -3.733 -6.493 -7.014 -7.014 -6.493 -7.014 -3.733 -6.493 -3.733 2.471 -7.014 -3.733 -7.014 -3.733 -6.493 -3.733 2.471 -7.014 -3.733 -3.733 -6.493 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.00 0.00 1.33 1.00 1.33 1.00 1.00 1.00 0.00 1.33 1.00 1.00 1.00 176 2 157 3 162 97 95 1 146 156 58 9 155 58 59 180 64 14 163 2 146 55 27 98 3 179 3 163 32 12 9 171 H Mo H Mo H S S Mo H H S Mo H S S H S Mo H Mo H S Mo S Mo H Mo H S Mo Mo H -1.809 0.00 1128 A 6.13 4.61 3.98 3.66 3.39 2.97 2.92 2.91 2.87 2.57 2.51 2.46 2.12 1.68 1.55 1.51 1.36 1.16 1.14 1.10 1.06 -1.05 1.04 1.02 1 1 1 2 2 1 1 2 1 2 1 1 2 1 1 1 1 1 2 2 1 2 2 1 D:xz D:x2-y2 D:xy P:y P:y D:xz D:z2 P:y D:x2-y2 P:x D:xz D:yz P:x D:z2 D:yz D:xz D:x2-y2 D:xz P:y P:y D:z2 D:x2-y2 P:y D:yz -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 3.575 -0.555 -3.733 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 0.00 0.00 1.00 11 11 24 81 60 22 11 41 17 49 4 13 86 24 24 24 23 8 83 71 6 17 11 22 Mo Mo Mo S S Mo Mo S Mo S Mo Mo S Mo Mo Mo Mo Mo S S Mo Mo Mo Mo -1.793 0.00 1129 A 6.36 5.70 4.69 4.11 3.48 3.27 2.86 2.63 1.97 1.91 1.79 1.74 1.69 1.57 1.46 1.40 1.32 1.11 1.08 1.05 1.02 1.01 1 1 1 2 2 1 2 2 2 1 1 2 2 1 1 1 2 1 2 1 1 2 D:x2-y2 D:yz D:xz P:x P:y D:xy P:y P:y P:x D:xz D:x2-y2 P:y P:x D:z2 D:yz D:z2 P:x D:xz P:y D:z2 D:xz P:y -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -0.555 -3.733 -3.733 -7.014 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 0.00 1.00 1.00 1.33 11 24 11 72 81 24 37 65 86 22 17 48 65 6 23 11 71 4 11 12 18 41 Mo Mo Mo S S Mo S S S Mo Mo S S Mo Mo Mo S Mo Mo Mo Mo S -1.786 0.00 1130 A 5.64 5.53 3.32 3.29 3.24 3.22 2.85 2.84 2.78 2.49 1.99 1.81 1.81 1.62 1.50 1.49 1.49 1.47 1.42 1.35 1.26 1.24 1.18 1.16 1.09 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xz D:xz D:yz D:xy D:yz D:xy P:z P:z D:xy D:xy D:yz D:yz D:xz D:xz P:y P:x P:z P:y P:x P:z P:y P:y D:xy P:x P:x D:xy -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 191 189 191 196 189 187 139 137 193 194 194 193 196 187 119 112 116 118 109 114 141 142 186 144 135 185 W W W W W W O O W W W W W W O O O O O O O O W O O W -1.770 0.00 1131 A 8.04 5.80 4.68 3.97 3.77 3.50 3.43 3.39 3.13 3.07 2.60 2.26 2.08 2.08 1.86 1.54 1.46 1.39 1.33 1.20 1.20 1.13 1.08 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:yz D:yz D:xz D:xy P:z D:xz D:xz D:xy P:z D:yz P:y P:x D:xy P:x P:y P:z D:xy D:xy D:x2-y2 P:y P:x P:y D:x2-y2 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 0.80 0.80 0.80 1.33 1.33 1.33 0.80 190 188 190 192 138 186 188 186 136 192 117 111 195 134 140 115 194 185 196 120 110 131 186 W W W W O W W W O W O O W O O O W W W O O O W -1.762 0.00 1132 A 4.94 4.12 3.91 3.04 2.90 2.88 2.60 2.60 2.47 2.26 2.03 1.96 1.91 1.85 1.72 1.56 1.52 1.49 1.44 1.32 1.21 1.19 1.17 1.14 1.11 1.07 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xz D:yz D:yz D:yz D:xz D:xz D:xy D:yz D:xz P:y P:x D:xy D:xy D:yz P:y P:y P:x D:xz D:xz P:x D:xy D:xy P:x D:yz P:z P:z P:z -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 0.80 1.33 1.33 1.33 185 195 193 194 196 187 195 188 186 143 133 185 193 192 141 120 135 191 188 110 196 187 144 187 126 128 113 W W W W W W W W W O O W W W O O O W W O W W O W O O O -1.736 0.00 1133 A 4.29 3.94 3.74 2.97 2.95 2.91 2.82 2.79 2.67 2.30 2.05 1.97 1.85 1.82 1.66 1.61 1.60 1.60 1.47 1.34 1.30 1.27 1.23 1.13 1.10 1.07 -1.07 -1.02 1.01 1 1 1 2 2 1 2 1 1 2 1 2 1 2 2 1 2 1 1 2 1 1 2 1 2 2 2 2 2 D:xz D:yz D:yz P:z P:x S P:x S S P:y D:yz P:y S P:z P:y D:xy P:x S D:xz P:x D:xz S P:x D:z2 P:x S S S P:x -3.733 -3.733 -3.733 -7.014 -7.014 -6.493 -7.014 -6.493 -6.493 -7.014 -3.733 -7.014 -6.493 -7.014 -7.014 -3.733 -7.014 -6.493 -3.733 -7.014 -3.733 -6.493 -7.014 -3.733 -7.014 -4.108 2.471 2.471 -7.014 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.00 0.00 0.00 1.33 2 1 3 98 29 155 53 176 171 53 2 77 161 64 51 27 95 184 5 30 20 156 32 3 55 2 146 171 75 Mo Mo Mo S S H S H H S Mo S H S S Mo S H Mo S Mo H S Mo S Mo H H S -1.723 0.00 1134 A 4.58 4.20 4.16 4.00 3.89 3.85 3.66 3.58 3.19 3.11 2.47 2.27 2.21 2.04 1.87 1.60 1.57 1.55 1.54 1.53 1.52 1.46 1.29 1.21 1.05 1.03 1.01 2 1 1 1 2 1 2 1 1 1 1 1 2 2 1 1 1 2 1 2 2 2 2 2 2 2 1 P:x D:yz D:xz D:yz P:x D:yz P:y S D:yz D:xz S D:xz P:x P:x D:xz S D:yz P:x D:xz P:x P:y P:x P:y P:z P:y P:y D:yz -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -6.493 -3.733 -3.733 -6.493 -3.733 -7.014 -7.014 -3.733 -6.493 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 32 1 19 3 55 5 54 162 2 5 184 2 29 53 13 157 4 73 3 30 29 50 79 30 77 78 25 S Mo Mo Mo S Mo S H Mo Mo H Mo S S Mo H Mo S Mo S S S S S S S Mo -1.701 0.00 1135 A 8.30 8.03 7.85 7.67 1.66 1.63 1.61 1.60 1.54 1.47 1.44 1.41 1.39 1.36 1.29 1.10 1.07 1.05 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:y P:x P:y D:xz D:yz D:xz D:yz D:yz D:xz D:yz D:xy D:xz P:x D:xy -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 190 189 188 191 138 137 136 139 186 192 185 194 195 187 193 186 196 123 185 W W W W O O O O W W W W W W W W W O W -1.696 0.00 1136 A 3.13 3.02 2.72 2.43 2.15 2.12 1.97 1.85 1.80 1.79 1.71 1.63 1.61 1.61 1.50 1.48 1.47 1.45 1.45 1.38 1.37 1.37 1.30 1.23 1.15 1.11 1.10 1.09 1.01 1 1 1 2 1 1 1 1 1 1 1 1 2 2 2 2 2 1 2 1 1 1 2 1 2 1 2 1 2 D:yz D:xz D:yz P:y D:yz D:yz D:xz D:yz D:yz S S S P:x P:y P:z P:z P:x D:yz P:x D:yz D:xz D:xz P:x D:xz P:y S P:y D:yz P:y -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -6.493 -6.493 -6.493 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -6.493 -7.014 -3.733 -7.014 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.33 18 18 21 72 27 2 25 13 26 170 151 153 74 73 46 92 72 23 75 7 4 16 51 20 56 160 50 9 51 Mo Mo Mo S Mo Mo Mo Mo Mo H H H S S S S S Mo S Mo Mo Mo S Mo S H S Mo S -1.688 0.00 1137 A 2.81 2.77 2.66 2.18 1.88 1.81 1.66 1.51 1.36 1.33 1.33 1.28 1.26 1.19 1.12 1.12 1.09 1.03 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 2 1 D:yz D:xz D:yz D:yz D:xz D:yz D:yz D:z2 D:z2 D:xz D:yz D:z2 P:x D:xz P:x P:y P:y D:xz -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -4.498 -4.498 -3.733 -3.733 -4.498 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 0.80 0.80 1.00 1.00 0.80 1.33 1.00 1.33 1.33 1.33 1.00 18 16 13 17 17 20 2 193 194 13 21 195 48 9 67 44 78 10 Mo Mo Mo Mo Mo Mo Mo W W Mo Mo W S Mo S S S Mo -1.682 0.00 1138 A 6.96 6.03 4.33 4.23 3.36 3.19 2.64 2.48 2.36 2.30 2.08 1.74 1.66 1.65 1.57 1.49 1.46 1.44 1.37 1.27 1.27 1.19 1.12 1.04 1.01 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:z2 D:z2 D:xz D:xz D:x2-y2 D:xy D:xy D:x2-y2 P:z P:z D:yz P:y D:z2 D:yz P:z P:y P:z D:z2 D:yz D:z2 D:yz D:z2 P:y P:z -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 1.33 187 196 186 185 189 191 187 194 193 196 114 116 189 135 194 191 137 144 139 193 194 195 193 192 142 135 W W W W W W W W W W O O W O W W O O O W W W W W O O -1.675 0.00 1139 A 5.83 4.99 3.20 2.83 1.86 1.74 1.70 1.67 1.57 1.56 1.55 1.32 1.32 1.31 1.27 1.24 1.17 1.15 1.14 1.08 1.07 1.07 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:z2 D:z2 D:xy P:z D:xy D:x2-y2 D:x2-y2 D:x2-y2 P:z D:xz D:x2-y2 D:z2 P:x D:xy P:z D:z2 D:xy P:z P:z D:yz P:x -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -3.733 -9.089 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 0.80 1.33 0.80 0.80 1.33 1.33 1.00 1.33 193 194 192 195 187 127 196 192 195 193 125 187 194 187 109 186 141 196 185 115 113 13 140 W W W W W O W W W W O W W W O W O W W O O Mo O -1.646 0.00 1140 A 3.71 3.65 3.58 3.14 3.05 2.73 1.99 1.87 1.85 1.84 1.81 1.74 1.42 1.37 1.31 1.20 1.18 1.15 1.11 1.02 1 1 1 1 1 2 2 1 1 1 2 1 2 2 2 1 2 2 2 1 D:xy D:yz D:xy D:x2-y2 D:z2 P:x P:x D:z2 D:xz D:x2-y2 P:y D:yz P:x P:y P:y D:xz P:y P:x P:y D:yz -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 26 17 23 16 23 85 48 17 6 23 47 3 88 48 82 14 65 72 41 13 Mo Mo Mo Mo Mo S S Mo Mo Mo S Mo S S S Mo S S S Mo -1.626 0.00 1141 A 6.17 5.25 3.98 3.89 3.43 3.25 2.22 2.19 2.08 1.90 1.75 1.65 1.63 1.60 1.36 1.36 1.33 1.32 1.28 1.24 1.09 1.08 1.07 1.03 1 1 2 1 2 1 1 1 1 2 1 1 1 2 1 2 1 1 1 2 1 1 2 2 D:x2-y2 D:yz P:y D:xy P:y D:xz D:x2-y2 D:x2-y2 D:xz P:x D:yz D:xy D:z2 P:x D:yz P:x D:yz D:yz D:xy P:y D:xy D:yz P:y P:x -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 6 12 37 26 80 12 25 19 13 74 23 25 6 42 5 88 26 14 7 33 12 24 66 87 Mo Mo S Mo S Mo Mo Mo Mo S Mo Mo Mo S Mo S Mo Mo Mo S Mo Mo S S -1.610 0.00 1142 A 3.84 3.40 3.18 3.07 2.73 2.64 2.51 2.47 2.32 1.67 1.54 1.40 1.35 1.28 1.24 1.22 1.18 1.13 1.06 1.03 1 1 2 1 1 1 1 2 1 1 1 1 2 2 1 2 1 1 2 1 D:xz D:yz P:x D:xz D:yz S D:xz P:y D:xz D:xz D:yz D:xz P:x P:z D:xz P:x D:yz D:yz P:x D:xz -3.733 -3.733 -7.014 -3.733 -3.733 -6.493 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 14 23 71 17 15 151 20 47 22 5 4 6 93 63 8 68 27 1 44 19 Mo Mo S Mo Mo H Mo S Mo Mo Mo Mo S S Mo S Mo Mo S Mo -1.603 0.00 1143 A 4.91 2.93 2.85 2.76 2.40 2.04 2.02 1.73 1.72 1.61 1.50 1.48 1.31 1.30 1.23 1.22 1.18 1.16 1.11 1.09 1.06 1.05 1.05 1.02 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 2 2 2 2 1 2 1 2 1 1 D:xz D:xz D:yz D:xz D:yz D:yz D:yz D:x2-y2 D:yz D:xz D:yz D:xz D:yz P:x P:x P:x P:x P:y P:x S P:y D:xy P:y S D:xz -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -6.493 -7.014 -3.733 -7.014 -6.493 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.00 19 7 2 5 12 15 5 6 14 17 1 8 27 32 69 98 44 37 45 157 80 26 73 161 26 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S S S S S S H S Mo S H Mo -1.579 0.00 1144 A 3.78 2.35 2.34 2.27 2.25 2.01 1.84 1.56 1.44 1.43 1.36 1.35 1.35 1.26 1.24 1.23 1.23 1.21 1.20 1.08 1 2 1 1 1 1 2 1 1 2 1 2 1 2 1 1 1 1 1 2 D:yz P:y D:x2-y2 D:x2-y2 D:x2-y2 D:yz P:x D:z2 D:z2 P:x D:xz P:y D:xz P:x D:xz D:xz D:yz D:yz D:yz P:y -3.733 -7.014 -4.498 -4.498 -3.733 -3.733 -7.014 -4.498 -4.498 -7.014 -3.733 -7.014 -4.498 -7.014 -3.733 -4.498 -3.733 -4.498 -4.498 -7.014 1.00 1.33 0.80 0.80 1.00 1.00 1.33 0.80 0.80 1.33 1.00 1.33 0.80 1.33 1.00 0.80 1.00 0.80 0.80 1.33 17 70 191 189 6 23 48 192 195 71 17 80 187 47 22 196 18 193 194 42 Mo S W W Mo Mo S W W S Mo S W S Mo W Mo W W S -1.578 0.00 1145 A 2.95 2.63 2.39 2.01 1.94 1.58 1.57 1.49 1.40 1.38 1.25 1.22 1.20 1.15 1.14 1.12 1.02 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 D:x2-y2 D:x2-y2 D:z2 D:yz D:z2 D:yz D:xz D:yz D:xz D:yz D:x2-y2 P:y D:xy D:yz P:z S D:yz -4.498 -4.498 -4.498 -3.733 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -3.733 -7.014 -4.498 -3.733 -9.089 -6.493 -3.733 0.80 0.80 0.80 1.00 0.80 0.80 0.80 0.80 0.80 0.80 1.00 1.33 0.80 1.00 1.33 1.00 1.00 191 189 186 17 192 193 187 190 196 194 6 70 186 18 115 154 5 W W W Mo W W W W W W Mo S W Mo O H Mo -1.564 0.00 1146 A 3.48 3.07 1.83 1.66 1.64 1.49 1.46 1.29 1.28 1.19 1.16 1.09 1.07 1.05 1.01 1.01 1 1 1 1 1 1 2 1 2 1 2 1 1 2 1 2 D:yz D:xz D:yz D:yz S S P:x D:yz P:y S P:y D:yz D:xz P:y D:z2 P:y -3.733 -3.733 -3.733 -3.733 -6.493 -6.493 -7.014 -3.733 -7.014 -6.493 -7.014 -3.733 -3.733 -7.014 -4.498 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.33 0.80 1.33 1 9 4 20 162 181 91 7 77 182 60 13 19 56 186 68 Mo Mo Mo Mo H H S Mo S H S Mo Mo S W S -1.561 0.00 1147 A 3.70 3.32 3.27 2.92 2.66 2.34 2.22 2.07 1.91 1.65 1.62 1.61 1.57 1.55 1.47 1.43 1.40 1.39 1.27 1.26 1.21 1.18 1.16 1.15 1.10 1.09 1.08 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:z2 D:z2 D:yz D:xy D:x2-y2 D:xy D:xz P:z D:xz D:xy D:x2-y2 D:yz D:z2 D:z2 D:x2-y2 D:x2-y2 D:xz D:yz D:z2 D:xy D:xy D:z2 P:x P:z P:z D:xy D:z2 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 185 195 188 185 195 194 189 113 188 193 187 190 187 193 192 196 191 191 192 186 195 194 143 114 116 196 196 W W W W W W W O W W W W W W W W W W W W W W O O O W W -1.539 0.00 1148 A 2.88 2.78 2.56 2.40 2.19 2.00 1.87 1.71 1.64 1.64 1.53 1.45 1.33 1.31 1.25 1.18 1.18 1.03 1.03 1 2 1 1 1 1 1 1 1 1 2 1 1 1 1 2 1 1 1 S P:x S D:x2-y2 D:x2-y2 D:xz D:xz D:yz D:yz D:z2 P:z S D:z2 D:yz D:xz P:x D:xz P:z S -6.493 -7.014 -6.493 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -7.014 -6.493 -4.498 -3.733 -3.733 -7.014 -3.733 -9.089 -6.493 1.00 1.33 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.00 0.80 1.00 1.00 1.33 1.00 1.33 1.00 150 76 178 188 190 185 186 192 195 195 76 160 192 27 27 52 14 128 176 H S H W W W W W W W S H W Mo Mo S Mo O H -1.538 0.00 1149 A 2.51 2.26 2.26 2.24 2.10 2.08 1.99 1.86 1.78 1.77 1.68 1.57 1.52 1.50 1.40 1.33 1.32 1.31 1.16 1.14 1.12 1.10 1.08 1.07 1.02 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 2 1 1 1 1 1 1 1 1 S D:x2-y2 S D:x2-y2 D:yz D:z2 D:yz S S D:xz S P:x D:xy D:xz P:z S P:y D:z2 S S D:xz D:z2 P:z D:xy P:y -6.493 -4.498 -6.493 -4.498 -4.498 -4.498 -4.498 -6.493 -6.493 -4.498 -6.493 -7.014 -4.498 -4.498 -7.014 -6.493 -7.014 -4.498 -6.493 -6.493 -3.733 -4.498 -9.089 -4.498 -9.089 1.00 0.80 1.00 0.80 0.80 0.80 0.80 1.00 1.00 0.80 1.00 1.33 0.80 0.80 1.33 1.00 1.33 0.80 1.00 1.00 1.00 0.80 1.33 0.80 1.33 153 188 150 190 195 185 192 170 176 186 154 76 195 185 92 155 74 192 160 149 27 186 128 192 120 H W H W W W W H H W H S W W S H S W H H Mo W O W O -1.513 0.00 1150 A 3.38 2.87 2.31 2.22 2.03 1.84 1.74 1.72 1.68 1.68 1.62 1.60 1.57 1.39 1.30 1.29 1.29 1.25 1.23 1.21 1.17 1.10 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 2 2 2 1 1 1 1 D:xz S D:x2-y2 D:xz D:xz D:xz S S D:xz S S P:y D:yz D:yz D:xz P:y P:y P:x D:xy D:xz D:xz D:xy -3.733 -6.493 -3.733 -3.733 -3.733 -3.733 -6.493 -6.493 -3.733 -6.493 -6.493 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 13 154 6 22 14 12 178 149 4 179 151 33 19 12 19 60 80 66 24 2 25 25 Mo H Mo Mo Mo Mo H H Mo H H S Mo Mo Mo S S S Mo Mo Mo Mo -1.500 0.00 1151 A 3.76 3.62 3.48 2.96 2.17 2.14 2.03 1.92 1.73 1.73 1.70 1.63 1.63 1.58 1.46 1.45 1.42 1.28 1.24 1.22 1.16 1.15 1.13 1.12 -1.02 1.01 1 1 2 1 1 1 1 1 2 1 2 1 2 1 2 1 1 2 2 2 1 2 1 1 2 2 D:xz S P:x S S S S D:xz P:z S P:x D:xz P:z S P:x S D:z2 P:y P:x P:z S S D:yz D:yz S P:y -3.733 -6.493 -7.014 -6.493 -6.493 -6.493 -6.493 -3.733 -7.014 -6.493 -7.014 -3.733 -7.014 -6.493 -7.014 -6.493 -3.733 -7.014 -7.014 -7.014 -6.493 -4.108 -3.733 -3.733 2.471 -7.014 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 0.00 1.33 22 181 91 182 154 171 151 4 98 180 58 2 91 156 36 178 1 83 47 36 161 9 4 22 156 29 Mo H S H H H H Mo S H S Mo S H S H Mo S S S H Mo Mo Mo H S -1.476 0.00 1152 A 6.52 5.05 4.79 4.45 3.38 3.19 2.87 1.75 1.74 1.58 1.48 1.41 1.40 1.39 1.38 1.32 1.23 1.19 1.15 1.10 1.08 1.03 1 1 1 1 1 2 2 2 1 2 1 2 1 2 1 1 2 1 2 2 1 1 D:yz D:xy D:xy D:x2-y2 D:x2-y2 P:y P:x P:y S P:x D:xy P:y D:yz P:x D:x2-y2 D:yz P:x D:xz P:x P:z D:x2-y2 D:z2 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -6.493 -7.014 -3.733 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 12 26 25 25 19 37 87 49 151 51 18 87 24 88 18 20 66 22 42 60 11 25 Mo Mo Mo Mo Mo S S S H S Mo S Mo S Mo Mo S Mo S S Mo Mo -1.456 0.00 1153 A 7.09 4.66 2.97 2.92 2.40 2.16 2.04 1.95 1.90 1.86 1.77 1.66 1.66 1.62 1.57 1.41 1.28 1.27 1.26 1.24 1.20 -1.19 1.18 1.09 1.08 1.06 1.01 1 1 1 1 1 2 1 2 2 1 1 2 1 1 2 1 1 2 1 2 1 2 1 2 2 2 2 D:yz D:yz D:xz D:yz D:yz P:y S P:x P:x D:yz D:xz P:y D:yz D:xz P:y D:xy D:xz P:z D:x2-y2 P:x S D:yz D:yz P:y P:y P:x P:x -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -6.493 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -6.493 3.575 -3.733 -7.014 -7.014 -7.014 -7.014 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.00 0.00 1.00 1.33 1.33 1.33 1.33 7 17 2 9 18 56 154 48 71 1 17 65 20 18 47 24 1 29 6 62 176 7 23 49 42 36 72 Mo Mo Mo Mo Mo S H S S Mo Mo S Mo Mo S Mo Mo S Mo S H Mo Mo S S S S -1.446 0.00 1154 A 6.24 4.11 3.32 2.69 2.68 2.44 2.39 2.15 2.09 1.88 1.87 1.83 1.77 1.60 1.58 1.56 1.39 -1.28 1.25 1.19 1.16 1.15 1.15 -1.14 1.12 1.11 1.10 1.08 1.01 1 1 1 1 1 2 1 2 3 1 2 1 1 2 1 1 2 3 2 1 2 1 1 2 1 2 1 2 2 S D:yz D:yz S S P:x D:yz P:x S D:xz P:x S S P:z D:xz D:xz S P:x P:x D:yz P:x S D:yz S S P:y D:yz P:x P:y -6.493 -3.733 -3.733 -6.493 -6.493 -7.014 -3.733 -7.014 0.830 -3.733 -7.014 -6.493 -6.493 -7.014 -3.733 -3.733 2.471 3.474 -7.014 -3.733 -7.014 -6.493 -3.733 2.471 -6.493 -7.014 -3.733 -7.014 -7.014 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 0.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 0.00 0.00 1.33 1.00 1.33 1.00 1.00 0.00 1.00 1.33 1.00 1.33 1.33 149 7 16 154 175 94 10 47 15 16 34 146 155 94 7 18 149 94 63 2 70 163 25 148 177 82 12 96 47 H Mo Mo H H S Mo S Mo Mo S H H S Mo Mo H S S Mo S H Mo H H S Mo S S -1.417 0.00 1155 A 6.03 5.32 3.15 2.03 2.02 1.95 1.89 1.84 1.68 1.64 1.62 1.60 1.60 1.45 1.44 1.43 1.43 1.33 1.31 1.29 1.19 1.18 1.16 1.16 1.15 1.10 1.06 1.06 1.03 1.02 1.01 1 1 1 1 2 1 1 2 1 1 1 2 2 1 2 1 1 1 1 2 1 2 2 2 2 2 2 1 1 2 1 D:xz D:xz D:xz D:xz P:y S D:yz P:y S D:yz D:yz P:x P:y S P:x D:yz D:yz D:xz D:xz P:x D:xz P:x P:x P:y P:x P:x P:y D:xz D:yz P:y D:xz -3.733 -3.733 -3.733 -3.733 -7.014 -6.493 -3.733 -7.014 -6.493 -3.733 -3.733 -7.014 -7.014 -6.493 -7.014 -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.00 18 16 5 3 53 146 4 72 175 2 3 61 56 181 70 7 1 14 25 38 17 41 42 79 66 95 60 11 10 55 12 Mo Mo Mo Mo S H Mo S H Mo Mo S S H S Mo Mo Mo Mo S Mo S S S S S S Mo Mo S Mo -1.392 0.00 1156 A 6.18 5.04 3.83 3.31 2.28 2.27 2.09 2.07 1.70 1.67 1.65 1.53 1.48 1.44 1.42 1.42 1.34 1.29 1.18 1.14 1.13 1.09 1.00 1 2 1 1 2 1 1 2 1 1 1 2 1 2 1 3 1 1 2 1 1 1 2 D:yz P:x D:yz S P:x D:yz D:yz P:y D:xz S D:xz P:y D:z2 P:x D:yz S S S P:y D:yz D:xz D:yz P:x -3.733 -7.014 -3.733 -6.493 -7.014 -3.733 -3.733 -7.014 -3.733 -6.493 -3.733 -7.014 -3.733 -7.014 -3.733 0.830 -6.493 -6.493 -7.014 -3.733 -3.733 -3.733 -7.014 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 0.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 16 47 17 175 70 22 21 82 22 157 16 83 16 96 5 8 178 182 41 12 17 28 71 Mo S Mo H S Mo Mo S Mo H Mo S Mo S Mo Mo H H S Mo Mo Mo S -1.383 0.00 1157 A 6.79 5.95 4.31 3.85 3.42 3.17 2.91 2.72 2.36 1.88 1.75 1.72 1.69 1.65 1.60 -1.56 1.55 1.54 1.53 1.44 -1.29 1.24 1.19 1.16 1.12 1.07 1.06 1.04 1.04 -1.03 1.01 1.00 1 1 1 1 2 2 1 1 1 2 1 2 1 1 3 2 1 1 1 2 2 2 2 1 2 1 1 2 2 3 2 2 S D:yz D:xz D:yz P:x P:z S S S P:z S P:z S D:yz S S S D:yz S P:y S P:y P:z D:xz P:y D:yz D:z2 P:x P:x S S P:y -6.493 -3.733 -3.733 -3.733 -7.014 -7.014 -6.493 -6.493 -6.493 -7.014 -6.493 -7.014 -6.493 -3.733 0.830 2.471 -6.493 -3.733 -6.493 -7.014 2.471 -7.014 -7.014 -3.733 -7.014 11.667 -3.733 -7.014 -7.014 5.346 2.471 -7.014 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 0.00 0.00 1.00 1.00 1.00 1.33 0.00 1.33 1.33 1.00 1.33 0.00 1.00 1.33 1.33 0.00 0.00 1.33 148 21 19 28 94 94 175 149 160 75 157 52 152 17 10 148 182 5 154 92 149 44 46 21 69 94 21 69 92 52 175 68 H Mo Mo Mo S S H H H S H S H Mo Mo H H Mo H S H S S Mo S S Mo S S S H S -1.372 0.00 1158 A 6.10 5.92 4.20 3.77 2.52 2.34 2.26 2.06 2.02 1.97 1.87 1.87 1.74 -1.61 -1.58 1.56 1.55 1.52 1.51 1.45 1.39 1.36 1.34 1.34 1.30 1.30 1.25 1.14 1.12 1.07 1.02 1 1 1 1 1 1 1 1 2 1 1 2 1 3 3 2 1 3 2 2 2 2 1 1 2 1 1 2 3 2 2 S S S S S S D:xz D:yz P:z D:xz D:yz P:z D:yz P:y S P:y D:yz S P:x S P:x S D:yz S P:x D:xz S P:y S P:y P:z -6.493 -6.493 -6.493 -6.493 -6.493 -6.493 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 3.474 5.346 -7.014 -3.733 0.830 -7.014 2.471 -7.014 2.471 -3.733 -6.493 -7.014 -3.733 -6.493 -7.014 0.830 -7.014 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 0.00 0.00 1.33 1.00 0.00 1.33 0.00 1.33 0.00 1.00 1.00 1.33 1.00 1.00 1.33 0.00 1.33 1.33 178 170 153 151 154 176 14 27 76 10 16 63 21 46 92 46 15 28 36 153 93 170 17 149 95 16 155 45 21 74 92 H H H H H H Mo Mo S Mo Mo S Mo S S S Mo Mo S H S H Mo H S Mo H S Mo S S -1.327 0.00 1159 A 3.54 2.44 2.27 2.07 2.06 2.00 1.87 1.81 1.72 1.62 1.59 1.52 1.43 1.32 1.27 1.20 1.19 1.16 1.13 1.12 1.11 1.11 1.09 1.05 1.04 1.04 1.03 1.01 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 2 1 3 2 1 1 S D:yz D:x2-y2 P:x D:yz D:yz D:xz D:xy S S D:yz S D:xy D:x2-y2 D:yz D:xz S P:x P:x D:xz S S P:z D:yz S P:z D:x2-y2 S -6.493 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -6.493 -6.493 -3.733 -6.493 -3.733 -3.733 -3.733 -3.733 -6.493 -7.014 -7.014 -3.733 -6.493 -6.493 -7.014 -3.733 0.830 -7.014 -3.733 -6.493 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 0.00 1.33 1.00 1.00 175 14 11 54 4 12 4 24 157 180 27 149 12 6 7 13 146 96 35 9 184 170 96 8 8 62 17 148 H Mo Mo S Mo Mo Mo Mo H H Mo H Mo Mo Mo Mo H S S Mo H H S Mo Mo S Mo H -1.305 0.00 1160 A 4.39 3.83 3.76 3.13 3.12 2.34 1.99 1.87 1.77 1.60 1.60 1.60 1.58 1.58 1.53 1.50 1.30 1.13 1.10 1.06 1.05 1.04 1 1 1 1 1 2 1 1 1 2 1 1 1 1 1 1 1 2 1 1 1 2 D:x2-y2 D:x2-y2 D:xy S D:xy P:y D:yz S D:xz P:y D:x2-y2 D:x2-y2 D:xz D:xy S D:xz S P:x D:yz D:yz S P:z -3.733 -3.733 -3.733 -6.493 -3.733 -7.014 -3.733 -6.493 -3.733 -7.014 -3.733 -3.733 -3.733 -3.733 -6.493 -3.733 -6.493 -7.014 -3.733 -3.733 -6.493 -7.014 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 11 6 12 163 24 81 5 146 18 80 17 23 11 17 156 7 160 86 10 8 181 72 Mo Mo Mo H Mo S Mo H Mo S Mo Mo Mo Mo H Mo H S Mo Mo H S -1.294 0.00 1161 A 2.35 2.28 2.04 2.02 1.99 1.96 1.94 1.94 1.92 1.84 1.73 1.59 1.59 1.55 1.50 1.27 1.26 1.23 1.17 1.14 1.14 1.14 1.11 1.10 1.06 1.05 1.04 1.04 1 1 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xz D:xy D:xz D:xy D:xz D:yz D:xz D:xy D:xy D:yz D:yz S D:yz D:yz D:yz D:x2-y2 D:x2-y2 D:x2-y2 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S S Mo S Mo H S H Mo S S Mo -1.224 0.00 1164 A 7.51 4.35 4.24 3.40 2.36 2.20 2.19 2.13 2.03 1.94 1.63 1.56 1.45 1.43 1.34 1.28 1.22 1.15 1.12 1.11 1.09 1.00 1 1 1 1 2 1 2 2 2 1 1 1 1 1 1 2 1 1 2 2 1 2 D:yz D:yz D:yz D:yz P:x D:yz P:y P:x P:x D:yz D:yz D:yz S D:xz D:yz P:x D:xz D:xz P:y P:x D:yz P:z -3.733 -3.733 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -6.493 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 4 12 9 26 31 14 79 54 38 23 2 8 149 2 7 61 12 16 37 59 27 39 Mo Mo Mo Mo S Mo S S S Mo Mo Mo H Mo Mo S Mo Mo S S Mo S -1.195 0.00 1165 A 6.66 4.19 3.36 3.08 2.55 2.52 2.33 2.29 2.02 1.93 1.88 1.83 1.81 1.72 1.63 1.54 1.53 1.43 1.41 1.35 1.31 1.29 1.27 1.27 1.24 -1.18 1.09 1.08 1.06 1.05 1.04 1.00 1 1 1 1 2 2 1 1 2 1 1 2 1 2 2 2 1 2 1 2 1 2 2 2 2 2 2 1 1 1 2 1 D:yz D:yz S D:yz P:x P:y S S P:x D:xz D:yz P:y D:yz P:y P:x P:x S P:y D:xz P:y S P:x P:y P:y P:z D:yz P:x D:xz S D:yz P:x S -3.733 -3.733 -6.493 -3.733 -7.014 -7.014 -6.493 -6.493 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -7.014 -6.493 -7.014 -3.733 -7.014 -6.493 -7.014 -7.014 -7.014 -7.014 3.575 -7.014 -3.733 -6.493 -3.733 -7.014 -6.493 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 0.00 1.33 1.00 1.00 1.00 1.33 1.00 5 2 175 23 57 54 179 149 96 4 16 31 24 70 31 54 163 56 23 78 150 34 71 48 96 5 65 3 147 7 97 177 Mo Mo H Mo S S H H S Mo Mo S Mo S S S H S Mo S H S S S S Mo S Mo H Mo S H -1.173 0.00 1166 A 3.70 3.20 2.65 2.50 2.46 2.35 2.27 2.05 1.96 1.87 1.87 1.72 1.72 1.62 1.53 1.47 1.44 1.37 1.30 1.28 1.23 1.22 1.18 1.15 1.13 1.10 1.10 1.09 1.07 1.06 1.03 1.01 1.01 1.00 1 1 1 1 1 2 2 2 1 2 1 1 2 1 2 2 1 1 2 2 1 2 2 1 2 2 2 1 1 1 1 1 2 2 D:xz D:xz S S D:yz P:y P:y P:y D:xz P:y D:xz D:xz P:y D:xz P:y P:x D:xz D:xz P:y P:y S P:x P:x D:xz P:x P:z P:z D:xz D:yz D:xz D:xz D:yz P:x P:y -3.733 -3.733 -6.493 -6.493 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -7.014 -7.014 -6.493 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.33 9 18 149 156 9 34 57 62 4 39 7 2 67 11 43 94 13 5 31 53 184 41 65 6 56 94 36 16 4 3 19 2 60 55 Mo Mo H H Mo S S S Mo S Mo Mo S Mo S S Mo Mo S S H S S Mo S S S Mo Mo Mo Mo Mo S S -1.128 0.00 1167 A 8.10 7.10 5.21 3.46 3.01 2.88 2.66 2.66 2.63 2.41 2.38 2.19 2.19 2.02 1.95 1.93 1.92 1.91 -1.90 1.50 1.45 1.42 -1.38 1.33 1.23 1.22 1.19 1.19 1.18 1.13 1.12 -1.11 1.04 -1.04 -1.01 1.01 1.00 1 1 2 3 3 3 1 1 2 1 1 1 1 1 1 1 2 1 2 2 2 2 3 1 1 2 1 1 1 1 2 3 1 3 3 3 1 S S P:x S S S S S S S S S S S D:yz S P:y S S S S S P:y S S S S S D:xz S S S D:yz S S S S -6.493 -6.493 -7.014 0.830 0.830 0.830 -6.493 -6.493 2.471 -6.493 -6.493 -6.493 -6.493 -6.493 -3.733 -6.493 -7.014 -6.493 2.471 2.471 -4.108 2.471 3.474 -6.493 -6.493 2.471 -6.493 -6.493 -3.733 -6.493 2.471 5.346 -3.733 5.346 5.346 0.830 -6.493 1.00 1.00 1.33 0.00 0.00 0.00 1.00 1.00 0.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 0.00 0.00 1.00 0.00 0.00 1.00 1.00 0.00 1.00 1.00 1.00 1.00 0.00 0.00 1.00 0.00 0.00 0.00 1.00 160 177 93 1 28 3 178 184 160 182 181 161 180 150 27 148 92 151 151 182 28 184 92 162 176 161 163 171 9 154 178 91 20 76 92 10 179 H H S Mo Mo Mo H H H H H H H H Mo H S H H H Mo H S H H H H H Mo H H S Mo S S Mo H -1.105 0.00 1168 A 6.07 4.81 3.34 3.07 2.67 2.49 2.35 2.32 2.16 -2.09 2.09 1.98 1.86 1.74 1.50 1.47 1.47 1.35 -1.33 1.32 1.27 1.24 1.24 1.17 1.15 1.09 1.05 1.04 1.01 1 1 1 2 1 1 1 2 1 2 1 1 2 1 1 3 1 1 2 1 3 2 2 2 2 2 1 2 2 S S S P:x S S D:xz P:x D:xz S S S P:x D:yz S S S D:xz S S S P:z P:y P:y P:y P:z D:yz P:y P:z -6.493 -6.493 -6.493 -7.014 -6.493 -6.493 -3.733 -7.014 -3.733 2.471 -6.493 -6.493 -7.014 -3.733 -6.493 0.830 -6.493 -3.733 2.471 -6.493 0.830 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 0.00 1.00 1.00 1.33 1.00 1.00 0.00 1.00 1.00 0.00 1.00 0.00 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 162 176 155 97 150 161 5 76 16 163 182 156 95 19 152 10 163 17 146 175 3 64 66 42 97 95 18 70 97 H H H S H H Mo S Mo H H H S Mo H Mo H Mo H H Mo S S S S S Mo S S -1.100 0.00 1169 A 6.70 4.45 3.04 2.94 2.41 2.30 2.15 2.10 1.96 1.85 1.75 1.74 1.74 1.61 1.53 1.51 1.44 1.44 1.43 1.33 1.30 1.29 1.26 1.12 1.10 1.09 1.06 1.06 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 2 1 2 2 2 2 2 2 2 2 1 1 1 D:yz D:yz S D:yz D:yz S D:yz D:yz S D:xz D:yz D:xz S P:z D:yz P:y P:x D:yz P:z P:y P:x P:x P:x P:x P:z P:x D:xz S D:yz -3.733 -3.733 -6.493 -3.733 -3.733 -6.493 -3.733 -3.733 -6.493 -3.733 -3.733 -3.733 -6.493 -7.014 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -7.014 -3.733 -6.493 -3.733 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 7 4 149 10 25 154 13 15 176 16 12 13 179 38 18 79 94 5 33 33 34 36 57 95 56 62 5 150 21 Mo Mo H Mo Mo H Mo Mo H Mo Mo Mo H S Mo S S Mo S S S S S S S S Mo H Mo -1.056 0.00 1170 A 4.98 4.11 3.81 3.26 3.02 3.01 2.45 2.28 2.20 2.04 1.68 1.64 1.60 1.59 1.54 1.53 1.52 1.46 1.44 1.38 1.23 1.18 1.10 -1.10 -1.08 1.08 1.07 1.02 1.02 1.01 1.00 1 1 1 1 1 2 1 2 1 1 3 1 1 1 1 1 1 1 2 2 2 1 1 3 2 1 2 1 1 2 2 S D:yz S D:xz S P:z S P:x S D:yz S S D:yz S S S D:yz S S P:x S D:yz D:yz P:z S D:yz P:z S S P:x P:x -6.493 -3.733 -6.493 -3.733 -6.493 -7.014 -6.493 -7.014 -6.493 -3.733 0.830 -6.493 -3.733 -6.493 -6.493 -6.493 -3.733 -6.493 2.471 -7.014 2.471 -3.733 -3.733 3.474 2.471 -3.733 -7.014 -6.493 -6.493 -7.014 -7.014 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 0.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 0.00 1.33 0.00 1.00 1.00 0.00 0.00 1.00 1.33 1.00 1.00 1.33 1.33 175 19 161 5 182 96 147 96 183 5 1 152 4 160 150 151 14 162 161 76 182 20 13 96 147 12 68 178 176 97 91 H Mo H Mo H S H S H Mo Mo H Mo H H H Mo H H S H Mo Mo S H Mo S H H S S -1.038 0.00 1171 A 4.14 3.32 2.96 2.80 2.75 2.51 2.43 2.28 1.96 1.77 1.68 1.59 1.57 1.50 1.46 1.44 1.40 1.39 1.37 1.37 1.36 1.34 1.34 1.22 1.17 1.17 1.16 1.16 1.15 1.08 1.03 1.01 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 3 2 1 2 1 2 2 1 1 2 2 1 2 2 2 D:xz D:yz D:yz S S S D:xz S D:xz P:y P:y S S D:yz D:xz D:yz S S P:x D:yz P:y S P:y P:y S S P:y P:y D:xz P:x P:y P:y -3.733 -3.733 -3.733 -6.493 -6.493 -6.493 -3.733 -6.493 -3.733 -7.014 -7.014 -6.493 -6.493 -3.733 -3.733 -3.733 -6.493 0.830 -7.014 -3.733 -7.014 -6.493 -7.014 -7.014 -6.493 -6.493 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 0.00 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 13 17 24 156 170 150 17 179 12 67 43 175 180 19 4 8 163 28 64 13 65 184 41 48 162 161 61 38 24 76 71 66 Mo Mo Mo H H H Mo H Mo S S H H Mo Mo Mo H Mo S Mo S H S S H H S S Mo S S S -1.018 0.00 1172 A 5.93 4.02 3.56 3.51 3.28 2.82 2.77 2.31 2.04 2.03 1.97 1.87 1.81 1.61 1.56 1.56 1.50 1.44 1.36 1.31 1.30 1.25 1.24 1.22 1.17 1.17 1.11 1.10 1.09 1.04 1.03 1.02 1.00 1 1 1 1 2 2 1 2 1 1 2 1 1 1 2 2 1 1 2 2 1 1 1 2 2 2 1 1 2 2 2 1 1 D:xz D:xz D:xz D:yz P:x P:x D:xz P:x S D:yz P:x D:xz S S P:x P:x S D:yz P:x P:x D:yz D:yz D:xz P:x P:z P:x S D:xz P:x P:x P:x S D:yz -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -6.493 -3.733 -7.014 -3.733 -6.493 -6.493 -7.014 -7.014 -6.493 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -6.493 -3.733 -7.014 -7.014 -7.014 -6.493 -3.733 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 6 4 14 8 56 33 13 60 179 19 37 17 170 149 64 39 154 18 62 54 26 12 11 66 55 94 156 5 42 36 31 153 3 Mo Mo Mo Mo S S Mo S H Mo S Mo H H S S H Mo S S Mo Mo Mo S S S H Mo S S S H Mo -0.988 0.00 1173 A 10.28 4.89 4.39 4.25 4.17 3.99 3.87 3.01 2.78 2.55 2.29 -2.09 2.06 2.04 1.99 1.81 1.79 1.70 1.59 1.52 1.50 1.37 1.33 1.25 -1.22 1.22 1.21 1.19 1.16 1.16 1.15 -1.05 1 1 2 1 1 1 2 1 1 2 1 2 2 1 2 1 1 2 3 2 2 2 1 2 3 2 2 2 2 1 2 3 S D:yz P:z S S D:yz P:x D:yz S S D:xz S P:x S P:z S D:yz P:z S P:x P:y S S P:y P:z P:z P:y P:x P:x D:xz S P:x -6.493 -3.733 -7.014 -6.493 -6.493 -3.733 -7.014 -3.733 -6.493 -4.108 -3.733 2.471 -7.014 -6.493 -7.014 -6.493 -3.733 -7.014 0.830 -7.014 -7.014 2.471 -6.493 -7.014 3.474 -7.014 -7.014 -7.014 -7.014 -3.733 2.471 3.474 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 0.00 1.33 1.00 1.33 1.00 1.00 1.33 0.00 1.33 1.33 0.00 1.00 1.33 0.00 1.33 1.33 1.33 1.33 1.00 0.00 0.00 184 3 30 147 182 1 30 4 183 1 4 183 96 161 96 162 5 54 1 32 77 182 175 29 30 53 30 53 91 5 161 30 H Mo S H H Mo S Mo H Mo Mo H S H S H Mo S Mo S S H H S S S S S S Mo H S -0.936 0.00 1174 A 5.79 4.44 3.21 2.97 2.92 2.42 2.35 2.31 2.25 2.25 2.07 2.00 1.98 1.90 1.87 1.83 1.68 1.59 1.56 1.54 1.52 1.47 1.45 1.44 1.33 1.32 1.30 1.29 1.25 1.23 1.21 1.17 1.07 1.06 1.06 1.01 1 1 1 2 1 1 2 2 2 1 1 1 1 1 1 2 2 2 1 2 2 2 2 1 1 1 1 2 2 1 1 1 2 2 2 2 D:yz D:xz D:xz P:x D:xz D:yz P:x P:x P:x D:yz D:xz D:xz D:yz D:xz D:yz P:x P:x P:x D:xz P:z P:z P:x P:z D:xz S D:yz D:yz P:y P:x D:yz D:xz D:xz P:x P:x P:x P:x -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -7.014 -3.733 -6.493 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 3 7 12 41 11 16 66 42 65 17 18 3 23 16 1 37 60 38 17 29 32 61 53 9 156 18 8 70 34 2 23 6 57 33 59 56 Mo Mo Mo S Mo Mo S S S Mo Mo Mo Mo Mo Mo S S S Mo S S S S Mo H Mo Mo S S Mo Mo Mo S S S S -0.904 0.00 1175 A 5.31 4.37 3.74 3.22 3.02 2.75 2.06 2.01 1.91 1.78 1.75 1.71 1.65 1.65 1.40 1.36 1.34 1.32 1.29 1.29 1.25 1.19 1.19 1.12 1.09 1.09 1.04 1.01 1 1 1 1 1 1 1 3 1 1 1 1 1 2 1 1 2 1 1 2 2 2 1 1 2 2 2 1 S D:xz D:yz D:yz S S D:yz S D:yz D:yz D:yz S S P:x S D:yz S S S P:z P:x P:z S D:xz P:z P:z P:x S -6.493 -3.733 -3.733 -3.733 -6.493 -6.493 -3.733 0.830 -3.733 -3.733 -3.733 -6.493 -6.493 -7.014 -6.493 -3.733 2.471 -6.493 -6.493 -7.014 -7.014 -7.014 -6.493 -3.733 -7.014 -7.014 -7.014 -6.493 1.00 1.00 1.00 1.00 1.00 1.00 1.00 0.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 0.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.00 161 2 19 4 178 151 7 1 5 9 20 180 147 98 183 21 161 160 170 31 93 54 157 13 43 68 61 148 H Mo Mo Mo H H Mo Mo Mo Mo Mo H H S H Mo H H H S S S H Mo S S S H -0.886 0.00 1176 A 7.78 7.66 5.77 5.27 3.72 2.36 2.25 2.19 2.11 2.08 2.02 1.84 1.75 1.73 1.59 1.54 1.49 1.45 1.38 1.36 1.23 -1.19 1.18 1.12 1.11 1.08 1.08 1 1 1 1 2 1 2 1 1 2 1 1 2 2 1 2 1 2 1 1 1 3 2 1 1 1 1 S S S S P:x D:yz P:x D:xz S P:z D:xz D:yz P:x P:x S P:y D:xz P:z D:yz D:z2 S P:x P:z S D:yz D:xz D:yz -6.493 -6.493 -6.493 -6.493 -7.014 -3.733 -7.014 -3.733 -6.493 -7.014 -3.733 -3.733 -7.014 -7.014 -6.493 -7.014 -3.733 -7.014 -3.733 -3.733 -6.493 3.474 -7.014 -6.493 -3.733 -3.733 -3.733 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.33 1.00 1.00 1.00 0.00 1.33 1.00 1.00 1.00 1.00 170 153 151 178 76 21 93 11 150 92 7 15 92 46 148 46 2 93 23 28 161 46 76 183 10 27 27 H H H H S Mo S Mo H S Mo Mo S S H S Mo S Mo Mo H S S H Mo Mo Mo -0.834 0.00 1177 A 8.87 6.20 4.55 3.68 2.86 2.79 2.65 2.52 2.44 2.37 2.28 2.25 2.17 2.07 1.75 1.73 1.73 1.62 -1.52 1.50 1.36 1.32 1.31 -1.28 -1.23 1.22 1.20 1.19 1.16 1.13 1.08 1 1 1 1 1 2 2 2 1 1 1 1 1 2 2 1 1 1 2 2 1 3 3 3 3 1 2 2 2 2 1 S S S S S P:y P:x P:z S D:xz D:yz S D:yz P:z S S D:xz S S P:x S S S P:z P:y S P:x S P:x S D:xz -6.493 -6.493 -6.493 -6.493 -6.493 -7.014 -7.014 -7.014 -6.493 -3.733 -3.733 -6.493 -3.733 -7.014 -4.108 -6.493 -3.733 -6.493 2.471 -7.014 -6.493 0.830 0.830 3.474 3.474 -6.493 -7.014 2.471 -7.014 -4.108 -3.733 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 0.00 1.33 1.00 0.00 0.00 0.00 0.00 1.00 1.33 0.00 1.33 1.00 1.00 160 150 153 146 184 92 76 92 170 16 23 179 24 46 10 147 11 181 170 92 157 28 10 92 92 148 30 150 95 27 17 H H H H H S S S H Mo Mo H Mo S Mo H Mo H H S H Mo Mo S S H S H S Mo Mo -0.792 0.00 1178 A 6.51 5.07 4.67 4.60 3.59 3.41 2.92 2.59 2.47 2.43 2.42 2.40 2.13 1.92 1.71 1.67 1.67 1.56 1.52 1.47 1.39 1.38 1.32 1.30 1.23 1.16 1.14 1.10 1.07 1.07 1.04 1.02 1 1 1 1 2 2 1 1 1 2 1 1 2 2 1 2 2 2 1 1 2 1 2 2 1 1 1 2 2 2 2 2 D:yz D:yz D:yz D:xz P:x P:x D:xz D:xz D:yz P:z D:xz D:yz P:z P:z D:yz P:z P:y P:z D:xz D:yz P:y D:xz P:z P:y S D:xz D:yz P:y P:z P:z P:x P:z -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -7.014 -7.014 -6.493 -3.733 -3.733 -7.014 -7.014 -7.014 -7.014 -7.014 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 18 26 17 16 67 43 19 11 7 65 6 13 41 73 25 50 42 66 13 20 66 4 56 38 157 25 9 61 33 44 42 68 Mo Mo Mo Mo S S Mo Mo Mo S Mo Mo S S Mo S S S Mo Mo S Mo S S H Mo Mo S S S S S -0.752 0.00 1179 A 5.72 5.46 5.23 3.69 3.45 3.20 3.08 2.79 2.50 2.47 2.44 2.19 1.88 1.87 1.80 1.72 1.66 1.62 1.50 1.47 1.42 1.40 1.40 1.38 1.36 1.33 1.33 -1.26 1.22 -1.06 1 1 1 1 1 2 2 1 1 1 1 1 1 1 2 2 1 1 2 2 1 2 1 1 1 1 2 3 2 3 D:yz D:yz D:xz D:xz D:xz P:z P:z D:xz D:xz S S S D:xz S P:z P:y S S P:x P:z S P:y S D:xz S S P:z S P:z S -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -6.493 -6.493 -6.493 -3.733 -6.493 -7.014 -7.014 -6.493 -6.493 -7.014 -7.014 -6.493 -7.014 -6.493 -3.733 -6.493 -6.493 -7.014 5.346 -7.014 5.346 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.33 0.00 1.33 0.00 24 23 17 12 7 71 48 6 23 152 155 179 4 157 46 61 183 170 64 42 156 38 160 2 153 163 64 48 66 71 Mo Mo Mo Mo Mo S S Mo Mo H H H Mo H S S H H S S H S H Mo H H S S S S -0.726 0.00 1180 A 3.97 3.58 3.52 3.15 2.49 2.48 2.39 2.22 1.98 1.93 1.82 1.73 1.73 1.55 1.53 1.52 1.49 1.49 1.44 1.42 1.39 1.34 1.34 1.30 1.30 1.30 1.29 1.27 1.24 1.22 1.21 1.19 1.10 1.06 1.06 1.05 1.05 1.02 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 1 1 1 1 1 2 1 2 1 2 2 1 1 1 2 2 2 2 3 2 2 1 2 D:xz S D:xz D:yz D:yz S S S S S P:x S S P:z S D:yz D:yz D:xz D:yz D:yz P:z S P:z D:xz P:z P:z D:yz D:yz S P:z P:x P:x P:z S P:z P:z D:xz P:x -3.733 -6.493 -3.733 -3.733 -3.733 -6.493 -6.493 -6.493 -6.493 -6.493 -7.014 -6.493 -6.493 -7.014 -6.493 -3.733 -3.733 -3.733 -3.733 -3.733 -7.014 -6.493 -7.014 -3.733 -7.014 -7.014 -3.733 -3.733 -6.493 -7.014 -7.014 -7.014 -7.014 0.830 -7.014 -7.014 -3.733 -7.014 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.00 1.33 7 155 4 19 26 181 153 150 162 180 46 148 152 67 170 5 9 25 13 10 64 157 54 2 73 57 25 8 161 46 76 58 31 1 43 50 18 97 Mo H Mo Mo Mo H H H H H S H H S H Mo Mo Mo Mo Mo S H S Mo S S Mo Mo H S S S S Mo S S Mo S -0.715 0.00 1181 A 9.09 4.67 4.36 3.77 3.28 3.16 2.46 2.41 2.29 2.08 2.04 2.01 1.95 1.92 -1.77 1.61 1.44 1.37 1.36 1.34 1.28 1.27 1.26 1.23 -1.22 1.20 1.18 1.11 -1.10 1.05 1 1 1 1 1 2 1 2 1 1 1 1 1 2 3 2 1 1 1 2 1 2 1 2 3 1 1 2 2 2 S S S S D:xz P:z D:xz P:x S D:xz S S S P:z P:z P:x S S S P:y S P:z D:xz P:x P:z S D:yz P:x S P:x -6.493 -6.493 -6.493 -6.493 -3.733 -7.014 -3.733 -7.014 -6.493 -3.733 -6.493 -6.493 -6.493 -7.014 3.474 -7.014 -6.493 -6.493 -6.493 -7.014 -6.493 -7.014 -3.733 -7.014 3.474 -6.493 -3.733 -7.014 2.471 -7.014 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.33 0.00 1.33 1.00 1.00 1.00 1.33 1.00 1.33 1.00 1.33 0.00 1.00 1.00 1.33 0.00 1.33 155 157 146 156 12 64 4 95 152 17 150 184 170 58 64 58 148 177 180 95 163 46 2 46 58 153 23 64 179 76 H H H H Mo S Mo S H Mo H H H S S S H H H S H S Mo S S H Mo S H S -0.668 0.00 1182 A 6.25 2.34 1.99 1.97 1.72 1.66 1.66 1.55 1.55 1.53 1.53 1.52 1.51 1.48 1.47 1.40 1.33 1.29 1.27 1.26 1.25 1.25 1.24 1.19 1.19 1.18 -1.18 1.17 1.17 -1.14 1.11 -1.06 -1.06 1.05 1.04 1.03 1.02 1.02 2 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 3 1 1 1 3 3 2 1 1 2 1 2 2 3 3 3 3 1 S S D:z2 D:z2 D:z2 D:yz D:z2 D:yz D:x2-y2 D:x2-y2 D:xy D:xy D:xz D:x2-y2 D:xz D:x2-y2 D:xz D:xz D:x2-y2 S S D:yz D:xy D:x2-y2 S S S D:xy D:yz S D:x2-y2 S S S S S S D:x2-y2 -13.975 3.091 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 1.231 -4.498 -4.498 -4.498 1.231 1.231 24.654 -4.498 -4.498 24.654 -4.498 24.654 24.654 1.231 1.231 1.231 1.231 -4.498 2.00 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.00 0.80 0.80 0.80 0.00 0.00 0.00 0.80 0.80 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.80 197 197 190 188 189 196 191 187 195 196 188 190 192 192 194 187 193 195 193 188 189 186 189 194 191 190 105 191 185 108 186 106 107 194 193 187 196 185 P P W W W W W W W W W W W W W W W W W W W W W W W W O W W O W O O W W W W W -0.654 0.00 1183 A 11.05 5.64 5.11 5.00 4.13 3.81 3.80 3.28 2.23 2.22 2.17 1.99 1.92 -1.89 1.75 1.62 1.59 1.34 1.33 1.27 1.22 1.19 -1.19 -1.16 -1.16 1.15 -1.14 1.08 1.07 -1.03 -1.02 1.01 1 1 1 1 1 2 2 1 1 1 2 2 2 3 2 1 3 2 2 2 2 1 3 2 3 1 3 1 1 3 2 1 S S S D:xz S P:x P:z D:xz S D:xz P:z P:z P:y P:z P:x D:yz S S P:z P:x P:z S P:x S P:z S P:y S D:xz S S D:yz -6.493 -6.493 -6.493 -3.733 -6.493 -7.014 -7.014 -3.733 -6.493 -3.733 -7.014 -7.014 -7.014 3.474 -7.014 -3.733 0.830 2.471 -7.014 -7.014 -7.014 -6.493 3.474 2.471 3.474 -6.493 3.474 -6.493 -3.733 5.346 2.471 -3.733 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 0.00 1.33 1.00 0.00 0.00 1.33 1.33 1.33 1.00 0.00 0.00 0.00 1.00 0.00 1.00 1.00 0.00 0.00 1.00 183 180 181 5 157 58 30 7 163 2 58 34 97 30 30 19 1 181 91 97 32 171 58 157 91 162 97 156 9 91 180 26 H H H Mo H S S Mo H Mo S S S S S Mo Mo H S S S H S H S H S H Mo S H Mo -0.586 0.00 1184 A 10.96 4.92 4.37 3.54 3.51 3.46 3.40 3.36 2.92 2.91 2.60 2.57 2.56 2.29 2.22 2.17 2.09 1.98 1.88 -1.73 1.65 1.57 1.47 1.42 1.34 1.32 1.22 1.11 -1.10 1.06 1.03 -1.02 1 1 1 2 1 1 1 2 1 1 2 2 2 1 1 2 1 1 1 2 2 2 1 2 1 1 1 2 3 1 2 3 D:xz D:yz D:yz P:z D:yz D:yz D:xz P:z D:xz D:yz P:z P:z P:z D:xz D:yz P:z D:xz D:xz D:xz D:xz P:z P:z D:xz P:z D:xz D:yz D:xz P:z S S P:z S -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 -3.733 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -7.014 -3.733 -3.733 -3.733 3.575 -7.014 -7.014 -3.733 -7.014 -3.733 -3.733 -3.733 -7.014 5.346 -6.493 -7.014 5.346 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 1.00 1.00 1.00 0.00 1.33 1.33 1.00 1.33 1.00 1.00 1.00 1.33 0.00 1.00 1.33 0.00 12 25 13 61 18 26 25 38 7 14 42 73 66 4 17 50 11 19 13 12 62 39 16 72 17 7 9 49 38 171 65 61 Mo Mo Mo S Mo Mo Mo S Mo Mo S S S Mo Mo S Mo Mo Mo Mo S S Mo S Mo Mo Mo S S H S S -0.508 0.00 1185 A 23.28 19.33 11.56 8.76 6.85 6.48 6.25 5.43 -5.29 -4.95 4.63 -3.35 -2.98 2.91 2.33 -2.33 2.12 2.07 -1.62 1.52 1.51 -1.51 1.27 1 1 2 2 2 1 1 2 3 3 1 2 2 2 1 3 2 2 3 1 1 2 1 S S P:z P:z P:x S S P:x P:z P:z D:xz S S P:y D:yz P:x P:x P:x P:y D:yz S S D:x2-y2 -6.493 -6.493 -7.014 -7.014 -7.014 -6.493 -6.493 -7.014 3.474 3.474 -3.733 2.471 2.471 -7.014 11.667 3.474 -7.014 -7.014 3.474 11.667 -6.493 2.471 11.667 1.00 1.00 1.33 1.33 1.33 1.00 1.00 1.33 0.00 0.00 1.00 0.00 0.00 1.33 0.00 0.00 1.33 1.33 0.00 0.00 1.00 0.00 0.00 171 181 98 91 91 161 182 98 91 98 2 161 182 98 98 91 53 29 98 91 157 171 98 H H S S S H H S S S Mo H H S S S S S S S H H S -0.486 0.00 1186 A 10.53 8.21 5.98 4.35 3.90 3.44 3.35 3.09 2.93 2.72 2.66 2.23 2.06 2.02 1.93 -1.89 1.87 1.77 1.75 1.70 1.66 1.59 -1.50 -1.50 1.47 -1.46 -1.40 -1.37 1.36 1.35 -1.33 1.32 1.29 -1.27 1.26 1.15 1.13 -1.11 -1.09 1.05 1.03 1.02 1 1 1 1 1 2 1 1 1 2 1 1 1 3 2 2 3 1 2 2 1 2 3 3 2 3 3 2 2 1 3 3 1 3 2 2 3 3 3 2 1 2 S S S S S P:x S S S P:z S S S S P:x S S S P:x P:y S S S P:y P:z S P:x S P:x S S S S S S S S P:x S S S S -6.493 -6.493 -6.493 -6.493 -6.493 -7.014 -6.493 -6.493 -6.493 -7.014 -6.493 -6.493 -6.493 0.830 -7.014 2.471 0.830 -6.493 -7.014 -7.014 -6.493 2.471 5.346 3.474 -7.014 5.346 3.474 2.471 -7.014 -6.493 5.346 0.830 -6.493 5.346 2.471 2.471 0.830 3.474 5.346 2.471 -6.493 -4.108 1.00 1.00 1.00 1.00 1.00 1.33 1.00 1.00 1.00 1.33 1.00 1.00 1.00 0.00 1.33 0.00 0.00 1.00 1.33 1.33 1.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 1.33 1.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.00 147 148 150 179 171 30 183 157 180 96 184 163 152 8 76 184 1 177 36 94 182 179 64 94 30 58 30 175 96 178 76 28 155 96 148 180 21 36 94 157 154 8 H H H H H S H H H S H H H Mo S H Mo H S S H H S S S S S H S H S Mo H S H H Mo S S H H Mo -0.480 0.00 1187 A 4.63 4.58 2.45 2.40 2.27 2.11 2.01 1.87 1.75 1.65 1.63 1.60 1.46 1.43 1.40 1.36 1.35 1.35 1.35 1.28 1.27 1.27 1.25 1.24 1.23 1.20 1.17 1.13 1.11 1.04 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xz D:xz D:yz D:yz D:yz D:yz D:yz D:x2-y2 D:yz D:yz D:xz D:z2 D:z2 D:xz D:xz D:z2 D:x2-y2 P:y D:xy D:yz D:xz D:yz D:x2-y2 D:yz P:x D:z2 D:x2-y2 D:xy P:y P:y D:x2-y2 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 1.33 0.80 190 188 190 188 193 185 186 193 194 195 196 186 195 192 195 192 188 131 186 192 187 196 194 187 124 185 195 196 130 134 192 W W W W W W W W W W W W W W W W W O W W W W W W O W W W O O W -0.473 0.00 1188 A 4.09 3.78 2.85 2.84 2.57 2.54 2.51 2.34 2.01 1.81 1.81 1.72 1.67 1.66 1.61 1.57 1.49 1.43 1.36 1.32 1.32 1.21 1.07 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:yz D:yz D:xy D:xz D:x2-y2 D:xy D:xz D:yz D:xz D:yz D:z2 D:xz D:yz P:x D:x2-y2 D:xz D:z2 P:y D:xz D:xy P:z D:xz D:x2-y2 D:z2 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 0.80 191 189 192 186 186 194 196 192 189 194 194 193 187 122 191 191 196 132 194 196 125 192 187 190 W W W W W W W W W W W W W O W W W O W W O W W W -0.469 0.00 1189 A 3.96 3.58 3.01 2.56 2.53 2.43 2.29 2.27 2.17 2.14 2.10 2.08 1.81 1.81 1.79 1.70 1.60 1.53 1.49 1.42 1.40 1.30 1.28 1.06 1.04 1.04 1.01 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xy D:xy D:xy D:xy D:x2-y2 D:xz D:z2 D:z2 D:xy D:xy D:z2 D:xz D:xy D:xy D:xy D:yz P:z D:yz D:x2-y2 D:z2 D:xy D:xy D:z2 D:z2 P:z P:x D:yz P:y -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 195 187 193 191 185 185 188 189 188 185 191 187 196 189 192 195 127 193 194 190 186 190 187 193 128 139 189 129 W W W W W W W W W W W W W W W W O W W W W W W W O O W O -0.402 0.00 1190 A 14.40 13.88 5.36 4.60 4.45 3.01 2.73 2.03 1.89 -1.82 1.79 1.75 1.56 1.53 1.52 1.52 1.50 -1.47 1.43 1.43 1.42 1.41 1.39 1.36 1.35 1.33 1.31 1.28 1.18 1.15 1.14 -1.14 1.11 1.11 1.09 1.08 -1.07 1.06 1.06 1 1 2 2 1 1 1 2 2 3 2 1 1 1 2 2 1 3 1 2 2 2 1 1 1 2 2 1 2 2 2 2 2 2 2 1 2 2 2 D:xz D:xz P:z P:z D:yz D:yz D:yz P:y P:z S P:z D:xz D:xz D:xz P:z P:z D:yz S D:yz P:z P:z P:z D:xz D:yz D:xz S P:y D:yz P:y S P:z D:xz P:y P:x P:z D:xz D:xz P:y P:x -3.733 -3.733 -7.014 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 5.346 -7.014 -3.733 -3.733 -3.733 -7.014 -7.014 -3.733 5.346 -3.733 -7.014 -7.014 -7.014 -3.733 -3.733 -3.733 -17.266 -7.014 -3.733 -7.014 -17.266 -7.014 3.575 -7.014 -7.014 -7.014 -3.733 3.575 -7.014 -7.014 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 1.33 0.00 1.33 1.00 1.00 1.00 1.33 1.33 1.00 0.00 1.00 1.33 1.33 1.33 1.00 1.00 1.00 2.00 1.33 1.00 1.33 2.00 1.33 0.00 1.33 1.33 1.33 1.00 0.00 1.33 1.33 6 11 37 60 24 12 18 60 41 37 71 13 17 18 67 43 13 60 19 33 56 48 4 9 16 37 56 23 65 60 42 6 41 33 65 7 11 37 65 Mo Mo S S Mo Mo Mo S S S S Mo Mo Mo S S Mo S Mo S S S Mo Mo Mo S S Mo S S S Mo S S S Mo Mo S S -0.363 0.00 1191 A 11.80 8.51 7.33 6.93 6.27 5.86 5.07 4.87 4.55 -4.47 4.33 4.15 3.92 3.05 -2.71 -2.64 -2.61 2.37 2.32 2.29 2.25 2.11 2.11 1.85 -1.80 -1.77 -1.75 1.75 1.68 1.66 1.53 -1.38 -1.38 -1.29 1.20 1.18 -1.16 -1.12 -1.09 1.06 1 1 1 2 2 1 1 1 1 3 1 2 1 2 3 3 3 2 2 1 2 1 2 2 3 3 2 2 2 2 2 3 3 3 2 3 3 3 3 1 S S S S S S S S S P:z S S S S P:z S S P:z P:y S S S S P:x P:z P:y P:z P:y S S S P:z P:z S P:z S S S S S -6.493 -6.493 -6.493 2.471 2.471 -6.493 -6.493 -6.493 -6.493 3.474 -6.493 2.471 -6.493 2.471 3.474 5.346 5.346 -7.014 -7.014 -6.493 2.471 -6.493 2.471 -7.014 3.474 3.474 -0.555 -7.014 2.471 2.471 2.471 3.474 3.474 5.346 -7.014 0.830 5.346 5.346 5.346 -6.493 1.00 1.00 1.00 0.00 0.00 1.00 1.00 1.00 1.00 0.00 1.00 0.00 1.00 0.00 0.00 0.00 0.00 1.33 1.33 1.00 0.00 1.00 0.00 1.33 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 1.00 178 151 170 178 151 153 160 179 152 76 150 170 176 152 93 76 92 76 46 147 176 149 155 64 92 46 28 92 160 153 150 95 46 46 93 20 93 95 64 146 H H H H H H H H H S H H H H S S S S S H H H H S S S Mo S H H H S S S S Mo S S S H -0.310 0.00 1192 A 20.50 11.73 7.84 6.75 6.05 6.02 4.23 2.70 -2.57 2.53 2.40 2.27 2.27 1.97 -1.94 1.91 1.72 1.55 1.54 1.50 -1.48 1.48 -1.41 1.40 -1.38 1.38 1.34 -1.32 -1.23 1.21 -1.20 1.19 1.13 -1.11 1.10 1.04 3 3 3 3 3 2 2 2 2 3 1 3 3 3 3 2 3 1 3 3 3 3 3 2 3 3 2 3 3 2 3 2 3 1 2 3 S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S 0.830 0.830 0.830 0.830 0.830 -4.108 -4.108 -4.108 2.471 0.830 -6.493 1.231 1.231 0.830 0.830 2.471 1.231 -6.493 1.231 0.830 0.830 1.231 5.346 -4.108 5.346 0.830 2.471 5.346 0.830 -4.108 5.346 -5.688 1.231 -6.493 -5.688 0.830 0.00 0.00 0.00 0.00 0.00 1.00 1.00 1.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 2.00 0.00 1.00 2.00 0.00 22 16 11 23 24 22 16 11 173 4 145 192 191 25 17 145 185 158 188 6 7 190 85 23 83 2 158 82 12 24 84 192 189 173 191 9 Mo Mo Mo Mo Mo Mo Mo Mo H Mo H W W Mo Mo H W H W Mo Mo W S Mo S Mo H S Mo Mo S W W H W Mo -0.231 0.00 1193 A 15.00 6.13 5.06 3.51 3.32 3.19 2.90 2.78 2.72 2.56 2.55 2.54 2.49 2.17 1.88 1.84 1.80 1.77 1.51 1.39 1.37 -1.33 1.33 1.32 1.26 1.25 -1.18 1.18 3 2 3 3 3 3 3 3 3 3 3 2 3 3 2 1 3 3 2 2 2 3 2 1 2 2 3 2 S S S S S S S S S S S S S S S S S S S S S S S S S S S S 0.830 -4.108 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 0.830 -5.688 0.830 1.231 -5.688 -6.493 1.231 0.830 -5.688 -5.688 2.471 0.830 -5.688 -6.493 -5.688 -5.688 3.091 -5.688 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 2.00 1.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 1.00 2.00 2.00 0.00 2.00 22 22 189 188 194 187 190 196 193 195 23 189 16 186 188 145 191 24 190 194 145 17 187 178 193 196 197 195 Mo Mo W W W W W W W W Mo W Mo W W H W Mo W W H Mo W H W W P W -0.175 0.00 1194 A 7.49 5.80 5.59 4.33 3.95 3.92 3.35 -3.00 2.63 2.60 2.59 2.53 2.51 2.47 2.42 2.41 2.34 -2.26 2.25 2.11 1.97 1.86 -1.80 1.76 1.57 1.56 1.51 1.38 -1.38 -1.27 1.25 1.24 1.23 1.23 1.22 1.13 1.11 1.10 -1.08 1.08 1.07 1.06 1.06 -1.03 1.02 1.00 1 1 1 1 1 1 2 3 1 3 2 1 2 1 1 2 2 3 2 1 1 2 3 2 1 2 2 2 3 3 3 2 3 1 2 3 2 2 3 1 2 3 3 3 3 2 S S S S S S S P:z S S S S S S S S S S P:x S S S P:z P:x S P:y P:z S P:z S S S S S S S P:z S S S S S S P:y S S -6.493 -6.493 -6.493 -6.493 -6.493 -6.493 2.471 3.474 -6.493 0.830 2.471 -6.493 2.471 -6.493 -6.493 2.471 2.471 5.346 -7.014 -6.493 -6.493 2.471 3.474 -7.014 -6.493 -7.014 -7.014 2.471 3.474 5.346 1.231 2.471 1.231 -6.493 -4.108 1.231 -7.014 2.471 5.346 -6.493 2.471 1.231 1.231 3.474 1.231 2.471 1.00 1.00 1.00 1.00 1.00 1.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 1.00 1.00 0.00 0.00 0.00 1.33 1.00 1.00 0.00 0.00 1.33 1.00 1.33 1.33 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.00 0.00 1.33 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 176 156 154 179 180 162 156 95 178 22 157 175 176 147 163 154 162 36 64 170 157 147 97 58 184 36 95 175 36 97 193 178 196 152 22 191 97 170 96 160 155 188 187 96 194 163 H H H H H H H S H Mo H H H H H H H S S H H H S S H S S H S S W H W H Mo W S H S H H W W S W H -0.083 0.00 1195 A 18.27 6.06 5.27 4.61 4.18 3.90 3.52 3.40 -3.09 2.97 -2.94 2.81 2.80 -2.76 2.70 2.63 2.57 -2.51 2.18 -2.16 2.04 2.03 1.93 -1.86 1.81 -1.51 1.49 1.46 1.39 -1.39 1.30 1.25 -1.22 1.17 -1.16 1.16 1.07 1.06 1.06 1.06 1.04 -1.00 1 1 1 1 3 1 1 2 3 1 3 2 2 2 1 1 1 3 3 3 2 2 2 3 1 3 2 1 2 3 2 1 3 2 3 2 1 2 2 1 1 3 S S S S S S S P:x P:x S S P:y P:y S S S S P:y S P:y P:y P:z P:y P:y S P:y S S P:z P:x S S S P:x P:z P:y S P:y S D:x2-y2 D:yz S -6.493 -6.493 -6.493 -6.493 0.830 -6.493 -6.493 -7.014 3.474 -6.493 5.346 -7.014 -7.014 2.471 -6.493 -6.493 -6.493 3.474 0.830 3.474 -7.014 -7.014 -7.014 3.474 -6.493 3.474 -4.108 -6.493 -7.014 3.474 -17.266 -6.493 5.346 -7.014 3.474 -7.014 -6.493 -7.014 2.471 11.667 -3.733 5.346 1.00 1.00 1.00 1.00 0.00 1.00 1.00 1.33 0.00 1.00 0.00 1.33 1.33 0.00 1.00 1.00 1.00 0.00 0.00 0.00 1.33 1.33 1.33 0.00 1.00 0.00 1.00 1.00 1.33 0.00 2.00 1.00 0.00 1.33 0.00 1.33 1.00 1.33 0.00 0.00 1.00 0.00 177 148 154 155 21 179 156 93 93 152 93 94 36 148 147 153 175 64 10 46 46 93 64 94 162 36 21 146 64 64 93 151 96 64 93 96 149 93 177 64 21 46 H H H H Mo H H S S H S S S H H H H S Mo S S S S S H S Mo H S S S H S S S S H S H S Mo S -0.024 0.00 1196 A 15.12 14.56 14.11 6.34 5.76 4.88 4.47 4.04 3.58 3.35 3.02 2.97 2.85 2.59 1.80 1.77 1.63 -1.63 -1.60 1.59 -1.49 -1.44 -1.43 -1.37 1.32 1.26 -1.25 1.22 1.22 -1.13 -1.12 -1.11 -1.11 1.08 1.05 -1.04 1.01 1.01 1.00 3 3 3 3 2 2 1 2 3 3 1 1 3 2 1 1 1 3 3 2 3 3 2 3 3 1 3 2 3 3 3 3 3 2 1 4 2 3 3 S S S S S S S S S S S S S S S S S S S S P:y S S S S S P:y P:x S P:x S S S P:y S S S S S 0.830 0.830 0.830 0.830 -4.108 -4.108 -6.493 -4.108 0.830 0.830 -6.493 -6.493 0.830 -4.108 -6.493 -6.493 -6.493 5.346 0.830 -4.108 3.474 5.346 -4.108 5.346 0.830 -6.493 3.474 -7.014 1.231 3.474 5.346 5.346 5.346 -7.014 -6.493 10.873 -4.108 0.830 1.231 0.00 0.00 0.00 0.00 1.00 1.00 1.00 1.00 0.00 0.00 1.00 1.00 0.00 1.00 1.00 1.00 1.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 1.33 1.00 0.00 1.00 0.00 0.00 26 25 27 20 27 20 146 25 14 24 177 147 22 26 156 150 160 88 13 22 36 73 13 74 21 152 92 95 186 95 50 87 89 36 148 20 19 19 196 Mo Mo Mo Mo Mo Mo H Mo Mo Mo H H Mo Mo H H H S Mo Mo S S Mo S Mo H S S W S S S S S H Mo Mo Mo W -0.014 0.00 1197 A 29.63 25.74 12.46 10.41 7.92 -5.95 5.63 -4.30 -4.16 3.75 3.46 3.38 -3.30 -3.06 2.72 -2.45 -2.44 2.41 -2.36 -2.36 2.15 2.08 2.08 -2.00 -1.96 1.88 1.80 -1.61 1.60 1.54 -1.52 1.46 1.36 -1.33 1.29 1.24 1.22 -1.19 1.17 -1.16 1.14 1.13 1.12 1.12 1.11 1.10 -1.05 1.04 -1.02 -1.02 3 3 2 3 2 3 3 2 2 1 3 2 3 2 2 1 2 3 3 3 3 2 3 3 1 3 3 2 2 2 4 1 1 3 3 3 2 3 1 2 1 3 2 2 2 3 3 3 4 3 S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S P:y S S S S S S S S P:z S S P:z 0.830 0.830 -4.108 0.830 -4.108 0.830 0.830 2.471 -4.108 -6.493 0.830 2.471 0.830 2.471 -4.108 -6.493 -4.108 1.231 5.346 5.346 1.231 -4.108 0.830 0.830 -6.493 1.231 1.231 2.471 -5.688 2.471 10.873 -6.493 -6.493 5.346 0.830 0.830 -5.688 3.474 -6.493 -4.108 -6.493 0.830 -5.688 -5.688 -4.108 1.231 3.474 0.830 10.873 3.474 0.00 0.00 1.00 0.00 1.00 0.00 0.00 0.00 1.00 1.00 0.00 0.00 0.00 0.00 1.00 1.00 1.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 0.00 2.00 0.00 0.00 1.00 1.00 0.00 0.00 0.00 2.00 0.00 1.00 1.00 1.00 0.00 2.00 2.00 1.00 0.00 0.00 0.00 0.00 0.00 2 4 2 6 4 7 11 168 7 169 1 169 3 164 6 168 3 190 78 79 187 11 22 12 164 193 185 167 190 166 2 182 166 80 16 9 187 31 163 12 184 23 193 185 22 188 54 13 4 31 Mo Mo Mo Mo Mo Mo Mo H Mo H Mo H Mo H Mo H Mo W S S W Mo Mo Mo H W W H W H Mo H H S Mo Mo W S H Mo H Mo W W Mo W S Mo Mo S 0.004 0.00 1198 A 9.76 8.19 6.25 6.05 5.80 4.41 4.40 2.72 -2.56 -2.45 2.44 2.43 2.36 2.35 2.26 2.19 2.09 2.05 1.94 1.85 1.81 1.78 1.72 1.71 1.66 1.57 1.51 1.43 1.40 1.39 -1.31 1.31 -1.26 -1.22 -1.16 1.15 1.04 -1.02 1 1 3 1 3 1 3 2 3 3 1 1 1 3 3 2 2 3 3 2 2 1 2 2 3 2 2 1 1 3 3 2 3 3 3 1 1 3 S S S S S S S P:x P:y P:x S S S S S P:y S S S P:x P:y S S S S P:y S S S S S S P:y S P:x S S P:y -6.493 -6.493 0.830 -6.493 0.830 -6.493 0.830 -7.014 3.474 3.474 -6.493 -6.493 -6.493 0.830 0.830 -7.014 -4.108 0.830 0.830 -7.014 -7.014 -6.493 -4.108 2.471 0.830 -7.014 2.471 -6.493 -6.493 0.830 5.346 -4.108 3.474 5.346 3.474 -6.493 -6.493 3.474 1.00 1.00 0.00 1.00 0.00 1.00 0.00 1.33 0.00 0.00 1.00 1.00 1.00 0.00 0.00 1.33 1.00 0.00 0.00 1.33 1.33 1.00 1.00 0.00 0.00 1.33 0.00 1.00 1.00 0.00 0.00 1.00 0.00 0.00 0.00 1.00 1.00 0.00 177 146 25 147 26 156 27 93 36 93 152 179 154 10 22 36 25 20 28 95 96 162 27 177 24 95 156 161 153 15 93 22 64 96 95 175 160 46 H H Mo H Mo H Mo S S S H H H Mo Mo S Mo Mo Mo S S H Mo H Mo S H H H Mo S Mo S S S H H S 0.029 0.00 1199 A 16.22 11.05 8.12 7.96 7.27 6.21 5.29 -5.26 -4.27 3.70 3.60 3.47 3.42 2.65 2.43 -2.43 2.28 -2.28 -2.10 -2.08 1.96 1.91 -1.89 -1.88 1.83 1.67 1.60 1.52 -1.51 1.45 1.35 -1.34 -1.22 -1.20 1.14 1.11 1.11 1.06 1 1 1 1 2 3 2 3 3 2 1 1 2 1 1 3 1 3 3 2 3 2 3 3 1 2 2 2 3 2 2 3 3 3 2 1 3 1 S S S S S S P:y S P:y S S S P:x S S P:z S P:y P:y S S P:y P:z P:x S S S P:x P:y S P:z P:x P:y P:z P:z D:x2-y2 P:z S -6.493 -6.493 -6.493 -6.493 2.471 0.830 -7.014 5.346 3.474 2.471 -6.493 -6.493 -7.014 -6.493 -6.493 3.474 -6.493 3.474 3.474 2.471 0.830 -7.014 3.474 3.474 -6.493 -17.266 -4.108 -7.014 3.474 -4.108 -7.014 3.474 3.474 3.474 -7.014 11.667 3.474 -6.493 1.00 1.00 1.00 1.00 0.00 0.00 1.33 0.00 0.00 0.00 1.00 1.00 1.33 1.00 1.00 0.00 1.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 1.00 2.00 1.00 1.33 0.00 1.00 1.33 0.00 0.00 0.00 1.33 0.00 0.00 1.00 183 184 180 163 183 3 30 30 30 184 157 148 58 176 161 30 171 98 96 180 4 97 58 97 156 30 3 97 91 8 30 58 97 95 95 58 96 146 H H H H H Mo S S S H H H S H H S H S S H Mo S S S H S Mo S S Mo S S S S S S S H 0.112 0.00 1200 A 9.97 8.44 6.91 5.90 4.84 3.71 -3.37 3.34 2.67 2.62 2.58 2.50 2.50 2.44 2.25 2.09 2.05 1.97 -1.97 1.89 1.88 1.84 1.78 1.73 -1.72 1.72 1.68 -1.68 1.63 -1.61 1.60 1.59 -1.54 1.47 -1.47 -1.37 1.37 -1.28 1.28 1.28 1.26 -1.23 1.21 -1.20 1.20 1.19 1.18 1.12 1.12 1.11 1.10 1.09 -1.05 -1.03 1.02 1.00 1 1 1 1 1 2 3 1 2 1 1 2 3 3 2 2 1 3 3 2 1 3 2 1 3 1 2 3 2 3 3 2 3 3 3 3 2 3 2 3 2 3 3 3 3 2 2 2 2 2 2 2 3 3 2 2 S S S S S S P:y S P:y S S S S S S S S S S P:x S S S S S S S P:y S P:z S S S S S P:y P:x S S S S P:x S P:y S S P:z S P:y S S S P:x S S S -6.493 -6.493 -6.493 -6.493 -6.493 2.471 3.474 -6.493 -7.014 -6.493 -6.493 2.471 1.231 0.830 2.471 2.471 -6.493 1.231 5.346 -7.014 -6.493 0.830 -4.108 -6.493 5.346 -6.493 2.471 3.474 -4.108 3.474 0.830 -5.688 5.346 0.830 5.346 3.474 -7.014 5.346 2.471 0.830 -5.688 3.474 1.231 3.474 0.830 -4.108 -7.014 2.471 -7.014 2.471 2.471 2.471 3.474 0.830 -4.108 2.471 1.00 1.00 1.00 1.00 1.00 0.00 0.00 1.00 1.33 1.00 1.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.33 1.00 0.00 1.00 1.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 1.00 1.33 0.00 1.33 0.00 0.00 0.00 0.00 0.00 1.00 0.00 146 148 163 182 161 171 94 171 94 160 149 146 189 10 163 148 178 191 95 91 162 11 10 170 98 181 181 58 21 97 16 189 91 22 94 92 95 97 166 14 191 91 186 98 1 22 97 149 92 161 176 155 95 12 8 162 H H H H H H S H S H H H W Mo H H H W S S H Mo Mo H S H H S Mo S Mo W S Mo S S S S H Mo W S W S Mo Mo S H S H H H S Mo Mo H 0.149 0.00 1201 A 7.71 6.61 5.25 4.84 4.33 4.15 3.92 3.64 3.59 3.55 -3.47 3.43 -3.14 3.07 2.89 2.71 2.67 2.58 2.19 -2.14 2.14 2.08 2.02 1.95 1.88 1.82 1.75 1.70 1.62 1.54 1.53 1.53 1.40 1.37 1.32 1.26 1.25 1.21 1.15 -1.10 1.05 1.02 3 3 3 3 3 3 2 2 3 2 3 3 3 3 2 1 2 3 2 2 3 2 1 1 2 1 3 3 3 2 2 3 1 2 3 1 2 1 2 2 2 3 S S S S S S S S S S P:x S S S S S S S S S S S S S S S S S S S S S S S S S S D:xz S P:x S S 0.830 0.830 1.231 0.830 0.830 1.231 -4.108 -5.688 1.231 -4.108 2.188 0.830 0.830 1.231 -4.108 -6.493 -5.688 1.231 -5.688 -4.108 1.231 -4.108 -6.493 -6.493 -5.688 -6.493 0.830 0.830 0.830 -5.688 -5.688 0.830 -6.493 -4.108 1.231 -6.493 -4.108 -4.498 2.471 -5.506 -4.108 0.830 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.00 0.00 1.00 0.00 0.00 0.00 0.00 1.00 1.00 2.00 0.00 2.00 1.00 0.00 1.00 1.00 1.00 2.00 1.00 0.00 0.00 0.00 2.00 2.00 0.00 1.00 1.00 0.00 1.00 1.00 0.80 0.00 1.00 1.00 0.00 2 16 191 11 22 192 22 191 189 2 197 27 12 194 16 146 192 188 189 12 195 27 148 161 188 145 4 17 5 195 194 6 163 11 190 171 17 192 145 197 6 24 Mo Mo W Mo Mo W Mo W W Mo P Mo Mo W Mo H W W W Mo W Mo H H W H Mo Mo Mo W W Mo H Mo W H Mo W H P Mo Mo 0.207 0.00 1202 A 5.43 4.66 4.00 3.70 3.66 3.44 -3.44 3.41 3.21 3.01 2.80 2.38 2.14 2.12 1.95 1.94 1.90 1.74 1.72 1.72 -1.62 1.37 1.36 1.32 1.29 1.29 1.24 1.24 1.15 -1.05 1.00 3 1 1 3 3 2 3 3 3 2 1 2 3 3 2 1 1 2 1 2 3 1 2 2 3 3 3 1 1 2 1 S D:yz D:yz S S S P:y S S S D:xy S S S S D:xy D:xz S D:x2-y2 S S D:xy S S S S S S D:z2 S D:yz 1.231 -4.498 -4.498 0.830 1.231 -5.688 2.188 1.231 1.231 -4.108 -4.498 -5.688 0.830 1.231 -5.688 -4.498 -4.498 -5.688 -4.498 -4.108 0.830 -4.498 -5.688 -5.688 0.830 1.231 1.231 -6.493 -4.498 -4.108 -4.498 0.00 0.80 0.80 0.00 0.00 2.00 0.00 0.00 0.00 1.00 0.80 2.00 0.00 0.00 2.00 0.80 0.80 2.00 0.80 1.00 0.00 0.80 2.00 2.00 0.00 0.00 0.00 1.00 0.80 1.00 0.80 196 196 186 27 190 196 197 186 188 27 188 188 26 189 189 190 194 190 186 26 13 196 186 194 9 194 191 146 190 13 189 W W W Mo W W P W W Mo W W Mo W W W W W W Mo Mo W W W Mo W W H W Mo W 0.223 0.00 1203 A 13.39 12.98 9.92 9.20 8.16 6.58 6.20 4.78 3.67 3.63 3.37 2.96 2.90 2.75 2.68 2.46 2.25 2.20 -1.86 1.80 1.74 1.73 -1.69 1.66 1.64 1.59 -1.47 -1.45 -1.40 -1.36 -1.32 -1.31 1.26 -1.24 -1.21 -1.16 -1.14 -1.09 -1.05 -1.01 3 3 3 2 3 2 3 2 3 1 3 2 2 2 3 1 1 2 2 3 3 2 2 2 2 2 3 3 3 2 3 3 3 3 1 3 3 2 3 3 S S S S S S S S S S S S S S S S S S S S S S P:y S S S S S S S S S S S S P:y P:y S P:y P:y 0.830 0.830 0.830 -4.108 0.830 -4.108 0.830 -4.108 0.830 -6.493 0.830 -4.108 -4.108 2.471 0.830 -6.493 -6.493 -4.108 2.471 0.830 0.830 2.471 -0.555 2.471 -4.108 -4.108 5.346 0.830 0.830 -4.108 5.346 5.346 0.830 5.346 -6.493 3.474 3.474 -4.108 3.474 3.474 0.00 0.00 0.00 1.00 0.00 1.00 0.00 1.00 0.00 1.00 0.00 1.00 1.00 0.00 0.00 1.00 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 23 16 24 23 27 16 2 27 11 158 25 2 24 158 20 145 159 25 173 28 4 159 22 145 11 20 82 18 21 21 86 85 1 81 173 41 70 18 47 65 Mo Mo Mo Mo Mo Mo Mo Mo Mo H Mo Mo Mo H Mo H H Mo H Mo Mo H Mo H Mo Mo S Mo Mo Mo S S Mo S H S S Mo S S 0.230 0.00 1204 A 5.85 3.73 3.36 3.31 2.66 2.40 2.26 2.24 2.04 1.86 1.80 1.66 1.66 1.54 1.48 1.39 1.33 1.30 1.30 1.19 1.17 1.13 1.13 1.04 1.03 1.01 1 1 1 3 1 2 3 1 1 3 1 1 1 1 2 1 2 3 1 1 1 2 1 1 2 3 D:xz D:xy D:xz S D:yz S S D:xy D:x2-y2 S D:x2-y2 D:z2 D:yz D:xy S D:yz S S P:x P:y P:z S S D:yz S S -4.498 -4.498 -4.498 0.830 -4.498 -4.108 1.231 -4.498 -4.498 0.830 -4.498 -4.498 -4.498 -4.498 -5.688 -4.498 -5.688 1.231 -9.089 -9.089 -9.089 -5.688 -24.020 -4.498 -4.108 0.830 0.80 0.80 0.80 0.00 0.80 1.00 0.00 0.80 0.80 0.00 0.80 0.80 0.80 0.80 2.00 0.80 2.00 0.00 1.33 1.33 1.33 2.00 2.00 0.80 1.00 0.00 193 190 195 27 187 27 193 188 193 2 195 188 185 194 193 186 187 187 141 138 141 189 108 195 2 23 W W W Mo W Mo W W W Mo W W W W W W W W O O O W O W Mo Mo 0.243 0.00 1205 A 3.47 3.31 3.28 3.10 3.01 2.63 2.44 2.17 2.14 2.05 1.90 1.88 1.77 1.65 1.63 1.52 1.49 1.47 1.46 1.44 1.32 1.30 1.16 1.13 1.11 1.08 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xy D:xy D:xz D:xy D:xy D:xz D:yz D:xz D:xz D:xy D:yz D:xz D:xy D:xy D:xy D:z2 D:xz D:yz D:z2 D:x2-y2 D:xz D:x2-y2 D:xz P:y D:yz D:yz P:y -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 192 188 187 195 190 196 193 186 193 186 194 195 185 193 194 190 185 192 188 185 194 187 192 136 195 185 138 W W W W W W W W W W W W W W W W W W W W W W W O W W O 0.247 0.00 1206 A 4.13 3.61 2.90 2.89 2.82 2.61 2.41 2.41 2.32 2.04 1.97 1.89 1.84 1.81 1.71 1.68 1.68 1.41 1.33 1.22 1.14 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xy D:xy D:xy D:yz D:yz D:xy D:yz D:xz D:yz D:xz D:xy D:z2 D:yz D:xz D:xy D:xy D:z2 P:x D:xy D:yz P:x -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 189 191 187 192 185 196 195 185 187 196 185 191 193 186 193 186 189 137 194 194 139 W W W W W W W W W W W W W W W W W O W W O 0.252 0.00 1207 A 5.62 4.86 4.71 4.68 3.05 2.87 2.79 2.69 2.40 2.10 2.09 1.94 1.90 1.53 1.47 1.28 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:yz D:xz D:xz D:yz D:xz D:xz D:xz D:yz D:yz D:xz D:yz D:xz D:yz D:xz D:yz D:yz -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 191 188 190 189 189 191 194 190 188 192 186 193 196 195 187 185 W W W W W W W W W W W W W W W W 0.270 0.00 1208 A 4.62 4.23 4.19 3.28 3.22 2.75 2.68 2.33 1.84 1.62 1.60 1.52 1.48 1.44 1.40 1.38 1.21 1.15 1.15 1.13 1.07 1 1 3 1 2 1 1 3 2 1 1 1 1 3 1 2 3 1 2 3 3 D:xy D:xz S D:xz S D:yz D:xy S S P:x D:z2 D:yz D:z2 S D:x2-y2 S S D:x2-y2 S S S -4.498 -4.498 0.830 -4.498 -4.108 -4.498 -4.498 0.830 -5.688 -9.089 -4.498 -4.498 -4.498 0.830 -4.498 -4.108 1.231 -4.498 -4.108 0.830 0.830 0.80 0.80 0.00 0.80 1.00 0.80 0.80 0.00 2.00 1.33 0.80 0.80 0.80 0.00 0.80 1.00 0.00 0.80 1.00 0.00 0.00 191 194 27 192 27 185 189 16 190 139 189 187 191 24 194 16 190 187 22 11 22 W W Mo W Mo W W Mo W O W W W Mo W Mo W W Mo Mo Mo 0.285 0.00 1209 A 5.18 5.16 5.02 4.97 4.92 4.06 3.24 2.69 2.55 2.39 2.30 -2.25 1.83 1.83 1.79 1.76 1.70 1.65 1.45 1.35 -1.32 1.17 1.12 1.04 1.02 3 3 2 3 2 2 3 2 2 1 1 3 3 3 2 1 2 1 3 3 3 1 1 3 3 S S S S S S S S S D:yz D:xy P:y S S S D:xy S D:yz S S S D:xz D:z2 S S 1.231 1.231 -5.688 1.231 -5.688 -5.688 1.231 -5.688 -5.688 -4.498 -4.498 2.188 1.231 1.231 -5.688 -4.498 -5.688 -4.498 1.231 1.231 0.830 -4.498 -4.498 1.231 0.830 0.00 0.00 2.00 0.00 2.00 2.00 0.00 2.00 2.00 0.80 0.80 0.00 0.00 0.00 2.00 0.80 2.00 0.80 0.00 0.00 0.00 0.80 0.80 0.00 0.00 189 196 191 191 196 189 186 193 186 186 189 197 193 187 187 191 190 196 190 188 13 195 191 185 27 W W W W W W W W W W W P W W W W W W W W Mo W W W Mo 0.309 0.00 1210 A 7.46 7.04 6.72 6.38 5.32 4.95 4.74 -3.41 3.25 3.03 2.95 2.78 2.77 2.59 2.51 2.07 1.82 1.78 1.75 1.61 1.46 -1.42 -1.40 1.38 1.38 1.27 1.21 1.19 -1.19 1.17 1.13 1.08 1.06 -1.05 1.05 1.03 3 3 3 2 2 2 3 3 3 2 3 3 3 2 2 3 2 3 2 3 2 3 2 2 3 3 2 2 3 3 2 2 3 3 2 1 S S S S S S S P:x S S S S S S S S S S S S S S S S S S S S S S S S S S S S 1.231 1.231 1.231 -5.688 -5.688 -5.688 0.830 2.188 0.830 -4.108 1.231 1.231 0.830 -4.108 -5.688 1.231 -5.688 0.830 -5.688 1.231 -4.108 0.830 -4.108 -5.688 0.830 1.231 -5.688 2.471 0.830 0.830 -4.108 -4.108 0.830 5.346 -4.108 -6.493 0.00 0.00 0.00 2.00 2.00 2.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 1.00 2.00 0.00 2.00 0.00 2.00 0.00 1.00 0.00 1.00 2.00 0.00 0.00 2.00 0.00 0.00 0.00 1.00 1.00 0.00 0.00 1.00 1.00 188 190 193 188 190 193 2 197 1 1 194 195 24 2 195 189 194 11 185 185 24 3 3 189 25 191 191 166 17 23 25 11 22 78 22 181 W W W W W W Mo P Mo Mo W W Mo Mo W W W Mo W W Mo Mo Mo W Mo W W H Mo Mo Mo Mo Mo S Mo H 0.350 0.00 1211 A 9.03 7.34 6.85 4.99 4.29 4.02 3.98 3.57 -2.97 2.72 2.54 2.52 2.52 -2.48 2.41 2.38 2.17 -2.16 2.12 2.09 2.07 2.06 2.05 1.90 1.89 1.87 -1.84 -1.80 1.77 -1.76 -1.67 1.35 1.34 1.27 1.22 1.20 1.18 -1.18 1.17 -1.15 -1.14 1.13 -1.06 1.03 1.01 1 1 1 1 1 2 2 1 3 2 1 1 2 3 2 1 2 3 1 1 2 1 1 1 1 3 3 3 2 3 3 2 2 1 1 3 1 3 2 3 3 2 3 2 2 S S S S S S S S P:y S S S P:y P:y P:x S S P:z S S P:y S S S S S S P:y P:y S P:x S P:z S S S D:xz S S P:y S S P:z S S -6.493 -6.493 -6.493 -6.493 -6.493 2.471 2.471 -6.493 3.474 2.471 -6.493 -6.493 -7.014 3.474 -7.014 -6.493 -4.108 3.474 -6.493 -6.493 -7.014 -6.493 -6.493 -6.493 -6.493 0.830 5.346 3.474 -7.014 5.346 3.474 2.471 -7.014 -6.493 -6.493 0.830 -3.733 5.346 -4.108 3.474 5.346 -4.108 3.474 2.471 2.471 1.00 1.00 1.00 1.00 1.00 0.00 0.00 1.00 0.00 0.00 1.00 1.00 1.33 0.00 1.33 1.00 1.00 0.00 1.00 1.00 1.33 1.00 1.00 1.00 1.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 1.33 1.00 1.00 0.00 1.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 0.00 182 147 181 148 161 181 171 171 94 147 149 160 94 96 91 163 10 91 175 155 96 152 179 151 178 16 91 91 91 98 91 155 95 157 176 20 2 64 2 92 96 16 96 157 161 H H H H H H H H S H H H S S S H Mo S H H S H H H H Mo S S S S S H S H H Mo Mo S Mo S S Mo S H H 0.369 0.00 1212 A 7.60 6.24 4.38 3.59 -3.53 3.43 2.94 2.64 2.57 2.56 2.45 2.39 2.36 2.20 2.09 2.03 1.97 1.93 1.89 1.88 1.71 1.68 1.68 -1.65 1.57 1.53 1.47 1.47 1.46 1.42 1.40 1.35 1.26 -1.25 -1.24 1.15 1.15 1.05 1.02 3 2 3 2 3 1 3 1 2 1 1 3 3 3 3 2 2 2 2 3 1 2 2 3 3 3 3 1 1 1 2 3 2 3 3 2 1 2 1 S S S S P:z S S S S S S S S S S S S P:y S S S S S P:y S S S S S S S S S P:z S P:z S S S 1.231 -5.688 1.231 -5.688 2.188 -6.493 1.231 -6.493 -5.688 -6.493 -6.493 1.231 1.231 1.231 0.830 -5.688 -5.688 -7.014 -5.688 1.231 -6.493 -5.688 -4.108 3.474 1.231 0.830 1.231 -6.493 -6.493 -6.493 -5.688 0.830 -4.108 3.474 0.830 -7.014 -6.493 -5.688 -6.493 0.00 2.00 0.00 2.00 0.00 1.00 0.00 1.00 2.00 1.00 1.00 0.00 0.00 0.00 0.00 2.00 2.00 1.33 2.00 0.00 1.00 2.00 1.00 0.00 0.00 0.00 0.00 1.00 1.00 1.00 2.00 0.00 1.00 0.00 0.00 1.33 1.00 2.00 1.00 187 187 194 194 197 151 195 148 195 153 152 192 193 186 26 186 192 46 193 185 149 188 26 46 191 9 188 178 146 177 185 25 25 93 13 93 160 191 169 W W W W P H W H W H H W W W Mo W W S W W H W Mo S W Mo W H H H W Mo Mo S Mo S H W H 0.371 0.00 1213 A 10.89 7.00 6.10 -5.64 5.63 5.18 4.70 4.39 4.24 3.93 3.43 2.99 2.94 2.84 2.12 2.05 2.03 -1.89 1.87 -1.81 1.74 -1.68 1.56 1.56 1.54 -1.48 -1.47 1.46 1.44 -1.43 1.39 1.37 1.30 -1.29 1.23 1.19 -1.18 1.15 1.07 1.06 1.00 1 1 1 3 1 2 3 1 1 2 3 2 3 2 1 3 2 3 3 3 2 3 2 2 2 2 3 3 1 3 2 3 3 3 2 2 3 2 2 3 1 S S S P:z S P:z S S S S S P:y S S S S P:z P:y S P:y S S P:y S S S P:z S S S S S S P:z S S S S S S S -6.493 -6.493 -6.493 3.474 -6.493 -7.014 1.231 -6.493 -6.493 -5.688 1.231 -7.014 0.830 -5.688 -6.493 1.231 -7.014 3.474 0.830 3.474 -4.108 5.346 -7.014 -4.108 -5.688 2.471 3.474 0.830 -6.493 5.346 -4.108 0.830 0.830 3.474 -4.108 2.471 0.830 2.471 2.471 0.830 -6.493 1.00 1.00 1.00 0.00 1.00 1.33 0.00 1.00 1.00 2.00 0.00 1.33 0.00 2.00 1.00 0.00 1.33 0.00 0.00 0.00 1.00 0.00 1.33 1.00 2.00 0.00 0.00 0.00 1.00 0.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 1.00 151 152 153 93 177 93 187 160 178 187 194 46 24 194 170 191 76 46 23 92 24 93 92 23 191 148 76 14 148 46 10 11 20 46 22 152 17 177 151 22 150 H H H S H S W H H W W S Mo W H W S S Mo S Mo S S Mo W H S Mo H S Mo Mo Mo S Mo H Mo H H Mo H 0.413 0.00 1214 A 4.15 3.40 3.38 3.32 3.23 3.20 3.16 3.05 2.99 2.90 2.63 2.62 2.60 2.49 2.34 2.28 2.14 1.69 1.26 1.17 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 3 2 2 D:yz D:xz D:yz D:yz D:xz D:yz D:xy D:xy D:xz D:xz D:xy D:xy D:xy D:xy S D:xy D:xy S S S -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 0.830 -4.498 -4.498 0.830 -4.108 -4.108 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.80 0.80 0.00 1.00 1.00 195 187 192 194 186 193 194 193 196 185 185 192 186 196 9 195 187 14 15 10 W W W W W W W W W W W W W W Mo W W Mo Mo Mo 0.434 0.00 1215 A 5.05 4.78 4.64 4.48 2.46 2.45 2.21 2.13 1.81 1.70 1.67 1.67 1.63 1.57 1.48 1.44 1.41 1.34 1.05 -1.05 1.04 1.01 -1.01 1.00 1 1 1 1 1 1 1 1 2 1 1 1 1 2 1 1 2 1 2 2 1 1 3 1 D:xz D:xz D:yz D:yz D:xz D:xz D:yz D:yz S D:xy D:xy D:xy S S D:xy D:yz P:z D:yz S S S D:yz P:z D:yz -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.108 -4.498 -4.498 -4.498 -6.493 -4.108 -4.498 -4.498 -7.014 -4.498 -4.108 2.471 -6.493 -4.498 3.474 -4.498 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 0.80 1.00 1.00 0.80 0.80 1.33 0.80 1.00 0.00 1.00 0.80 0.00 0.80 188 190 191 189 191 189 190 188 15 192 195 194 146 10 193 193 95 194 3 146 179 195 95 192 W W W W W W W W Mo W W W H Mo W W S W Mo H H W S W 0.436 0.00 1216 A 4.06 3.31 3.23 2.73 -2.10 2.08 -2.03 1.90 1.83 1.77 1.76 1.75 1.73 1.71 1.69 1.68 1.66 1.57 1.56 1.55 1.50 1.44 1.31 1.30 1.28 1.28 1.28 1.25 1.25 -1.24 -1.21 1.18 1.17 1.16 1.14 1.10 1.09 1.06 1.05 1.05 1.04 1.02 2 1 2 2 3 2 2 1 1 1 1 1 1 1 1 1 2 1 1 1 2 3 1 2 1 1 3 1 2 2 3 1 1 3 2 2 3 2 3 1 1 1 S S S P:z P:z S S D:yz D:xy D:xy D:xz D:yz S S D:yz D:xz S S D:yz S S S D:xz S D:xz D:xy S D:xz P:y S S D:xz D:xy S S S S P:x S D:xz D:xz S -4.108 -6.493 -4.108 -7.014 3.474 -4.108 2.471 -4.498 -4.498 -4.498 -4.498 -4.498 -6.493 -6.493 -4.498 -4.498 2.471 -6.493 -4.498 -6.493 -4.108 0.830 -4.498 -4.108 -4.498 -4.498 0.830 -4.498 -7.014 2.471 5.346 -4.498 -4.498 0.830 -4.108 2.471 0.830 -0.555 1.231 -4.498 -4.498 -6.493 1.00 1.00 1.00 1.33 0.00 1.00 0.00 0.80 0.80 0.80 0.80 0.80 1.00 1.00 0.80 0.80 0.00 1.00 0.80 1.00 1.00 0.00 0.80 1.00 0.80 0.80 0.00 0.80 1.33 0.00 0.00 0.80 0.80 0.00 1.00 0.00 0.00 0.00 0.00 0.80 0.80 1.00 15 146 10 95 95 3 146 189 185 186 190 191 179 176 188 188 179 154 190 147 21 4 186 8 185 187 14 187 96 147 64 196 196 9 27 154 16 15 196 189 191 155 Mo H Mo S S Mo H W W W W W H H W W H H W H Mo Mo W Mo W W Mo W S H S W W Mo Mo H Mo Mo W W W H 0.469 0.00 1217 A 7.99 6.59 6.51 6.13 5.15 4.53 4.47 4.18 4.08 3.74 3.57 3.28 2.89 -2.63 2.55 2.52 2.28 2.24 2.19 2.10 2.02 1.99 1.91 1.54 1.40 1.27 1.27 1.26 1.22 1.20 1.20 1.11 1.01 1 2 3 3 2 1 3 2 3 2 3 3 2 2 2 2 2 3 3 3 3 3 2 2 2 2 2 2 2 3 2 3 2 S S S S S S S S S S S S S P:y S S S S S S S S S S S S S S S S S S S -6.493 -4.108 0.830 0.830 2.471 -6.493 0.830 -4.108 0.830 -4.108 0.830 0.830 -4.108 -0.555 2.471 -4.108 -5.688 1.231 0.830 0.830 0.830 0.830 -4.108 -4.108 -4.108 -5.688 -4.108 -4.108 -4.108 1.231 -4.108 0.830 -5.688 1.00 1.00 0.00 0.00 0.00 1.00 0.00 1.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 1.00 2.00 0.00 0.00 0.00 0.00 0.00 1.00 1.00 1.00 2.00 1.00 1.00 1.00 0.00 1.00 0.00 2.00 158 23 25 23 158 145 27 27 6 25 11 28 28 22 145 11 188 188 2 26 19 1 6 1 19 187 21 22 26 187 2 22 189 H Mo Mo Mo H H Mo Mo Mo Mo Mo Mo Mo Mo H Mo W W Mo Mo Mo Mo Mo Mo Mo W Mo Mo Mo W Mo Mo W 0.503 0.00 1218 A 7.55 6.13 5.93 5.14 4.75 4.48 4.37 3.74 3.73 2.90 2.85 2.83 2.79 -2.05 -2.02 1.98 -1.75 1.74 1.73 1.66 1.66 -1.58 -1.58 1.54 -1.54 1.53 1.52 1.50 1.48 -1.46 1.42 -1.42 1.40 -1.30 -1.28 1.26 1.25 1.25 1.22 -1.19 1.18 1.16 1.13 1.11 -1.11 1.10 -1.09 -1.07 1.06 1.04 1.03 -1.02 1.00 1 2 1 1 1 1 1 2 1 1 2 2 3 3 3 1 3 1 1 1 2 3 2 3 3 2 3 2 3 3 2 2 2 2 3 1 2 1 3 3 2 3 2 2 3 2 3 4 2 2 2 3 2 S S S S S S S S S S S P:y S S P:y S P:y S S S S P:z S S P:z P:z S S S P:z P:z S P:z S P:z S P:x S S S S S S S P:x P:x P:y S S S S S S -6.493 -4.108 -6.493 -6.493 -6.493 -6.493 -6.493 2.471 -6.493 -6.493 -4.108 -7.014 0.830 5.346 3.474 -6.493 3.474 -6.493 -6.493 -6.493 -4.108 3.474 2.471 0.830 3.474 -7.014 0.830 2.471 0.830 3.474 -7.014 2.471 -7.014 2.471 3.474 -6.493 -7.014 -6.493 0.830 5.346 2.471 0.830 -4.108 2.471 3.474 -7.014 3.474 10.873 -5.688 -5.688 -4.108 0.830 -5.688 1.00 1.00 1.00 1.00 1.00 1.00 1.00 0.00 1.00 1.00 1.00 1.33 0.00 0.00 0.00 1.00 0.00 1.00 1.00 1.00 1.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 1.33 0.00 1.33 0.00 0.00 1.00 1.33 1.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.33 0.00 0.00 2.00 2.00 1.00 0.00 2.00 163 8 149 146 155 156 176 146 179 154 2 36 2 95 36 182 91 161 181 171 10 36 154 14 64 64 10 181 16 95 97 179 95 156 97 145 94 147 1 64 147 24 24 176 97 64 58 8 185 196 16 3 190 H Mo H H H H H H H H Mo S Mo S S H S H H H Mo S H Mo S S Mo H Mo S S H S H S H S H Mo S H Mo Mo H S S S Mo W W Mo Mo W 0.544 0.00 1219 A 12.85 9.28 4.76 3.66 3.42 3.18 3.02 3.01 -2.88 2.79 2.73 2.63 -2.48 -2.45 2.44 2.30 2.18 2.14 2.08 -2.08 2.07 1.99 1.97 1.85 1.71 1.70 1.68 1.59 1.58 -1.49 1.46 1.41 1.40 1.40 1.37 -1.36 1.31 1.30 1.17 1.15 1.14 1.11 -1.10 -1.10 -1.08 1.05 1.05 1.05 1.03 1.01 1.00 2 3 1 1 3 3 2 1 3 2 3 1 3 2 3 2 1 1 2 2 3 2 3 3 2 2 3 2 1 2 2 2 3 1 2 4 3 3 3 2 2 2 3 3 2 3 3 2 1 2 2 S S S S S S S S S S S S P:z S S S S S S P:y S P:z S S S S S S S S S S S S S S P:y S S S P:y S P:y S S S S S S S S -4.108 0.830 -6.493 -6.493 0.830 0.830 -5.688 -6.493 5.346 2.471 0.830 -6.493 3.474 2.471 1.231 -5.688 -6.493 -6.493 -4.108 -0.555 0.830 -7.014 0.830 1.231 -4.108 -5.688 0.830 -4.108 -6.493 -4.108 -4.108 -5.688 1.231 -6.493 -5.688 10.873 3.474 0.830 0.830 -4.108 -7.014 -4.108 3.474 5.346 2.471 1.231 0.830 2.471 -6.493 2.471 -5.688 1.00 0.00 1.00 1.00 0.00 0.00 2.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 2.00 1.00 1.00 1.00 0.00 0.00 1.33 0.00 0.00 1.00 2.00 0.00 1.00 1.00 1.00 1.00 2.00 0.00 1.00 2.00 0.00 0.00 0.00 0.00 1.00 1.33 1.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 2.00 1 1 162 163 6 4 193 157 77 166 16 166 97 181 193 192 175 180 6 1 2 97 25 192 16 189 23 25 169 3 27 191 189 147 194 1 77 27 28 23 96 26 96 58 171 191 26 163 181 169 190 Mo Mo H H Mo Mo W H S H Mo H S H W W H H Mo Mo Mo S Mo W Mo W Mo Mo H Mo Mo W W H W Mo S Mo Mo Mo S Mo S S H W Mo H H H W 0.555 0.00 1220 A 6.29 5.31 4.77 4.42 4.06 3.76 3.25 2.76 2.59 2.54 2.17 2.08 2.00 1.89 1.81 1.75 1.58 1.58 1.48 1.47 1.42 1.40 1.39 1.38 1.36 1.33 1.26 1.26 1.24 1.21 1.16 1.12 -1.08 1.03 -1.01 -1.00 2 2 3 2 2 3 3 3 2 3 3 3 1 3 2 2 2 1 2 1 2 2 1 2 1 1 3 2 3 2 3 2 3 2 3 2 S S S S S S S S S S S S S S S S S D:xy S D:xy P:z S D:yz S S S S S S S S S S S S S -5.688 -5.688 1.231 -5.688 -5.688 1.231 1.231 1.231 -5.688 0.830 1.231 0.830 -6.493 0.830 -5.688 2.471 -4.108 -4.498 2.471 -4.498 -5.506 -4.108 -4.498 2.471 -6.493 -6.493 1.231 -4.108 0.830 -4.108 0.830 -5.688 0.830 -5.688 5.346 -4.108 2.00 2.00 0.00 2.00 2.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 1.00 0.00 2.00 0.00 1.00 0.80 0.00 0.80 1.00 1.00 0.80 0.00 1.00 1.00 0.00 1.00 0.00 1.00 0.00 2.00 0.00 2.00 0.00 1.00 190 188 190 191 189 188 191 189 196 7 196 9 169 14 187 146 9 188 169 191 197 14 196 175 146 175 187 21 15 10 8 185 4 186 95 13 W W W W W W W W W Mo W Mo H Mo W H Mo W H W P Mo W H H H W Mo Mo Mo Mo W Mo W S Mo 0.570 0.00 1221 A 7.65 7.46 6.34 4.70 4.26 -4.06 3.82 3.66 3.28 2.93 2.84 2.74 2.63 2.62 2.61 -2.28 2.22 2.17 2.10 2.03 1.80 1.58 -1.52 -1.51 -1.51 1.50 -1.45 1.38 1.38 1.32 1.31 1.31 1.23 1.22 1.17 1.15 1.15 1.14 1.12 -1.10 1.09 1.07 1.05 -1.03 1.02 1.01 3 1 1 3 2 3 2 1 3 2 1 1 3 1 2 2 1 3 2 3 3 3 2 3 3 1 3 3 2 2 1 1 3 2 2 3 1 2 1 3 1 2 2 3 1 2 S S S S P:z P:z S S S S S S S S S S S S S S S S S P:y S S S S S S S S S S P:y S S S S P:y S S P:y P:z S P:x 0.830 -6.493 -6.493 0.830 -7.014 3.474 -5.688 -6.493 1.231 -4.108 -6.493 -6.493 0.830 -6.493 -4.108 -4.108 -6.493 0.830 -4.108 0.830 0.830 0.830 2.471 3.474 5.346 -6.493 0.830 0.830 -4.108 2.471 -6.493 -6.493 0.830 -5.688 -7.014 1.231 -6.493 -4.108 -6.493 3.474 -6.493 -5.688 -7.014 3.474 -6.493 -7.014 0.00 1.00 1.00 0.00 1.33 0.00 2.00 1.00 0.00 1.00 1.00 1.00 0.00 1.00 1.00 1.00 1.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 1.00 1.00 0.00 2.00 1.33 0.00 1.00 1.00 1.00 0.00 1.00 2.00 1.33 0.00 1.00 1.33 20 163 162 14 97 97 196 183 196 2 175 184 6 157 27 13 180 9 20 7 19 2 175 91 97 171 13 18 6 183 161 181 12 192 96 192 147 21 169 96 155 186 30 30 154 96 Mo H H Mo S S W H W Mo H H Mo H Mo Mo H Mo Mo Mo Mo Mo H S S H Mo Mo Mo H H H Mo W S W H Mo H S H W S S H S 0.596 0.00 1222 A 6.51 5.37 4.83 4.68 4.18 3.82 3.58 3.16 3.15 3.00 2.56 2.52 2.45 2.31 1.94 1.84 1.72 1.70 1.60 1.59 1.59 1.56 -1.44 1.40 1.39 1.37 1.29 1.26 1.18 1.18 1.15 1.14 1.12 1.00 2 2 2 3 3 3 3 2 3 3 2 1 3 1 3 2 2 1 2 2 1 1 3 3 2 1 1 2 1 2 2 1 1 1 S S S S S S S S S S S S S S S S S D:yz S S S S S S P:y S S S S S S D:xz D:xz D:xz -5.688 -5.688 -5.688 1.231 0.830 1.231 0.830 -5.688 0.830 1.231 -4.108 -6.493 1.231 -6.493 0.830 -4.108 -4.108 -4.498 -5.688 -4.108 -6.493 -6.493 0.830 0.830 -5.506 -6.493 -6.493 -5.688 -6.493 -5.688 2.471 -4.498 -4.498 -4.498 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 1.00 1.00 0.00 1.00 0.00 1.00 1.00 0.80 2.00 1.00 1.00 1.00 0.00 0.00 1.00 1.00 1.00 2.00 1.00 2.00 0.00 0.80 0.80 0.80 194 195 193 194 5 195 20 196 19 193 25 180 196 157 25 26 5 186 192 20 163 169 7 3 197 175 162 186 183 189 169 192 195 193 W W W W Mo W Mo W Mo W Mo H W H Mo Mo Mo W W Mo H H Mo Mo P H H W H W H W W W 0.642 0.00 1223 A 7.10 6.17 5.96 5.78 -4.69 4.28 3.89 3.12 3.00 3.00 2.71 -2.71 2.59 2.35 2.35 2.12 2.10 2.09 1.90 1.88 1.88 1.73 1.69 1.56 1.47 1.42 1.36 1.20 1.20 1.17 -1.14 1.14 1.13 1.04 1.03 2 3 3 2 2 2 2 3 2 3 3 3 2 2 1 2 3 2 3 3 2 1 3 3 2 2 2 2 1 3 2 2 1 2 1 S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S P:x S D:xz S D:xy -4.108 0.830 0.830 -4.108 -4.108 -5.688 -4.108 0.830 -5.688 1.231 0.830 0.830 -4.108 -5.688 -6.493 -5.688 1.231 -4.108 0.830 0.830 -4.108 -6.493 1.231 1.231 2.471 -4.108 -5.688 -5.688 -6.493 0.830 -0.555 2.471 -4.498 -5.688 -4.498 1.00 0.00 0.00 1.00 1.00 2.00 1.00 0.00 2.00 0.00 0.00 0.00 1.00 2.00 1.00 2.00 0.00 1.00 0.00 0.00 1.00 1.00 0.00 0.00 0.00 1.00 2.00 2.00 1.00 0.00 0.00 0.00 0.80 2.00 0.80 23 16 23 16 17 191 26 25 193 191 26 17 25 185 159 192 193 22 24 28 24 169 185 192 159 27 196 195 158 4 22 169 194 189 189 Mo Mo Mo Mo Mo W Mo Mo W W Mo Mo Mo W H W W Mo Mo Mo Mo H W W H Mo W W H Mo Mo H W W W 0.695 0.00 1224 A 8.09 7.17 6.96 6.57 6.48 5.45 5.08 4.95 4.47 4.32 3.98 3.82 3.81 3.23 3.01 2.98 2.88 2.59 2.45 2.08 2.04 1.46 1.41 1.28 1.20 -1.13 1.12 1.10 -1.03 -1.02 1.00 1 1 2 2 2 3 3 1 2 2 2 2 3 3 3 3 2 3 3 2 2 3 2 2 3 2 2 2 3 2 3 S S S S S S S S S S S S S S S S S S S S S S S S S S S S S P:z S -6.493 -6.493 -4.108 -4.108 -4.108 0.830 0.830 -6.493 -4.108 -4.108 2.471 2.471 0.830 0.830 0.830 0.830 2.471 0.830 0.830 -4.108 -5.688 1.231 -4.108 -5.688 0.830 -4.108 -4.108 -4.108 5.346 -0.555 0.830 1.00 1.00 1.00 1.00 1.00 0.00 0.00 1.00 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.00 0.00 1.00 2.00 0.00 1.00 1.00 1.00 0.00 0.00 0.00 145 158 11 1 28 26 24 169 26 24 158 145 11 1 17 28 169 5 7 17 192 192 5 186 3 23 25 27 77 22 27 H H Mo Mo Mo Mo Mo H Mo Mo H H Mo Mo Mo Mo H Mo Mo Mo W W Mo W Mo Mo Mo Mo S Mo Mo 0.745 0.00 1225 A 9.84 9.01 8.36 7.20 3.58 3.43 2.79 2.72 -2.53 2.34 2.17 2.13 2.09 1.99 1.98 1.86 1.85 -1.83 -1.83 -1.79 1.73 1.73 1.65 -1.63 1.59 -1.59 1.52 1.40 1.37 1.34 1.33 -1.28 1.27 1.23 1.19 1.18 -1.16 1.13 1.12 1.08 -1.07 1.04 -1.00 2 2 3 3 2 2 2 2 3 3 2 2 2 2 3 1 3 2 2 2 2 2 2 2 2 3 1 2 2 1 1 4 3 3 2 2 3 3 2 3 4 3 3 S S S S S P:x P:x S S S S S S S S S S S S S P:x P:x S S S P:x S P:z P:y S S S S P:z P:z S P:z S S S S S P:x -4.108 -4.108 0.830 0.830 -4.108 -0.555 -0.555 -4.108 0.830 0.830 -4.108 -4.108 -4.108 -4.108 0.830 -6.493 0.830 -4.108 2.471 2.471 -0.555 -0.555 2.471 -4.108 -4.108 3.474 -6.493 -7.014 -7.014 -6.493 -6.493 10.873 0.830 3.474 -7.014 2.471 3.474 0.830 2.471 0.830 10.873 0.830 3.474 1.00 1.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 1.00 1.00 1.00 1.00 0.00 1.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 1.00 1.00 0.00 1.00 1.33 1.33 1.00 1.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 3 5 20 27 21 28 15 8 3 7 20 28 10 7 183 9 8 183 177 3 8 175 4 5 52 177 93 30 169 175 3 21 97 30 148 93 12 169 6 21 14 75 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo H Mo Mo H H Mo Mo H Mo Mo S H S S H H Mo Mo S S H S Mo H Mo Mo Mo S 0.815 0.00 1226 A 12.89 11.18 10.84 9.02 8.19 6.23 5.50 5.18 4.57 4.53 4.13 2.99 -2.78 2.58 2.48 2.44 2.25 2.14 2.10 2.08 1.96 -1.88 1.77 -1.63 1.62 1.62 1.48 1.48 1.34 -1.30 1.30 -1.20 1.18 -1.16 1.11 1.11 -1.06 1.03 1.02 -1.02 -1.01 1.00 3 3 3 3 3 3 3 3 2 3 2 3 2 2 3 3 2 2 3 2 2 3 2 3 2 3 3 2 2 3 1 3 3 2 2 2 3 2 1 3 3 3 S S S S S S S S S S S S S S S S S S S S S P:z S P:z S S S S S P:z S S S S P:x S S S D:yz S P:y S 0.830 0.830 0.830 0.830 0.830 0.830 0.830 0.830 -4.108 0.830 -5.688 0.830 -4.108 -5.688 1.231 0.830 2.471 -4.108 0.830 -4.108 -4.108 3.474 -5.688 3.474 2.471 0.830 0.830 -4.108 2.471 3.474 -6.493 5.346 1.231 -4.108 -5.506 -4.108 5.346 -5.688 -4.498 5.346 3.474 1.231 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 2.00 0.00 1.00 2.00 0.00 0.00 0.00 1.00 0.00 1.00 1.00 0.00 2.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 1.00 1.00 1.00 0.00 2.00 0.80 0.00 0.00 0.00 13 9 14 5 20 15 19 17 20 7 189 18 10 187 189 8 149 17 12 9 5 39 186 34 154 10 21 28 179 44 169 39 186 12 197 13 35 185 187 40 33 187 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo W Mo Mo W W Mo H Mo Mo Mo Mo S W S H Mo Mo Mo H S H S W Mo P Mo S W W S S W 0.826 0.00 1227 A 6.94 5.21 4.88 4.74 4.60 4.27 3.35 3.23 3.06 3.03 2.52 2.50 2.46 2.44 2.29 2.15 2.11 2.04 1.96 1.90 1.63 1.63 1.60 1.53 1.50 1.48 1.46 1.39 1.37 1.35 -1.14 1.11 1.04 1.04 1 2 3 1 2 3 2 3 2 2 2 2 3 3 1 3 2 2 3 3 2 2 2 3 2 2 3 2 3 3 2 3 2 3 S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S P:z S S S -6.493 -4.108 0.830 -6.493 -4.108 0.830 2.471 0.830 -5.688 -4.108 -5.688 -4.108 0.830 0.830 -6.493 0.830 -5.688 2.471 1.231 0.830 -4.108 -5.688 -5.688 1.231 -4.108 -4.108 1.231 2.471 0.830 0.830 -0.555 1.231 2.471 0.830 1.00 1.00 0.00 1.00 1.00 0.00 0.00 0.00 2.00 1.00 2.00 1.00 0.00 0.00 1.00 0.00 2.00 0.00 0.00 0.00 1.00 2.00 2.00 0.00 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 24 5 145 26 24 158 16 185 16 194 5 8 26 159 3 186 145 185 2 1 192 187 194 2 6 186 159 28 23 22 192 175 6 H Mo Mo H Mo Mo H Mo W Mo W Mo Mo Mo H Mo W H W Mo Mo W W W Mo Mo W H Mo Mo Mo W H Mo 0.917 0.00 1228 A 3.52 3.38 3.20 3.08 2.92 2.65 2.64 2.63 2.47 2.22 -2.14 2.13 2.09 2.05 1.99 1.94 1.93 1.80 1.80 1.73 1.63 1.61 1.50 1.48 1.45 1.39 1.39 -1.32 1.31 1.28 1.15 -1.13 -1.12 1.10 1.01 2 2 2 1 2 2 1 2 1 1 3 2 3 2 3 3 2 1 2 3 3 1 1 2 1 3 3 2 3 1 1 3 3 3 3 S S S D:xy S S D:xy S D:xz D:xy S S S S S S S D:xy S S S S D:xz S D:xz S P:z S S D:xz D:z2 P:z S S S -4.108 -5.688 -5.688 -4.498 -5.688 -5.688 -4.498 -5.688 -4.498 -4.498 0.830 -5.688 1.231 -4.108 0.830 1.231 -4.108 -4.498 -4.108 1.231 0.830 -6.493 -4.498 -5.688 -4.498 0.830 3.474 -4.108 1.231 -4.498 -4.498 3.474 0.830 0.830 1.231 1.00 2.00 2.00 0.80 2.00 2.00 0.80 2.00 0.80 0.80 0.00 2.00 0.00 1.00 0.00 0.00 1.00 0.80 1.00 0.00 0.00 1.00 0.80 2.00 0.80 0.00 0.00 1.00 0.00 0.80 0.80 0.00 0.00 0.00 0.00 6 195 191 188 188 193 190 192 193 191 12 190 195 11 6 191 28 189 16 192 16 169 195 194 194 11 61 12 188 192 188 38 7 14 193 Mo W W W W W W W W W Mo W W Mo Mo W Mo W Mo W Mo H W W W Mo S Mo W W W S Mo Mo W 0.946 0.00 1229 A 12.13 7.42 7.25 7.02 6.14 5.54 3.56 3.36 3.29 2.97 2.78 2.57 2.41 2.15 2.05 2.02 -1.74 -1.62 1.53 1.46 1.45 1.43 1.42 -1.39 1.34 1.30 1.30 -1.20 -1.17 1.16 1.15 1.11 -1.08 1.08 1.05 1.03 1.03 -1.03 -1.02 2 3 2 2 3 2 2 2 3 3 2 2 2 3 2 1 4 3 1 1 3 2 2 3 2 2 3 3 3 2 2 2 2 3 3 2 3 4 3 S S S S S P:x S S S S S S P:x S S S S P:x S S S S P:x P:z S S S P:x S S S P:x S S P:z P:x P:x S S -4.108 0.830 -4.108 -4.108 0.830 -0.555 -4.108 -4.108 0.830 0.830 -4.108 2.471 -0.555 0.830 2.471 -6.493 10.873 3.474 -6.493 -6.493 0.830 -4.108 -0.555 3.474 2.471 2.471 0.830 3.474 0.830 2.471 -4.108 -0.555 2.471 0.830 3.474 -0.555 3.474 10.873 5.346 1.00 0.00 1.00 1.00 0.00 0.00 1.00 1.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 1.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 20 20 21 9 28 15 28 8 21 9 175 3 2 149 166 3 52 177 175 3 4 15 96 166 180 14 75 27 179 27 1 183 28 36 8 64 20 92 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo H Mo Mo H H Mo S H H Mo Mo Mo S H H Mo S Mo H Mo Mo H Mo S Mo S Mo S 0.962 0.00 1230 A 6.55 5.94 5.70 5.37 5.10 5.00 4.75 4.68 4.67 3.19 3.06 3.01 2.80 2.31 2.28 2.12 2.08 2.05 1.97 1.96 1.82 1.76 1.67 1.66 1.47 1.45 1.42 -1.42 1.33 -1.27 1.24 1.16 -1.06 -1.00 3 2 3 2 2 3 2 2 2 3 3 1 3 3 2 3 1 3 3 2 3 2 2 2 2 1 3 3 1 3 3 2 3 2 S S S S S S S S S S S S S S S S D:yz S S S S S S S S S S P:x D:xy S S S P:x P:x 0.830 -4.108 0.830 -4.108 -4.108 0.830 -4.108 -5.688 -4.108 0.830 0.830 -6.493 0.830 0.830 -4.108 0.830 -4.498 1.231 0.830 -5.688 0.830 2.471 -5.688 -4.108 -4.108 -6.493 0.830 3.474 -4.498 5.346 0.830 -4.108 3.474 -0.555 0.00 1.00 0.00 1.00 1.00 0.00 1.00 2.00 1.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 0.80 0.00 0.00 2.00 0.00 0.00 2.00 1.00 1.00 1.00 0.00 0.00 0.80 0.00 0.00 1.00 0.00 0.00 6 1 11 6 11 13 28 187 16 2 17 159 12 18 2 16 187 187 4 189 1 159 190 13 4 169 7 81 190 37 3 23 41 11 Mo Mo Mo Mo Mo Mo Mo W Mo Mo Mo H Mo Mo Mo Mo W W Mo W Mo H W Mo Mo H Mo S W S Mo Mo S Mo 1.015 0.00 1231 A 20.96 14.36 11.08 8.68 5.49 3.93 3.93 3.67 3.65 3.19 2.76 2.65 -2.45 2.23 -2.13 1.69 -1.65 1.57 -1.51 1.51 -1.43 1.42 1.38 1.31 1.29 1.27 1.26 1.25 1.22 -1.21 1.21 1.18 1.16 -1.14 1.14 -1.11 -1.08 1.04 1.04 -1.02 1.01 -1.00 1.00 2 3 3 2 3 3 2 2 2 3 3 3 4 3 2 3 3 1 3 2 3 1 3 3 3 2 3 3 2 3 2 2 3 4 2 3 3 2 2 2 2 3 2 S S S S S S S S S S S S S S S S P:y D:yz S S P:y D:xz S S S S S S S P:z S S S S S P:z P:z P:x S S P:x P:y P:x -4.108 0.830 0.830 -4.108 0.830 0.830 -5.688 -5.688 -4.108 0.830 0.830 0.830 10.873 0.830 2.471 1.231 3.474 -4.498 5.346 -4.108 3.474 -4.498 1.231 0.830 0.830 -5.688 0.830 0.830 -5.688 3.474 -4.108 2.471 0.830 10.873 -4.108 3.474 3.474 -0.555 -4.108 2.471 -0.555 3.474 -0.555 1.00 0.00 0.00 1.00 0.00 0.00 2.00 2.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 1.00 0.00 0.80 0.00 0.00 0.00 2.00 0.00 0.00 2.00 0.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 28 20 5 20 7 8 196 193 5 15 21 3 28 14 170 193 52 196 90 23 75 193 196 9 13 194 12 28 187 34 7 153 23 20 25 92 32 27 4 150 21 35 28 Mo Mo Mo Mo Mo Mo W W Mo Mo Mo Mo Mo Mo H W S W S Mo S W W Mo Mo W Mo Mo W S Mo H Mo Mo Mo S S Mo Mo H Mo S Mo 1.056 0.00 1232 A 21.67 19.99 18.50 10.05 9.92 9.32 9.23 6.85 6.33 -4.57 4.42 4.33 3.89 -3.53 3.07 3.06 -2.50 2.32 2.22 -2.12 -2.04 1.87 -1.82 -1.63 -1.63 1.57 -1.55 -1.54 -1.50 1.44 1.41 -1.35 -1.34 -1.28 1.23 1.21 -1.21 -1.16 -1.12 1.12 1.10 -1.08 3 3 3 3 2 3 3 2 2 3 3 3 2 3 3 2 3 2 3 3 3 2 4 3 2 3 3 3 4 2 3 3 3 3 2 2 3 3 3 2 3 3 S S S S S S S S S P:z S S S P:z S S P:z S S P:x S S S P:y S P:z P:x S S S S P:y P:x S S S S P:x S S S P:x 0.830 0.830 0.830 0.830 -4.108 0.830 0.830 -4.108 -4.108 3.474 0.830 0.830 -4.108 3.474 0.830 -4.108 3.474 -4.108 0.830 3.474 0.830 -4.108 10.873 3.474 -4.108 3.474 3.474 5.346 10.873 -4.108 0.830 3.474 3.474 5.346 2.471 -4.108 0.830 3.474 5.346 -4.108 0.830 3.474 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 12 17 18 19 17 7 13 12 19 42 8 15 7 38 16 18 43 8 23 39 11 6 17 37 11 36 34 42 12 9 10 60 49 43 149 28 24 62 38 13 26 44 Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo Mo Mo S Mo Mo S Mo Mo S Mo Mo Mo S Mo S S S Mo Mo Mo S S S H Mo Mo S S Mo Mo S 1.115 0.00 1233 A 17.19 9.46 8.38 6.41 5.50 4.84 4.56 4.49 4.29 4.03 3.54 -3.33 3.03 2.93 2.68 2.46 2.43 2.42 2.30 2.21 -2.10 2.08 -2.07 2.00 1.96 1.83 1.71 1.67 -1.60 1.58 1.48 1.47 -1.30 1.26 1.21 1.20 1.17 -1.12 1.11 1.11 1.11 1.10 1.08 -1.07 2 2 3 3 3 2 3 2 2 2 3 3 3 1 3 3 3 2 2 3 2 1 3 2 2 3 3 2 2 1 1 2 2 3 2 3 3 2 2 2 2 3 2 4 S S S S S S S S S S S S S S S S S S S S S S P:x S S S S S P:y S S S S S S S S P:y S S S S S S -4.108 -4.108 0.830 0.830 0.830 -4.108 0.830 -4.108 -4.108 -4.108 0.830 5.346 0.830 -6.493 0.830 0.830 0.830 -4.108 -4.108 0.830 2.471 -6.493 3.474 -4.108 -4.108 0.830 0.830 2.471 -0.555 -6.493 -6.493 -4.108 2.471 0.830 -5.688 0.830 0.830 -0.555 -4.108 -4.108 2.471 0.830 -4.108 10.873 1.00 1.00 0.00 0.00 0.00 1.00 0.00 1.00 1.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 1.00 1.00 0.00 0.00 1.00 0.00 1.00 1.00 0.00 0.00 0.00 0.00 1.00 1.00 1.00 0.00 0.00 2.00 0.00 0.00 0.00 1.00 1.00 0.00 0.00 1.00 0.00 28 23 28 23 19 26 25 25 3 21 18 90 3 159 26 5 13 18 27 8 170 145 76 24 13 27 11 159 24 158 150 17 160 24 190 12 14 26 5 4 150 9 6 28 Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo Mo S Mo H Mo Mo Mo Mo Mo Mo H H S Mo Mo Mo Mo H Mo H H Mo H Mo W Mo Mo Mo Mo Mo H Mo Mo Mo 1.184 0.00 1234 A 12.81 9.48 7.70 5.69 4.53 4.12 3.24 2.73 -2.60 2.46 2.24 2.19 2.12 2.07 -2.05 1.98 -1.93 1.78 1.69 1.63 1.61 1.54 1.53 -1.42 -1.40 1.38 1.34 1.30 1.22 -1.17 1.12 1.07 -1.05 1.03 1.01 -1.00 3 2 2 3 1 1 3 2 2 2 2 2 2 2 3 2 3 2 2 2 2 3 2 2 4 2 3 1 3 2 2 3 2 3 1 3 S S S S S S S S S S S S P:x S S S S S S S S S S S S S S D:xz S P:y S S S S S P:y 0.830 -4.108 -4.108 0.830 -6.493 -6.493 0.830 -4.108 -4.108 2.471 -4.108 -4.108 -0.555 -4.108 0.830 -4.108 0.830 -4.108 -5.688 2.471 2.471 0.830 -5.688 -4.108 10.873 -4.108 0.830 -4.498 0.830 -0.555 -5.688 1.231 2.471 1.231 -6.493 3.474 0.00 1.00 1.00 0.00 1.00 1.00 0.00 1.00 1.00 0.00 1.00 1.00 0.00 1.00 0.00 1.00 0.00 1.00 2.00 0.00 0.00 0.00 2.00 1.00 0.00 1.00 0.00 0.80 0.00 0.00 2.00 0.00 0.00 0.00 1.00 0.00 2 3 2 3 166 169 18 26 5 166 8 19 28 11 1 23 5 18 188 168 169 4 185 1 3 15 19 195 13 1 186 186 162 185 167 55 Mo Mo Mo Mo H H Mo Mo Mo H Mo Mo Mo Mo Mo Mo Mo Mo W H H Mo W Mo Mo Mo Mo W Mo Mo W W H W H S 1.208 0.00 1235 A 5.26 5.14 4.57 4.08 3.85 3.72 3.71 3.22 3.15 2.77 2.02 2.01 1.84 1.82 1.79 1.69 1.56 1.55 1.41 1.37 1.29 1.27 1.18 1.09 1.06 2 2 2 3 3 3 2 2 3 2 2 1 2 3 3 1 2 2 1 1 3 3 2 3 3 S S S S S S S S S S S D:yz S S S D:yz P:x S D:xz D:xz S S S S S -5.688 -5.688 -5.688 1.231 1.231 1.231 -5.688 -4.108 1.231 -4.108 -4.108 -4.498 -4.108 0.830 0.830 -4.498 -0.555 -4.108 -4.498 -4.498 0.830 0.830 -4.108 1.231 0.830 2.00 2.00 2.00 0.00 0.00 0.00 2.00 1.00 0.00 1.00 1.00 0.80 1.00 0.00 0.00 0.80 0.00 1.00 0.80 0.80 0.00 0.00 1.00 0.00 0.00 196 194 193 196 193 194 187 26 187 3 8 186 23 10 15 185 28 28 195 192 23 19 21 195 9 W W W W W W W Mo W Mo Mo W Mo Mo Mo W Mo Mo W W Mo Mo Mo W Mo 1.211 0.00 1236 A 5.73 4.73 4.50 4.41 3.89 3.57 3.50 3.42 3.29 3.14 -3.03 2.71 2.54 -2.49 2.19 1.84 1.78 1.76 -1.67 1.47 1.46 1.44 1.44 1.32 1.28 1.24 1.19 1.18 1.17 1.12 1.04 1.03 -1.03 -1.02 1.01 1.01 3 2 2 2 1 2 2 2 3 3 2 3 3 3 1 3 3 3 3 1 3 2 3 2 1 2 2 2 1 3 2 2 3 3 2 2 S S S S S S S S S S S S S S S S S S S D:yz S S S S S S S S D:xz S S P:x S S S S 0.830 -4.108 -4.108 -4.108 -6.493 -4.108 -4.108 -4.108 0.830 0.830 -4.108 0.830 0.830 0.830 -6.493 0.830 1.231 0.830 5.346 -4.498 1.231 -4.108 0.830 -5.688 -6.493 -5.688 -5.688 -5.688 -4.498 0.830 -5.688 -0.555 0.830 0.830 2.471 -4.108 0.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 0.00 0.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.80 0.00 1.00 0.00 2.00 1.00 2.00 2.00 2.00 0.80 0.00 2.00 0.00 0.00 0.00 0.00 1.00 2 4 26 2 169 9 23 21 9 4 5 10 15 5 166 3 187 23 79 185 192 25 19 188 165 192 189 193 194 26 187 27 6 7 166 11 Mo Mo Mo Mo H Mo Mo Mo Mo Mo Mo Mo Mo Mo H Mo W Mo S W W Mo Mo W H W W W W Mo W Mo Mo Mo H Mo 1.243 0.00 1237 A 10.90 4.99 4.72 4.15 4.09 4.03 3.04 3.03 2.86 2.47 2.41 2.21 2.08 2.04 1.69 1.68 1.67 1.60 -1.54 1.51 1.36 -1.34 1.30 1.27 1.26 1.23 1.21 1.19 1.16 1.14 1.10 -1.07 1.07 1.05 -1.03 1.02 1.01 1.00 2 2 3 3 2 2 2 2 2 2 2 2 2 2 3 2 2 2 4 3 3 2 2 2 3 3 1 2 1 3 2 3 2 2 3 3 1 3 S S S S S S S S S P:x P:x S P:x S S S S S S P:x P:x S S S S P:x S S S S S P:x P:y S P:z S D:xz S -4.108 -4.108 0.830 0.830 -4.108 -4.108 -5.688 -4.108 -4.108 -0.555 -0.555 2.471 -0.555 -4.108 0.830 2.471 -4.108 -4.108 10.873 3.474 3.474 2.471 -5.688 -5.688 0.830 3.474 -6.493 -5.688 -6.493 0.830 2.471 3.474 -0.555 2.471 3.474 0.830 11.667 1.231 1.00 1.00 0.00 0.00 1.00 1.00 2.00 1.00 1.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 1.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 1.00 2.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 15 7 17 14 17 196 8 10 28 1 177 3 2 18 153 18 20 1 98 46 171 194 193 8 91 169 186 162 21 154 53 1 182 97 14 98 196 Mo Mo Mo Mo Mo Mo W Mo Mo Mo Mo H Mo Mo Mo H Mo Mo Mo S S H W W Mo S H W H Mo H S Mo H S Mo S W