AMS 2021.101 r94406 2021-05-14 2025-02-10T16:32:22.000 GEOMETRY OPTIMIZATION FREQUENCIES DFT PBEc PBEx PBEc PBEx 2706.279641 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Unrestricted Restricted 0.00000 1.0E-08 1000 conjugate-gradient 78.39000 1.93000 1 3 1801.73308489 5138.42919354 Water DFT PW92 == Not Default == UNrestricted Restricted Point Charge Nuclei Frozen Orbital(s) Task GeometryOptimization Properties NormalModes Yes End System Atoms W 1.296371894073353 7.396841635676771 10.92105966624796 adf.R=1.992 O 1.970865266727334 5.050617485976586 4.82549527915155 adf.R=1.72 O 3.510853404895534 2.462533088978055 11.63698384701679 adf.R=1.72 W 1.940188197240748 1.84578314074398 6.448506768678504 adf.R=1.992 W 3.21672376576397 4.357607119275126 12.02241481809871 adf.R=1.992 O 4.816442750587582 4.449327146260837 7.178939166719942 adf.R=1.72 O 0.05000161859640916 8.131451292181504 9.629250985673179 adf.R=1.72 W 3.533043728311618 1.667434632577398 9.849255960002351 adf.R=1.992 W -0.1940508492971491 7.556166791031566 7.762409304873148 adf.R=1.992 O 0.297464681703612 3.928144307541476 9.352864080955889 adf.R=1.72 O 3.627956488901308 4.437369659174551 13.71643576650259 adf.R=1.72 W 0.1440158394134017 4.665546013590677 5.430095737018173 adf.R=1.992 W 3.335767438188402 7.702155391305585 8.096610389042386 adf.R=1.992 O 0.674479999909899 2.774425484892557 5.309324447569976 adf.R=1.72 O 0.1401720376716716 6.458753199697371 6.190068927350016 adf.R=1.72 W 3.673407134137499 4.806205069698132 5.769017863605975 adf.R=1.992 W -0.5565170846100339 4.211014000018407 11.66186845009628 adf.R=1.992 O 6.877313503283739 4.880934175058595 9.131994134315974 adf.R=1.72 O 1.772322085628636 4.127093424288105 7.287013800914181 adf.R=1.72 W -0.2415062129272896 1.51262791391177 9.492138166246347 adf.R=1.992 O 2.84005386859415 4.028550912695525 9.598054468485351 adf.R=1.72 O 1.125545658200127 8.551703687033628 12.2119568551278 adf.R=1.72 O -2.031920709126459 4.499376115859671 10.5534606933451 adf.R=1.72 O 2.590705258561939 6.180262206727816 11.66522908268277 adf.R=1.72 O 4.14212017398956 0.06727610000618549 10.18733649960665 adf.R=1.72 O -0.7754287580006254 -0.1326680241504275 9.722391054839504 adf.R=1.72 O 3.131428202051705 1.55618656607529 7.935264029860397 adf.R=1.72 O 2.700197133050023 8.237955795102211 9.882616486791308 adf.R=1.72 Tc 5.065568265603184 4.630780670496122 9.183970036772566 adf.R=1.967 O -1.777090909711489 2.319218284667728 8.796730654119981 adf.R=1.72 O 4.315682317221013 9.079866272629552 7.653537991069304 adf.R=1.72 O 3.324145322153876 2.880222033051249 5.564936617453702 adf.R=1.72 O -0.02129133832460213 6.076940289539131 11.41210889323828 adf.R=1.72 O -1.286350772894188 4.247092732970287 13.24656620432214 adf.R=1.72 O 1.542719694738871 6.097967452538617 8.874670605800187 adf.R=1.72 O 0.5176384157653017 1.451478261379792 7.685548197033516 adf.R=1.72 Tc -1.848244393541223 4.342812349805365 8.523057703648181 adf.R=1.967 O -1.46052441425821 6.325552938084472 8.308046003335823 adf.R=1.72 O 4.781123178957657 5.093321326813577 4.447920116192833 adf.R=1.72 O 4.570387628478549 6.570902233529073 8.884488996785654 adf.R=1.72 P 1.613375154152739 4.545011599490037 8.779085935331992 adf.R=2.13 O -1.213143865949234 4.207639565618948 6.599617631017684 adf.R=1.72 O 1.317635583496907 3.941917661127223 12.10971150252496 adf.R=1.72 O 4.846091790826061 4.776561695700776 11.21249007492975 adf.R=1.72 O -0.7120811852469237 4.880104757335039 3.921394264480341 adf.R=1.72 O 1.61553130637027 1.396221134260854 10.05687878018086 adf.R=1.72 O -0.6239689356315112 2.299475993467205 11.24084849757081 adf.R=1.72 O 2.083057580386405 0.3371661222388116 5.592635316712742 adf.R=1.72 O 1.589011286110095 8.324985876073882 7.463566642498214 adf.R=1.72 O 5.10082646713863 2.599945903956585 9.454919883627813 adf.R=1.72 O 3.397213881269645 6.590849916646981 6.499572093224026 adf.R=1.72 O -1.177351174670353 8.854880410359408 7.128886202518594 adf.R=1.72 O -3.631584767962122 4.453822656990368 8.12800616479106 adf.R=1.72 End Charge -7 BondOrders 1 7 1.0 1 22 1.0 1 24 1.0 1 28 1.0 1 33 1.0 1 35 1.0 2 12 1.0 2 16 1.0 3 5 1.0 3 8 1.0 4 14 1.0 4 19 1.0 4 27 1.0 4 32 1.0 4 36 1.0 4 48 1.0 5 11 1.0 5 24 1.0 5 43 1.0 5 44 1.0 6 16 1.0 6 29 1.0 7 9 1.0 8 25 1.0 8 27 1.0 8 46 1.0 8 50 1.0 9 15 1.0 9 38 1.0 9 49 1.0 9 52 1.0 10 17 1.0 10 20 1.0 10 37 1.0 10 41 2.0 12 14 1.0 12 15 1.0 12 42 1.0 12 45 1.0 13 28 1.0 13 31 1.0 13 40 1.0 13 49 1.0 13 51 1.0 16 32 1.0 16 39 1.0 16 51 1.0 17 23 1.0 17 33 1.0 17 34 1.0 17 43 1.0 17 47 1.0 18 29 1.0 19 41 2.0 20 26 1.0 20 30 1.0 20 36 1.0 20 46 1.0 20 47 1.0 21 41 2.0 23 37 1.0 29 40 1.0 29 44 1.0 29 50 1.0 30 37 1.0 35 41 2.0 37 38 1.0 37 42 1.0 37 53 1.0 End End Engine ADF Basis Type TZP Core Small End SpinPolarization 0 XC GGA PBE End Unrestricted Yes 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 EndEngine 183.95093200 15.99491400 15.99491400 183.95093200 183.95093200 15.99491400 15.99491400 183.95093200 183.95093200 15.99491400 15.99491400 183.95093200 183.95093200 15.99491400 15.99491400 183.95093200 183.95093200 15.99491400 15.99491400 183.95093200 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 98.00000000 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 98.00000000 15.99491400 15.99491400 15.99491400 30.97376100 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 W O O W W O O W W O O W W O O W W O O W O O O O O O O O Tc O O O O O O O Tc O O O P O O O O O O O O O O O O NOSYM -7 0 SCF CONVERGED 2706.279641 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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 A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B -17.37336725 -472.753628 -7 GEOMETRY CONVERGED 0.00000000074503 0.00058917536721 0.00018098603220 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 W O O W W O O W W O O W W O O W W O O W O O O O O O O O Tc O O O O O O O Tc O O O P O O O O O O O O O O O O 2.4526 -0.9886 -0.9798 2.4525 2.4027 -0.9373 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0.9689 0.9691 0.9695 1.0469 1.0469 1.0509 1.0521 0.9703 0.9677 0.9693 0.9695 1.0509 1.0520 1.0500 1.0478 0.9476 0.9480 0.9808 0.9808 1.0500 1.0477 1.0477 1.0500 0.9694 0.9695 0.9652 0.9649 1.0478 1.0500 1.0520 1.0509 0.9721 0.9780 0.9478 0.9478 1.0520 1.0509 0.9479 0.9476 0.9821 0.9821 0.9708 0.9731 0.9653 0.9652 0.9807 0.9808 0.9808 0.9808 0.9653 0.9652 0.9695 0.9693 0.9914 1.0316 0.9708 0.9731 0.9803 0.9804 0.9695 0.9693 0.9652 0.9653 0.9808 0.9808 0.9478 0.9478 0.9652 0.9653 1.0317 0.9913 0.9677 0.9704 0.9804 0.9804 0.9703 0.9676 1.2501 1.2501 0.9677 0.9704 0.9653 0.9653 0.9731 0.9708 0.9804 0.9803 0.9654 0.9654 0.9695 0.9691 0.9821 0.9821 0.9689 0.9689 0.9731 0.9709 0.9648 0.9651 0.9804 0.9803 0.9780 0.9721 3.0488 3.0489 2.5107 2.5107 2.4909 2.5195 3.0489 3.0488 3.0544 3.0562 2.4816 2.4829 2.5017 2.5064 3.0543 3.0561 3.0517 3.0497 2.5524 2.5608 2.4080 2.4125 3.0519 3.0498 3.0498 3.0519 2.5017 2.5062 2.5206 2.4924 3.0497 3.0517 3.0562 3.0544 2.1955 2.6830 2.5537 2.5537 3.0563 3.0545 2.5608 2.5524 2.4011 2.4011 2.4863 2.4779 2.5049 2.4990 2.4080 2.4126 2.4125 2.4081 2.5049 2.4992 2.5061 2.5015 3.0450 3.0929 2.4866 2.4779 2.4069 2.4192 2.5063 2.5017 2.4991 2.5048 2.4125 2.4081 2.5536 2.5536 2.4990 2.5048 3.0929 3.0445 2.4821 2.4817 2.4069 2.4191 2.4819 2.4831 3.6631 3.6631 2.4823 2.4819 2.5042 2.5043 2.4781 2.4862 2.4191 2.4070 2.5044 2.5043 2.5197 2.4908 2.4012 2.4012 2.5106 2.5108 2.4779 2.4859 2.4923 2.5208 2.4192 2.4070 2.6835 2.1953 1.6631 1.6634 0.0147 0.0147 0.0154 0.0154 1.6635 1.6632 1.6570 1.6977 0.0144 0.0203 0.0159 0.0155 1.6575 1.6971 1.7023 1.6531 0.0218 0.0201 0.0172 0.0172 1.7027 1.6531 1.6529 1.7030 0.0159 0.0155 0.0147 0.0146 1.6532 1.7022 1.6974 1.6573 0.0122 0.0124 0.0202 0.0202 1.6974 1.6573 0.0201 0.0218 0.0176 0.0176 0.0191 0.0151 0.0146 0.0151 0.0172 0.0172 0.0172 0.0172 0.0147 0.0151 0.0155 0.0159 1.4936 3.5320 0.0191 0.0151 0.0171 0.0170 0.0155 0.0159 0.0151 0.0146 0.0172 0.0172 0.0202 0.0202 0.0151 0.0146 3.5323 1.4935 0.0203 0.0145 0.0171 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12 53 33 3 16 12 10 25 51 26 44 O O O O O O W W W O W O Tc O O P O W O O W O Tc O O -10.254 1.00 180 A 12.56 10.71 3.30 2.29 2.15 1.97 1.90 1.86 1.79 1.70 1.66 1.63 1.61 1.60 1.44 1.37 1.29 1.23 1.22 1.18 1.17 1.07 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:x P:y D:yz P:x P:x D:xz D:xy D:xy D:xz P:x P:y P:z P:y D:yz P:z P:x P:z P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 34 20 20 11 32 46 53 35 27 6 7 5 8 24 45 22 34 2 24 48 18 35 O O O O O O P O O W W W W O O O O W O O O O -10.186 1.00 181 A 7.22 7.17 5.33 4.09 3.57 3.07 2.74 2.55 2.02 1.98 1.77 1.76 1.69 1.66 1.65 1.63 1.51 1.48 1.44 1.34 1.33 1.30 1.22 1.16 1.10 1.08 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 P:x P:x P:y P:y P:z D:xy D:xz P:z P:x P:x P:y P:y P:y P:x P:x 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1.35 1.29 1.26 1.25 1.25 1.21 1.21 1.18 1.09 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:x P:z P:x D:z2 P:z P:x P:x D:yz D:x2-y2 P:z D:xz P:z D:z2 D:xz P:y P:y P:z P:z D:yz P:x P:z D:z2 P:z P:y P:x P:z P:y P:y P:y -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -6.613 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33 1.00 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 13 27 39 35 2 43 24 32 1 1 31 4 35 51 10 20 28 17 38 2 41 36 52 32 27 29 46 14 38 36 O O O O W O O O W W O W O Tc W O O O O W O O Tc O O O O O O O -9.919 1.00 186 A 5.76 4.23 4.11 3.62 3.57 3.22 3.14 3.03 2.11 1.98 1.59 1.59 1.55 1.52 1.49 1.41 1.40 1.38 1.37 1.32 1.31 1.31 1.23 1.17 1.16 1.16 1.16 1.12 1.09 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:y P:z P:z P:y P:y P:y P:z P:x P:z P:x D:xy D:x2-y2 D:xz D:xy P:x D:yz P:x P:y P:y P:z D:xz P:y D:xy P:x D:xz P:z D:xy P:x 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 -4.498 -6.613 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -6.613 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.00 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 1.00 13 38 39 23 36 47 29 41 18 36 39 5 52 8 7 48 10 36 35 39 38 6 11 3 38 4 46 9 12 51 O O O O O O O O O O O W Tc W W O W O O O O W O W O W O W O Tc -9.811 1.00 187 A 3.96 3.36 3.01 2.96 2.63 2.57 2.56 2.49 2.41 2.38 2.16 2.10 2.03 2.01 1.92 1.91 1.86 1.85 1.83 1.82 1.71 1.71 1.65 1.53 1.53 1.49 1.45 1.41 1.37 1.33 1.21 1.20 1.20 1.20 1.13 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 1 1 1 1 P:z P:y P:z P:y P:y P:z D:z2 D:yz D:z2 P:z D:yz P:y D:x2-y2 P:y D:yz P:z D:z2 D:yz P:y P:z P:y P:z D:yz P:z P:z P:y D:yz P:z D:xy D:z2 P:y P:z P:y P:x P:y P:x P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -6.613 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -6.613 -9.089 -4.498 -4.498 -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 0.80 1.00 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.00 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 18 39 38 13 18 48 6 52 5 36 6 27 5 41 3 47 7 4 23 24 14 29 8 17 12 48 51 49 2 8 42 31 12 36 28 45 22 O O O O O O W Tc W O W O W O W O W W O O O O W O O O Tc O W W O O O O O O O -9.757 1.00 188 A 2.76 2.62 2.55 2.38 2.24 2.17 2.05 2.04 2.01 1.84 1.76 1.73 1.60 1.52 1.52 1.51 1.45 1.44 1.43 1.41 1.41 1.40 1.37 1.37 1.37 1.29 1.28 1.28 1.19 1.18 1.11 1.11 1.10 1.07 1.06 1.05 1.03 1.02 1.02 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 P:z D:yz P:y D:xy P:z P:z D:z2 D:z2 D:z2 P:y D:z2 P:y P:y P:y P:z P:z P:y D:yz P:z P:z D:x2-y2 P:z P:z D:x2-y2 P:z D:yz D:xz P:y P:x D:xz P:x P:y D:yz P:y P:y D:yz P:y D:yz P:y P:y D:z2 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -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 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 1.33 0.80 1.33 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 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 1.33 0.80 0.80 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 0.80 1.33 0.80 1.33 1.33 0.80 48 9 35 10 44 32 8 2 1 28 7 48 43 27 45 31 29 8 22 40 7 24 18 1 38 10 3 44 13 9 26 23 3 22 14 4 33 2 47 13 6 O W O W O O W W W O W O O O O O O W O O W O O W O W W O O W O O W O O W O W O O W -9.531 1.00 189 A 4.48 3.05 2.76 2.65 2.54 2.46 2.42 2.40 2.29 2.29 2.25 2.11 2.07 1.87 1.72 1.71 1.69 1.69 1.66 1.60 1.57 1.44 1.41 1.41 1.38 1.30 1.25 1.24 1.21 1.21 1.18 1.18 1.10 1.08 1.08 1.03 1.03 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 D:z2 P:z P:z P:y P:z P:y P:y D:xy P:y D:xz D:x2-y2 P:y P:y D:xz P:x P:z D:yz P:z D:xy P:z P:y P:z P:x P:z P:x D:xy D:xy P:x D:z2 P:x D:xz P:x D:xy P:x P:y P:z D:z2 D:xy -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 0.80 1.33 1.33 0.80 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1 45 40 43 28 22 31 10 46 3 2 35 17 9 26 11 2 32 4 14 27 24 23 22 33 7 5 29 2 31 6 16 8 14 11 20 9 6 W O O O O O O W O W W O O W O O W O W O O O O O O W W O W O W O W O O O W W -9.478 1.00 190 A 4.22 4.05 3.98 3.89 3.66 3.41 3.41 3.30 2.92 2.74 2.65 2.59 2.51 2.25 2.12 1.93 1.87 1.71 1.70 1.61 1.58 1.56 1.43 1.33 1.26 1.23 1.21 1.17 1.14 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 P:x P:x D:x2-y2 D:z2 D:x2-y2 D:z2 P:x P:x P:x P:z P:x D:yz P:x D:yz P:x P:z P:y D:yz P:z P:z P:y D:xz P:x P:z P:x P:x D:xy P:y D:x2-y2 P:y -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -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 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -4.498 -9.089 1.33 1.33 0.80 0.80 0.80 0.80 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 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 0.80 1.33 42 49 7 6 5 8 36 39 30 11 37 10 13 9 38 46 46 5 26 44 33 52 29 39 23 12 52 11 6 44 O O W W W W O O O O O W O W O O O W O O O Tc O O O O Tc O W O -9.457 1.00 191 A 4.34 3.85 3.79 3.79 3.27 2.88 2.48 2.41 2.33 2.19 2.11 1.99 1.90 1.71 1.58 1.55 1.53 1.48 1.41 1.41 1.36 1.36 1.30 1.26 1.25 1.22 1.22 1.21 1.18 1.17 1.08 1.06 1.05 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 1 1 1 1 1 1 D:yz P:x P:z P:y P:z D:yz P:z D:xy P:x P:x P:y D:yz P:y P:z P:y D:yz P:y D:xz D:xz P:y D:yz P:x P:y P:z P:z P:y P:z P:y P:z P:x D:xy P:x P:z D:xy P:x P:x -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -6.613 -9.089 -4.498 -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 -4.498 -9.089 -9.089 0.80 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.00 1.33 0.80 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 0.80 1.33 1.33 3 44 25 16 12 4 26 9 12 48 33 10 24 28 39 52 12 4 10 32 9 30 31 27 36 23 29 13 35 37 3 21 38 8 18 20 W O O O O W O W O O O W O O O Tc O W W O W O O O O O O O O O W O O W O O -9.447 1.00 192 A 4.55 3.49 3.49 3.15 2.95 2.88 2.79 2.62 2.33 2.16 1.86 1.81 1.78 1.67 1.63 1.57 1.54 1.49 1.39 1.36 1.35 1.32 1.30 1.23 1.19 1.10 1.09 1.03 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:z D:z2 P:y P:x P:z D:x2-y2 P:x P:y P:y P:x P:z P:z D:yz P:y D:yz P:y D:yz D:x2-y2 P:y P:z P:y D:z2 P:x P:x P:z P:x D:x2-y2 P:x -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 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 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 1.33 0.80 1.33 0.80 1.33 0.80 0.80 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 1.33 15 33 11 9 46 26 15 10 23 45 20 29 37 34 5 30 6 26 1 7 14 22 29 8 49 22 23 39 5 42 O O O W O O O W O O O O O O W O W O W W O O O W O O O O W O -9.422 1.00 193 A 5.89 3.79 2.87 2.73 2.72 2.71 2.44 2.33 2.12 1.92 1.92 1.79 1.61 1.60 1.51 1.48 1.46 1.44 1.42 1.42 1.38 1.29 1.24 1.23 1.16 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 P:y P:z D:xy D:z2 P:x P:z P:x P:x P:y D:x2-y2 P:x P:y P:z D:yz P:x P:y P:x D:xz P:y P:z D:xy D:yz P:y P:y P:z D:yz P:y -9.089 -9.089 -4.498 -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 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 1.33 1.33 0.80 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 1.33 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 1.33 21 21 1 3 45 16 22 25 25 4 16 14 22 7 47 17 41 2 49 17 2 8 28 44 42 2 45 O O W W O O O O O W O O O W O O O W O O W W O O O W O -9.403 1.00 194 A 2.76 2.66 2.66 2.65 2.65 2.29 2.23 2.12 2.07 2.07 2.03 1.99 1.95 1.88 1.80 1.72 1.68 1.67 1.63 1.62 1.62 1.60 1.56 1.53 1.53 1.46 1.41 1.38 1.36 1.35 1.31 1.20 1.20 1.19 1.11 1.10 1.06 1.05 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 1 1 1 1 D:yz P:y P:z D:yz P:z P:y P:z D:yz P:x P:z D:xy P:z P:y P:x P:y D:yz P:x P:y D:xz D:yz P:y P:z P:x P:y P:x P:x P:y D:xy D:xy P:x D:xz P:z P:z P:z P:z P:y D:xz D:z2 P:z P:y -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -6.613 -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 -9.089 -4.498 -4.498 -9.089 -9.089 0.80 1.33 1.33 0.80 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.00 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 1.33 0.80 0.80 1.33 1.33 4 37 12 3 44 23 30 9 15 29 8 47 12 48 28 10 21 42 7 52 41 49 18 44 45 22 16 6 2 31 5 25 48 18 31 48 1 6 17 14 W O O W O O O W O O W O O O O W O O W Tc O O O O O O O W W O W O O O O O W W O O -9.346 1.00 195 A 4.26 4.22 3.15 3.09 3.07 3.01 2.90 2.76 2.73 2.61 2.55 2.55 2.39 2.22 2.14 2.12 1.99 1.99 1.92 1.49 1.42 1.38 1.37 1.32 1.28 1.28 1.23 1.16 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 P:y P:z D:xy P:z D:xz D:xy D:xz P:x D:z2 P:x P:x P:x D:x2-y2 P:y D:z2 P:z P:z P:y P:x P:x P:z D:yz P:y P:z D:yz P:x P:x P:y D:yz P:y -9.089 -9.089 -4.498 -9.089 -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 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 1.33 1.33 0.80 1.33 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 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 0.80 1.33 43 40 10 22 3 4 9 47 2 25 16 41 1 45 1 45 33 28 23 29 31 2 22 26 4 33 26 24 3 26 O O W O W W W O W O O O W O W O O O O O O W O O W O O O W O -9.317 1.00 196 A 3.05 2.95 2.55 2.44 2.42 2.38 2.31 2.29 2.19 2.10 2.03 2.02 1.82 1.81 1.79 1.71 1.71 1.64 1.63 1.59 1.53 1.51 1.48 1.38 1.36 1.31 1.30 1.24 1.24 1.23 1.07 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 1 1 1 1 1 1 1 1 1 P:x D:xy P:z P:x P:y P:y D:xz P:x P:z P:x D:xz P:z P:z P:x D:yz P:x D:yz P:z D:xy P:x P:y D:z2 D:yz P:y P:x P:x P:y D:z2 P:x D:x2-y2 P:y P:z P:z -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 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-9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -9.089 0.80 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 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 1.00 1.33 1.33 0.80 1.33 3 4 47 10 25 15 41 39 16 33 26 9 12 36 44 13 23 22 16 45 21 38 48 8 2 15 29 41 32 18 52 35 21 1 25 W W O W O O O O O O O W O O O O O O O O O O O W W O O O O O Tc O O W O -9.169 1.00 198 A 6.00 5.66 3.47 3.47 3.20 2.97 2.47 2.43 2.18 2.05 1.94 1.93 1.86 1.85 1.78 1.72 1.71 1.46 1.39 1.32 1.31 1.16 1.15 1.12 1.10 1.08 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 P:x P:x D:x2-y2 D:z2 P:y P:y P:z P:y P:x D:yz P:z P:x P:z P:x D:yz P:x P:z P:z P:y D:x2-y2 P:z D:yz D:x2-y2 P:y P:x P:y P:z P:y -9.089 -9.089 -4.498 -4.498 -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 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 0.80 0.80 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 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 49 42 5 6 45 44 22 48 36 1 44 37 46 39 2 30 39 48 11 7 11 5 6 25 35 36 16 29 O O W W O O O O O W O O O O W O O O O W O W W O O O O O -9.113 1.00 199 A 5.23 4.55 4.34 3.98 3.71 3.52 2.86 2.59 2.56 2.49 2.38 2.37 2.24 2.09 1.89 1.79 1.67 1.59 1.58 1.51 1.48 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 P:y P:x P:x D:xz D:xy P:z P:x P:x D:z2 P:y D:x2-y2 P:y P:x P:x P:x P:x P:z P:z P:z P:x P:x P:y P:y -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -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 -9.089 -9.089 -9.089 1.33 1.33 1.33 0.80 0.80 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 1.33 12 37 30 1 2 12 45 22 8 18 7 44 13 38 20 34 18 17 44 17 14 32 27 O O O W W O O O W O W O O O O O O O O O O O O -9.106 1.00 200 A 7.56 7.51 7.07 6.32 3.05 2.66 2.54 2.41 2.12 2.01 1.72 1.71 1.66 1.60 1.56 1.49 1.48 1.43 1.40 1.37 1.20 1.16 1.16 1.12 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 P:y P:z P:z P:y P:z P:z P:y P:x P:y P:y P:x P:z P:x P:x P:y P:z P:x P:x D:x2-y2 P:x D:x2-y2 D:x2-y2 D:z2 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 -4.498 -9.089 -4.498 -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 1.33 0.80 0.80 0.80 1.33 1.33 31 14 28 17 27 35 32 44 24 23 12 29 24 35 41 47 27 32 8 28 9 3 10 48 21 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 -9.001 1.00 201 A 6.51 6.21 6.00 5.00 4.68 4.67 4.14 3.69 3.34 3.32 2.63 2.50 2.18 1.97 1.94 1.42 1.39 1.21 1.14 1.14 1.13 1.07 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 P:y P:y P:x P:y P:x P:y P:z P:z P:z P:x P:x P:x P:z P:x P:y P:y P:z D:z2 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 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O O O O O O -8.934 1.00 204 A 4.31 3.75 2.91 2.76 2.55 2.44 2.40 2.29 2.25 2.22 2.22 2.08 1.99 1.98 1.96 1.95 1.83 1.77 1.50 1.47 1.46 1.43 1.38 1.31 1.21 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 P:y P:z P:x P:y D:yz P:z P:x P:x P:z P:y P:y P:z P:y P:y P:x D:yz D:z2 P:x P:z D:yz P:z P:y P:z D:yz D:z2 P:x P:x -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 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 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 0.80 1.33 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 45 22 33 16 10 34 21 15 15 20 33 26 25 26 26 4 9 25 25 3 21 21 16 9 3 16 12 O O O O W O O O O O O O O O O W W O O W O O O W W O O -8.888 1.00 205 A 3.75 3.51 3.35 3.01 2.58 2.53 2.32 2.31 2.12 2.04 2.01 1.98 1.90 1.88 1.80 1.77 1.75 1.68 1.60 1.60 1.59 1.52 1.52 1.46 1.41 1.39 1.35 1.32 1.28 1.22 1.21 1.09 1.03 1.03 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 P:z P:y P:x P:x P:x P:y P:x P:x D:xz D:xy P:x D:xy P:z P:y P:z P:x P:z P:x P:y D:xz P:y P:z P:y D:xy D:xy P:z P:z D:xz P:x D:xy P:z P:y D:xz D:xz P:z -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 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -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 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 1.33 1.33 0.80 1.33 0.80 1.33 1.33 0.80 0.80 1.33 35 24 48 18 12 39 44 28 10 3 16 6 38 32 49 17 30 25 37 4 13 27 42 7 8 36 41 7 23 9 29 41 3 5 14 O O O O O O O O W W O W O O O O O O O W O O O W W O O W O W O O W W O -8.882 1.00 206 A 5.58 5.53 3.16 2.70 2.58 2.38 2.37 1.89 1.82 1.76 1.72 1.62 1.57 1.57 1.56 1.35 1.32 1.32 1.25 1.22 1.18 1.18 1.15 1.14 1.12 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 P:y P:z P:z P:x P:x P:z P:y P:y D:xz P:y P:x P:y D:xy P:x P:y P:z P:y P:z P:z P:z P:x P:z P:z P:z P:y D:yz 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 -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 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 40 43 27 31 14 22 32 45 4 46 17 12 9 28 11 24 44 44 37 32 29 11 47 23 18 8 2 35 O O O O O O O O W O O O W O O O O O O O O O O O O W W O -8.826 1.00 207 A 5.84 5.61 5.09 4.90 4.85 4.65 4.29 3.97 3.95 3.47 3.34 3.29 3.25 2.71 1.94 1.68 1.52 1.15 1.08 1.08 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 P:z D:xz P:y P:x P:y D:xy P:z P:x P:x P:x D:xy D:xz P:x P:x P:x P:z P:x P:y P:y D:x2-y2 P:y P:x -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 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 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1.33 1.33 1.33 0.80 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 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.00 1.33 0.80 1.33 1.33 1.33 0.80 36 39 30 45 22 37 37 41 8 25 30 47 49 7 29 42 16 7 8 13 38 6 23 38 13 4 5 34 8 12 48 46 52 49 7 20 11 50 2 O O O O O O O O W O O O O W O O O W W O O W O O O W W O W O O O Tc O W O O O W -8.756 1.00 209 A 5.30 4.76 4.61 4.39 3.99 3.56 3.00 2.86 2.84 2.49 2.17 2.07 2.00 1.73 1.53 1.40 1.34 1.28 1.23 1.19 1.15 1.14 1.13 1.10 1.08 1.08 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 P:z P:y P:x P:y P:z P:x P:x P:x P:y P:z P:y P:z P:x P:z P:y P:x P:z P:x P:y P:z D:x2-y2 P:y D:z2 P:x D:x2-y2 D:z2 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 -4.498 -9.089 -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 1.33 1.33 0.80 1.33 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-8.687 1.00 211 A 3.32 2.92 2.87 2.87 2.85 2.77 2.63 2.61 2.16 2.12 2.01 2.01 1.95 1.93 1.89 1.89 1.81 1.75 1.73 1.71 1.67 1.59 1.37 1.31 1.28 1.26 1.20 1.19 1.15 1.14 1.12 1.05 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 1 1 1 1 1 P:x P:y P:x D:yz P:z P:y D:z2 P:x P:x P:y P:z P:y P:z D:x2-y2 D:yz P:z P:z P:z P:y P:x D:yz P:z P:y P:y P:z P:y P:y P:z P:z P:y D:yz P:x P:z P:z P:y -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 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 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 0.80 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 35 49 32 1 42 45 2 24 27 22 22 30 28 1 2 37 31 17 13 12 52 14 31 41 47 14 28 45 38 39 51 44 29 36 17 O O O W O O W O O O O O O W W O O O O O Tc O O O O O O O O O Tc O O O O -8.661 1.00 212 A 4.92 4.82 4.41 3.79 3.62 3.48 2.79 2.66 2.61 2.39 2.30 2.27 2.16 2.12 1.96 1.91 1.88 1.82 1.80 1.69 1.64 1.62 1.59 1.49 1.44 1.42 1.39 1.33 1.32 1.25 1.12 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:y P:z P:z P:y P:z P:y P:x P:x P:y P:y D:z2 P:z P:x D:x2-y2 P:z P:y P:z D:x2-y2 D:xy P:x D:xz P:x P:x D:z2 P:x P:x D:yz P:y P:x P:z P:x D:z2 -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 -4.498 -9.089 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33 1.33 1.00 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 49 37 42 30 39 36 43 40 38 47 8 25 13 5 13 16 41 7 7 30 6 42 38 51 46 11 3 27 37 24 49 6 O O O O O O O O O O W O O W O O O W W O W O O Tc O O W O O O O W -8.646 1.00 213 A 5.49 4.16 3.60 3.00 2.37 2.18 2.18 2.06 1.93 1.81 1.81 1.81 1.76 1.73 1.72 1.70 1.64 1.64 1.57 1.57 1.55 1.53 1.46 1.44 1.40 1.38 1.38 1.38 1.34 1.33 1.30 1.20 1.08 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 1 1 1 1 1 1 1 1 1 P:y P:z D:x2-y2 P:y P:x P:z P:x D:z2 D:x2-y2 P:x P:x P:x P:z P:x P:z P:y P:x P:x P:x P:y P:z P:y P:z P:z P:y P:x P:x P:z P:x P:x P:y P:x P:x P:x P:x P:y -9.089 -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 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -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 0.80 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 22 45 2 45 41 16 48 1 1 37 47 29 42 30 23 29 14 35 32 25 22 26 38 33 13 17 27 28 24 25 49 23 49 12 16 31 O O W O O O O W 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 -8.597 1.00 214 A 4.69 4.40 4.24 4.21 3.47 3.26 2.34 2.19 2.10 1.83 1.80 1.77 1.74 1.64 1.64 1.55 1.43 1.42 1.33 1.31 1.25 1.16 1.10 1.09 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:y P:z P:y P:z P:y P:z P:x P:x D:z2 P:x P:x P:x P:z P:z D:x2-y2 P:x P:x D:xz P:y P:y D:z2 P:x P:x P:x P:x -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 -6.613 -9.089 -9.089 -4.498 -9.089 -9.089 -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 0.80 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 49 42 22 45 47 41 40 43 1 18 25 16 39 30 52 21 37 5 26 36 2 50 13 11 46 O O O O O O O O W O O O O O Tc O O W O O W O O O O -8.595 1.00 215 A 6.85 6.16 3.87 2.66 2.59 2.01 2.01 2.01 1.97 1.95 1.69 1.67 1.66 1.61 1.53 1.51 1.45 1.35 1.26 1.25 1.24 1.22 1.22 1.19 1.10 1.07 1.05 1.03 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 P:y P:z P:z P:y P:z P:x P:x P:x P:y P:x P:z P:x D:z2 P:z D:xy D:z2 P:y P:x 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43 46 21 49 21 13 36 41 19 39 38 23 3 O O O 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 -8.066 1.00 227 A 9.35 6.61 4.53 3.86 3.77 3.76 3.48 3.23 3.09 2.96 2.38 2.34 2.24 2.01 1.95 1.78 1.78 1.51 1.34 1.30 1.29 1.21 1.05 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 P:y P:z P:y P:z P:x P:x P:x P:y P:x P:z P:y P:y P:x P:y P:x P:z P:y P:z P:z P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 26 33 15 42 34 33 20 49 49 15 33 44 42 21 26 16 25 44 26 21 37 35 25 32 O O O O O O O O O O O O O O O O O O O O O O O O -8.039 1.00 228 A 8.52 7.65 3.46 3.41 3.35 3.17 2.87 2.08 1.94 1.70 1.68 1.60 1.58 1.53 1.50 1.48 1.38 1.34 1.34 1.29 1.29 1.23 1.22 1.20 1.17 1.17 1.10 1.03 1.02 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 1 P:y P:z P:y P:y P:z P:y P:y P:z P:z P:y P:z P:x P:y P:z P:y P:x P:y P:x P:y P:z P:z P:x P:y P:z P:z P:y 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 -9.089 -9.089 -9.089 -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 25 16 30 16 37 12 21 12 21 22 27 37 44 45 26 25 33 28 24 29 25 35 34 14 41 31 23 20 44 30 26 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -8.031 1.00 229 A 5.37 4.81 4.29 3.87 3.74 3.25 3.14 2.98 2.88 2.86 2.76 2.65 2.57 2.48 2.43 1.71 1.67 1.57 1.57 1.56 1.52 1.51 1.48 1.47 1.42 1.28 1.24 1.24 1.23 1.17 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:y P:z P:z P:z P:z P:y P:y P:y P:y P:y P:z P:z P:z P:z P:y P:x P:y P:z P:y P:z P:x P:x P:y P:x P:x P:y P:y P:x 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 37 30 42 34 16 22 25 45 26 20 49 33 20 49 30 38 49 34 13 36 39 33 42 37 37 26 29 47 30 23 41 42 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.982 1.00 230 A 4.71 4.41 4.06 3.82 3.21 3.19 2.91 2.90 2.73 2.46 2.40 2.27 1.86 1.77 1.74 1.73 1.66 1.59 1.57 1.52 1.50 1.47 1.46 1.43 1.29 1.29 1.28 1.26 1.21 1.20 1.15 1.11 1.09 1.08 1.07 1.07 1.06 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:z P:y P:y P:x P:z P:z P:x P:x P:x P:y P:y P:y P:z P:y P:y P:y P:y P:y P:z P:z P:z P:y P:x P:y P:y P:y P:z P:z P:y P:x P:x P:z P:z P:z P:z P:z P:y 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 -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 45 22 37 42 28 30 49 17 31 14 48 30 18 16 25 34 44 31 20 48 14 27 32 35 11 21 12 35 18 49 32 24 28 37 20 44 46 24 34 17 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.934 1.00 231 A 5.39 4.18 3.80 3.77 3.76 3.65 3.65 3.64 3.25 3.04 2.97 2.87 2.80 2.49 2.42 2.30 1.96 1.86 1.85 1.63 1.56 1.52 1.47 1.46 1.43 1.36 1.34 1.33 1.33 1.20 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 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:z P:y P:z P:x P:y P:x P:y P:y P:x P:z P:z P:y P:z P:y P:z P:x P:y P:x P:x P:x D:xy D:xz D:xy P:z P:x P:x 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 -4.498 -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 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 1.33 1.33 14 17 47 31 41 24 28 23 29 27 18 35 12 48 32 27 18 44 12 24 48 22 32 45 17 28 3 4 9 44 14 31 16 35 O O 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 W O O O O O -7.786 1.00 232 A 10.09 5.48 5.38 5.19 4.85 4.08 3.70 3.51 3.39 3.27 2.94 2.84 2.65 2.59 2.22 2.13 1.39 1.12 1.06 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:yz P:x P:y P:y P:z P:z P:y P:x P:z P:y P:z P:y D:yz P:z P:y P:z P:x P:y P:y -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 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 1.33 52 44 40 11 43 46 23 18 29 39 36 13 51 47 41 38 48 46 38 Tc O O O O O O O O O O O Tc O O O O O O -7.730 1.00 233 A 4.51 4.35 3.46 3.43 3.36 3.18 2.91 2.84 2.81 2.68 2.49 2.47 2.23 2.15 2.12 1.95 1.86 1.83 1.82 1.72 1.55 1.42 1.34 1.30 1.28 1.16 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 1 1 1 1 1 1 1 1 1 1 P:x P:x P:x P:z P:z P:z P:x P:x D:xz P:y P:x P:x P:y P:y P:x P:y D:xy P:z P:y P:x P:x P:z P:z P:z P:z P:z P:x P:z P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 42 49 39 13 33 50 41 36 52 38 11 46 26 50 47 47 52 17 14 40 43 18 15 26 41 23 44 11 27 O O O O O O O O Tc O O O O O O O Tc O O O O O O O O O O O O -7.710 1.00 234 A 3.38 3.13 2.95 2.90 2.74 2.73 2.71 2.70 2.48 2.31 2.30 2.29 2.14 2.13 1.96 1.89 1.88 1.82 1.74 1.74 1.70 1.67 1.66 1.64 1.41 1.40 1.38 1.34 1.28 1.25 1.22 1.16 1.12 1.12 1.11 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 1 1 1 1 1 P:x P:x P:x P:y P:x P:y P:y P:x P:z P:z P:y P:y P:z P:z P:z P:y P:x P:z P:y P:z P:z P:z P:z P:x P:x P:x P:y P:x P:y P:z P:x P:y 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 -9.089 -9.089 -9.089 -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 18 23 29 28 38 27 35 13 24 32 46 43 31 39 11 36 37 40 47 12 41 44 16 30 48 14 25 12 17 48 11 44 30 14 42 48 49 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.683 1.00 235 A 6.08 5.76 3.62 3.54 3.51 3.23 3.02 2.96 2.88 2.84 2.27 2.23 2.02 1.99 1.95 1.93 1.78 1.69 1.69 1.50 1.48 1.47 1.29 1.27 1.22 1.18 1.15 1 1 1 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 P:z D:xz 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:x P:x P:x P:y P:x P:y P:x P:y P:z P:x -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 52 50 41 52 50 40 43 47 20 47 29 34 41 26 13 38 42 39 49 33 23 36 22 23 45 36 29 Tc O O Tc O O O O O O O O O O O O O O O O O O O O O O O -7.634 1.00 236 A 4.01 3.55 3.31 3.07 2.81 2.74 2.68 2.60 2.58 2.41 2.28 1.97 1.88 1.88 1.81 1.71 1.63 1.57 1.51 1.51 1.50 1.50 1.40 1.35 1.32 1.29 1.28 1.24 1.22 1.21 1.10 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:y P:z P:z P:x P:z D:xy P:x P:y P:y P:z P:y P:x P:y P:z P:y P:x P:z P:y P:x P:x P:x P:y D:xy D:xz P:y P:x D:xz P:z D:xy D:xy P:y D:z2 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -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 -6.613 -9.089 -4.498 -4.498 -9.089 -6.613 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 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.00 1.33 0.80 0.80 1.33 1.00 13 38 23 28 29 52 31 29 20 35 32 26 23 34 36 17 47 50 14 43 33 41 6 5 39 40 52 39 9 8 22 52 O O O O O Tc O O O O O O O O O O O O O O O O W W O O Tc O W W O Tc -7.621 1.00 237 A 5.66 4.81 4.76 4.58 4.12 4.08 4.02 3.77 3.33 3.29 3.27 3.13 2.78 2.13 2.10 1.88 1.82 1.75 1.73 1.51 1.46 1.27 1.17 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 P:z P:z P:x P:x P:x P:x P:y P:x D:x2-y2 P:x P:x P:z P:y D:z2 P:y D:xy D:xz P:z P:x 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 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -6.613 -6.613 -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 1.00 1.33 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 21 50 20 34 50 33 21 26 52 22 45 42 49 52 50 52 52 16 19 25 39 36 23 25 O O O O O O O O Tc O O O O Tc O Tc Tc O O O O O O O -7.505 1.00 238 A 7.31 5.10 4.91 4.50 4.16 2.93 2.90 2.80 2.78 2.59 2.46 2.44 2.44 2.12 1.68 1.58 1.50 1.50 1.45 1.44 1.44 1.42 1.40 1.33 1.17 1.16 1.16 1.15 1.14 1.00 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:z P:z P:x P:x P:x P:y D:xz P:x P:x P:z P:x P:y P:x P:x P:z P:x P:y P:z P:x P:x D:xy D:xz P:z P:y P:z P:z P:x P:y P:x P:y P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -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 1.00 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 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 23 39 11 50 41 29 52 40 16 15 12 15 49 13 36 34 36 37 24 42 52 51 34 30 40 19 20 24 22 13 27 O O O O O O Tc O O O O O O O O O O O O O Tc Tc O O O O O O O O O -7.503 1.00 239 A 7.83 6.79 5.76 4.72 3.94 3.93 3.71 3.19 3.15 3.11 2.12 2.10 1.59 1.57 1.38 1.29 1.24 1.23 1.21 1.20 1.18 1.07 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 P:x P:y P:z P:y P:x P:x P:x P:x P:y P:z P:y P:x P:x P:y P:x P:x P:y P:z P:x P:y D:xy P:z 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 -9.089 -9.089 -6.613 -9.089 -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 1.33 1.33 1.00 1.33 1.33 0.80 46 39 36 29 11 47 43 38 36 38 20 25 32 19 35 13 47 27 42 46 51 15 13 6 O O O O O O O O O O O O O O O O O O O O Tc O O W -7.418 1.00 240 A 5.25 5.15 4.29 4.26 4.05 3.48 3.46 2.48 2.41 2.33 2.26 2.23 2.21 2.19 1.93 1.91 1.86 1.84 1.84 1.62 1.43 1.36 1.32 1.26 1.26 1.20 1.15 1.15 1.12 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 P:y P:z P:y P:y P:z D:x2-y2 P:z P:y D:z2 P:y P:x P:y D:x2-y2 P:x P:z P:z P:z P:y D:xy D:xz D:yz D:xy D:xy D:xz P:z P:y P:z D:xz D:yz D:yz P:x -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 -9.089 -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 -4.498 -4.498 -9.089 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 1.33 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 0.80 0.80 1.33 40 43 13 11 38 1 46 36 2 29 27 23 2 24 39 23 47 41 9 10 1 8 3 4 29 39 14 7 8 2 46 O O O O O W O O W O O O W O O O O O W W W W W W O O O W W W O -7.377 1.00 241 A 4.91 3.03 2.74 2.61 2.59 2.56 2.52 2.33 2.10 2.05 1.89 1.88 1.86 1.86 1.76 1.73 1.72 1.66 1.58 1.55 1.54 1.54 1.49 1.48 1.34 1.33 1.29 1.28 1.25 1.21 1.21 1.17 1.17 1.17 1.16 1.13 1.13 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 P:x P:x P:x P:x P:z P:x P:x P:y P:z P:z P:z P:z D:xz P:y P:z P:y P:y P:y P:x P:z P:x P:x P:z P:y P:x P:z P:z D:xy P:x P:y P:y P:y P:y P:x P:x P:y P:y 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 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 44 32 18 14 43 17 35 41 36 47 31 29 52 40 35 39 11 13 30 23 27 24 46 23 37 50 48 52 50 17 32 28 38 16 28 50 29 14 38 12 O O O O O O O O O O O O Tc O O O O O O O O O O O O O O Tc O O O O O O O O O O O O -7.335 1.00 242 A 8.88 7.64 4.64 3.97 3.89 3.80 3.72 3.26 3.00 2.47 2.13 1.94 1.89 1.88 1.78 1.61 1.50 1.47 1.39 1.38 1.35 1.25 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 P:x P:x P:z P:x P:y P:z P:y P:x P:y P:z P:y P:x D:xy P:z P:y P:z P:x P:z P:y P:y D:xz 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 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 20 34 34 25 21 42 49 16 20 21 37 33 51 41 47 30 26 13 38 30 51 16 26 47 25 O O O O O O O O O O O O Tc O O O O O O O Tc O O O O -7.182 1.00 243 A 4.99 4.14 3.95 3.00 2.87 2.74 2.69 2.66 2.63 2.48 2.45 2.38 2.24 2.18 1.82 1.75 1.72 1.68 1.64 1.58 1.56 1.56 1.53 1.51 1.50 1.49 1.46 1.46 1.39 1.36 1.34 1.34 1.34 1.28 1.12 1.07 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 P:z D:xz P:y P:x P:y D:xy P:x P:z P:x P:x P:z P:x P:z P:x P:x P:x P:x P:y P:z P:y P:y P:z P:z P:y P:y P:z P:z P:y P:y P:z P:x P:x P:x P:y P:x P:x P:z -9.089 -6.613 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -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 1.00 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 41 51 47 48 38 51 47 13 12 16 21 25 19 41 30 37 31 27 40 28 35 12 32 31 21 24 17 14 43 28 13 38 26 19 33 28 44 O Tc O O O Tc O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.138 1.00 244 A 28.06 9.94 4.16 3.43 2.95 2.94 2.46 2.23 2.20 2.10 2.07 1.77 1.31 1.16 1.10 1.08 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x D:x2-y2 P:z P:z P:x P:y D:x2-y2 P:y P:x P:x P:z P:y P:z D:z2 P:y P:z -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 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 1.00 1.33 1.33 50 19 52 26 44 15 33 51 44 39 36 15 35 11 52 46 32 O O Tc O O O O Tc O O O O O O Tc O O -7.110 1.00 245 A 11.49 7.56 4.77 3.97 3.70 3.50 3.26 3.15 2.89 2.54 2.47 2.29 2.15 2.15 1.89 1.88 1.85 1.85 1.65 1.44 1.43 1.26 1.22 1.20 1.17 1.14 1.08 1.05 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 1 P:y P:z P:y P:z P:z P:y P:y P:x D:xy P:z P:y P:x P:x P:z P:z P:x P:y P:z D:xz P:y P:x P:z P:z P:z P:y P:z P:y P:z P:y P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 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 1.33 1.33 1.33 1.33 1.33 1.33 15 15 42 49 34 20 50 49 52 33 26 42 34 50 39 20 14 17 52 27 14 20 36 24 36 23 16 25 30 37 O O O O O O O O Tc O O O O O O O O O Tc O O O O O O O O O O O -7.050 1.00 246 A 5.71 5.31 4.66 4.17 3.93 3.50 3.45 3.40 2.99 2.87 2.68 2.39 2.22 1.92 1.71 1.70 1.54 1.53 1.53 1.42 1.28 1.28 1.15 1.13 1.11 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 1 P:z P:y P:z P:y P:z P:z P:y P:z P:y P:y P:y P:z P:z P:y D:xz P:x P:y P:x P:y P:y P:x P:z P:y 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 -6.613 -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 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 12 14 17 27 24 44 12 41 35 47 44 18 32 17 51 14 38 23 28 18 29 31 16 25 40 13 30 O O O O O O O O O O O O O O Tc O O O O O O O O O O O O -7.023 1.00 247 A 9.32 7.55 5.78 5.20 3.80 3.60 3.52 3.09 2.91 2.77 2.40 2.38 2.30 2.08 2.04 2.00 1.90 1.69 1.64 1.38 1.22 1.07 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 P:z P:y P:x P:x P:x P:x P:x P:x P:x P:y P:y P:z P:z P:z P:y P:x P:y P:y P:z P:z P:y 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 11 46 13 38 36 23 39 29 47 43 28 40 46 13 38 41 29 37 31 30 30 17 26 23 O O O O O O O O O O O O O O O O O O O O O O O O -6.956 1.00 248 A 8.14 5.05 4.81 4.21 3.98 3.81 3.64 3.51 3.10 2.44 2.40 2.31 2.27 2.27 2.11 2.08 1.94 1.87 1.84 1.80 1.44 1.37 1.37 1.29 1.29 1.25 1 1 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:x P:y P:z P:x P:x P:x P:x P:y P:x P:x P:y P:x P:x P:x P:y P:z P:z P:z P:y P:y P:z P:z P:x P:z -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.00 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 52 51 18 41 47 12 31 28 44 14 35 27 13 32 48 24 38 38 48 17 39 16 36 25 17 44 Tc Tc O O O O O O O O O O O O O O O O O O O O O O O O -6.947 1.00 249 A 7.06 5.42 4.99 4.51 4.30 3.66 3.24 2.84 2.60 2.52 2.08 1.94 1.94 1.92 1.90 1.83 1.67 1.66 1.60 1.52 1.49 1.40 1.34 1.32 1.26 1.20 1.19 1.19 1.18 1.17 1.17 1.16 1.13 1.10 1.08 1.08 1.06 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 P:z P:z P:x P:x P:z P:y P:x D:xy P:y P:x P:x P:y P:y P:x P:y D:xz P:x P:x P:z P:y P:z P:z P:z P:z P:y P:y P:x P:x P:y P:y P:y P:z P:z P:z P:z P:z P:z P:x -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -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 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 21 41 21 47 41 30 47 29 51 37 16 23 28 35 31 19 51 30 37 11 46 38 16 32 40 25 43 36 25 34 36 13 39 31 20 26 19 43 28 O O O O O O O O Tc O O O O O O O Tc O O O O O O O O O O O O O O O O O O O O O O -6.937 1.00 250 A 7.68 3.46 3.19 3.12 3.08 3.06 2.97 2.95 2.79 2.33 2.29 2.22 2.11 2.04 1.94 1.82 1.77 1.75 1.61 1.59 1.58 1.45 1.39 1.33 1.29 1.24 1.22 1.21 1.18 1.17 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 P:x P:x P:x P:x P:x P:x P:z P:x P:y P:z P:x P:x P:x P:x P:z P:x P:x P:y P:x D:x2-y2 P:x P:x P:y P:y P:z P:y P:x P:x P:y 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 -6.613 -9.089 -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 1.00 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 19 18 12 34 20 25 25 13 16 15 38 23 24 27 37 47 16 47 42 51 17 14 30 49 41 29 49 26 15 42 33 39 29 O O O O O O O O O O O O O O O O O O O Tc O O O O O O O O O O O O O -6.907 1.00 251 A 8.50 6.75 5.66 3.52 3.38 3.05 2.51 2.35 2.30 1.94 1.78 1.78 1.62 1.58 1.42 1.41 1.35 1.28 1.27 1.26 1.25 1.21 1.16 1.16 1.07 1.04 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 P:y P:z P:x P:x P:x P:z P:y P:z P:x P:y P:z P:x P:x P:y P:z D:yz P:x P:y P:x P:z P:x P:y P:z P:y 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 -6.613 -9.089 -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 1.00 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 28 31 50 13 38 40 43 11 23 29 46 32 29 46 48 51 12 31 48 23 35 48 47 11 38 36 18 39 15 O O O O O O O O O O O O O O O Tc O O O O O O O O O O O O O -6.840 1.00 252 A 6.33 5.94 5.74 4.24 3.80 2.96 2.86 2.47 2.32 1.74 1.72 1.66 1.54 1.49 1.48 1.33 1.28 1.26 1.25 1.22 1.21 1.17 1.16 1.12 1.09 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:z P:x P:x P:y P:z P:y P:y P:z P:y P:z P:z P:z P:z P:y P:z P:y P:x P:y P:y P:z P:x 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 -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 48 12 44 50 12 38 13 33 26 16 18 29 21 25 46 45 17 37 40 23 43 30 23 18 30 28 O O O O O O O O O O O O O O O O O O O O O O O O O O -6.771 1.00 253 A 24.17 5.10 4.46 4.26 4.03 3.30 2.63 2.31 2.24 1.91 1.86 1.80 1.76 1.45 1.43 1.22 1.08 1.08 1.04 1.02 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:z P:x P:y P:y D:x2-y2 P:x P:x P:y P:y P:z P:x P:z P:z P:y P:y P:x P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 19 17 45 44 22 14 44 51 20 34 33 28 24 21 18 12 12 18 30 26 O O O O O O O Tc O O O O O O O O O O O O -6.768 1.00 254 A 8.66 7.97 3.91 3.67 3.02 2.55 2.49 2.24 1.94 1.92 1.90 1.89 1.89 1.85 1.79 1.71 1.70 1.65 1.62 1.56 1.32 1.32 1.25 1.23 1.19 1.14 1.13 1.12 1.11 1.07 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 P:y P:z P:y P:y P:x P:x P:z P:y P:x P:y P:z P:x P:x P:y P:x P:x D:xy P:z P:x P:z D:xz P:z P:z P:z P:y P:y P:z P:y P:x 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 -6.613 -9.089 -9.089 -9.089 -6.613 -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 1.00 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 20 34 14 27 16 25 24 38 29 19 17 37 13 49 23 14 51 37 30 32 51 43 40 13 43 35 42 25 42 19 30 36 O O O O O O O O O O O O O O O O Tc O O O Tc O O O O O O O O O O O -6.720 1.00 255 A 7.74 6.81 5.42 4.11 3.75 3.04 2.97 2.82 2.67 2.53 2.44 2.44 2.42 2.18 1.84 1.82 1.74 1.70 1.63 1.38 1.34 1.33 1.31 1.24 1.24 1.09 1.07 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 P:z P:z P:y P:y P:y P:y P:z P:y P:y P:z P:x P:z P:z P:x P:x P:x P:y P:y P:z P:x P:z P:y P:x P:y P:x 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 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -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 45 22 22 45 35 39 24 27 13 32 26 36 38 32 14 33 23 33 29 27 25 16 17 32 35 42 17 43 41 47 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.652 1.00 256 A 7.06 6.59 6.47 5.46 5.11 4.75 4.75 3.30 3.14 2.86 2.79 2.50 2.12 2.04 1.97 1.65 1.63 1.59 1.57 1.56 1.49 1.33 1.16 1.14 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:y P:z P:z P:z P:y P:y P:z P:z P:z P:y P:y P:z P:y P:y P:x P:x P:z P:y P:z P:z P:x P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 35 45 32 24 27 22 22 48 18 45 28 44 48 18 49 42 31 44 17 12 37 36 38 13 39 O O O O O O O O O O O O O O O O O O O O O O O O O -6.647 1.00 257 A 4.96 4.80 4.60 3.92 3.86 2.91 2.82 2.82 2.70 2.54 2.53 2.39 2.36 2.09 1.88 1.85 1.78 1.76 1.73 1.72 1.59 1.59 1.56 1.44 1.38 1.37 1.33 1.26 1.23 1.23 1.15 1.15 1.15 1.10 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 1 1 1 1 1 1 1 1 1 1 P:x P:y P:x P:x P:z P:x P:x P:y P:y P:x P:y P:x P:x P:y P:x P:z P:y P:x P:z P:z P:y P:x P:x P:x P:y P:x P:x P:z P:x P:y P:x P:x P:z P:x 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 -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 30 28 13 38 31 37 31 14 37 45 31 22 42 30 33 17 38 26 28 37 17 47 23 39 42 20 28 49 36 21 34 25 30 49 14 23 16 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.576 1.00 258 A 8.59 7.79 6.74 6.16 5.72 5.04 3.71 3.27 2.75 2.75 2.47 2.29 2.26 1.84 1.83 1.67 1.53 1.45 1.38 1.35 1.34 1.24 1.20 1.11 1.05 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 P:y P:z P:y P:z P:z P:z P:y P:y P:x P:x P:z P:y P:z P:y P:y P:y P:z P:x P:x P:y P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 42 49 33 18 44 26 44 18 18 26 40 43 12 12 35 41 47 33 12 49 32 23 29 45 22 16 26 O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.540 1.00 259 A 11.83 10.87 5.93 5.79 5.63 5.05 4.81 4.04 3.53 3.52 3.47 3.22 2.69 2.66 1.81 1.25 1.10 1.08 1.08 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:z P:x P:y P:x P:y P:z P:y P:z P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 16 25 27 24 12 22 33 45 12 26 35 32 24 16 25 32 17 25 14 O O O O O O O O O O O O O O O O O O O -6.530 1.00 260 A 13.68 11.82 9.51 9.40 7.91 4.79 4.70 4.24 4.17 2.03 1.78 1.21 1.20 1.09 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:z P:x P:z P:y P:y P:z P:z P:x P:y P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 37 30 48 48 48 42 49 18 18 18 30 33 19 26 O O O O O O O O O O O O O O -6.520 1.00 261 A 13.24 12.24 10.37 10.26 8.59 7.42 4.01 3.42 3.10 2.95 2.10 1.92 1.62 1.36 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:y P:y P:z P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 45 22 27 35 24 32 25 33 16 26 24 32 32 27 O O O O O O O O O O O O O O -6.441 1.00 262 A 7.47 7.30 4.80 4.61 3.89 3.83 3.66 3.21 3.13 3.02 2.76 2.48 2.29 2.14 2.07 1.97 1.93 1.92 1.91 1.89 1.79 1.76 1.76 1.72 1.49 1.35 1.25 1.22 1 1 1 1 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:x P:y P:x P:x P:x P:z P:y P:z P:z P:x P:z P:x P:y P:x P:x P:x P:x P:z P:y P:y P:z P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 34 20 15 23 21 29 47 41 15 14 17 21 13 26 36 28 33 39 38 26 49 42 35 33 31 29 32 30 O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.417 1.00 263 A 6.53 6.41 6.07 5.33 4.68 4.54 3.94 3.52 3.44 3.43 3.05 2.95 2.36 2.11 1.81 1.71 1.60 1.56 1.44 1.42 1.34 1.32 1.31 1.22 1.08 1.07 1.04 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 P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:z P:x P:x P:y P:z P:y P:x P:z P:x P:y 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 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -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 12 14 17 31 18 28 44 45 22 27 24 32 35 48 28 20 34 17 48 37 19 30 23 31 47 40 43 11 O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.413 1.00 264 A 5.87 4.63 3.49 3.30 3.10 2.99 2.72 2.68 2.67 2.61 2.58 2.41 2.38 2.24 2.21 2.11 2.10 2.04 2.00 1.94 1.79 1.78 1.75 1.70 1.70 1.69 1.66 1.58 1.50 1.27 1.21 1.11 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 1 1 1 1 1 1 1 1 1 1 P:z P:y P:x P:y P:z P:x P:y P:z P:z P:x P:z P:y P:z P:x P:z P:y P:z P:y P:z P:z 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: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 -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 11 46 30 33 26 44 42 18 49 37 45 16 32 42 25 27 22 35 24 46 14 37 43 22 18 49 40 30 17 49 31 45 28 48 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.385 1.00 265 A 9.16 9.09 6.67 6.21 6.18 4.91 4.78 4.40 2.37 2.24 2.00 1.82 1.63 1.62 1.60 1.43 1.39 1.33 1.28 1.28 1.16 1.09 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 P:y P:y P:y P:y P:y P:z P:z P:z P:x P:y P:z P:y P:z P:y P:z P:x P:y P:x P:y 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 -9.089 -9.089 -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 41 23 46 11 40 47 29 43 30 27 11 35 24 47 32 49 29 25 16 38 16 22 39 30 O O O O O O O O O O O O O O O O O O O O O O O O -6.383 1.00 266 A 12.00 6.38 6.27 3.83 3.52 3.47 3.44 3.05 2.50 2.46 2.35 2.18 2.17 1.73 1.70 1.62 1.58 1.46 1.44 1.39 1.37 1.26 1.17 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 1 1 P:z P:z P:y P:z P:z P:z P:y P:x P:y P:z P:x P:z P:z P:z P:z P:z P:z P:y P:z P:x 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 -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 46 11 11 30 47 29 37 37 42 43 42 36 49 37 48 38 18 39 12 49 44 28 14 14 25 O O O O O O O O O O O O O O O O O O O O O O O O O -6.378 1.00 267 A 16.63 14.95 5.74 5.47 3.98 3.90 3.42 2.79 2.33 1.56 1.47 1.46 1.39 1.35 1.32 1.18 1.12 1.09 1.06 1.03 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:x P:z P:y P:y P:z P:z P:y P:z P:z P:z P:y P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 43 40 16 25 26 33 46 40 11 47 29 23 45 30 33 28 26 22 25 41 O O O O O O O O O O O O O O O O O O O O -6.339 1.00 268 A 13.20 11.76 7.39 7.25 4.52 4.05 4.04 3.09 2.29 2.25 2.09 2.07 2.01 1.83 1.51 1.39 1.32 1.30 1.30 1.25 1.18 1.16 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 P:z P:y P:x P:x P:x P:x P:x P:z P:z P:x P:z P:y P:z P:z P:y P:x P:x P:z P:x P:x 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 -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 40 43 33 26 50 16 25 15 18 15 26 42 43 49 15 23 48 33 36 18 18 29 39 31 O O O O O O O O O O O O O O O O O O O O O O O O -6.313 1.00 269 A 10.09 8.49 7.34 7.12 6.67 6.10 3.35 3.25 3.11 2.93 2.92 2.77 1.92 1.65 1.34 1.28 1.27 1.21 1.20 1.20 1.14 1.05 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 P:z P:y P:z P:z P:y P:y P:x P:x P:z P:x P:z P:x P:y P:y P:z P:y P:x P:y P:y P:z P:x P:z P:x 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 11 46 34 40 20 43 37 30 46 49 43 42 21 15 30 40 25 11 28 21 33 15 26 31 14 O O O O O O O O O O O O O O O O O O O O O O O O O -6.287 1.00 270 A 17.55 8.24 3.82 3.70 3.62 3.47 3.40 3.26 2.51 2.40 2.31 2.03 1.77 1.75 1.62 1.57 1.56 1.53 1.45 1.29 1.29 1.20 1.18 1.13 1.13 1.11 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 P:x P:x P:x P:z P:x P:x P:y P:x P:x P:z P:z P:y P:x P:x P:z P:z P:x P:z P:x P:y P:y P:x P:y P:x P:y P:x 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 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22 31 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.143 1.00 272 A 5.56 5.27 5.17 4.89 3.53 3.48 3.31 3.14 2.88 2.72 2.41 2.40 2.29 2.14 2.09 2.08 1.99 1.80 1.78 1.78 1.76 1.76 1.72 1.65 1.29 1.28 1.24 1.21 1.17 1.16 1.11 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 P:z P:y P:z P:x P:x P:y P:z P:y P:x P:y P:x P:x P:x 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:z P:x P:y P:y 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 -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 31 50 50 27 32 27 32 14 24 36 39 36 42 14 35 47 39 18 49 13 31 48 12 49 42 28 28 23 28 37 24 50 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.036 1.00 273 A 10.61 6.98 4.40 4.12 3.85 3.63 3.48 3.45 3.41 3.25 3.11 3.05 2.78 2.78 2.76 2.74 2.72 2.64 2.63 2.51 2.05 1.89 1.67 1.50 1.28 1.22 1.21 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 1 1 1 1 1 P:y P:z P:x P:z P:y P:y P:x P:x P:x P:x P:x P:x P:x P:z P:x P:x P:x P:y P:y P:x P:y P:z P:z P:y P:z D:xy 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 -6.613 -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 1.00 1.33 1.33 1.33 50 50 36 39 36 23 35 32 28 42 31 39 17 29 49 24 14 13 29 27 41 38 47 39 23 52 31 38 49 O O O O O O O O O O O O O O O O O O O O O O O O O Tc O O O -5.979 1.00 274 A 10.65 7.73 6.74 5.15 4.72 4.59 4.05 3.96 3.79 3.54 3.52 2.82 2.71 2.41 2.26 2.06 2.05 1.93 1.90 1.87 1.80 1.78 1.43 1.35 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 P:x P:x P:x P:z P:z P:x P:y P:z P:y P:y P:y P:z P:z P:z P:x P:x P:x P:z P:x P:y P:y P:x P:x 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 44 18 48 38 29 12 13 47 41 39 23 36 50 48 11 46 43 44 36 50 18 40 39 18 12 O O O O O O O O O O O O O O O O O O O O O O O O O -5.951 1.00 275 A 6.74 5.73 5.10 4.99 4.56 4.32 4.24 4.22 4.19 4.06 3.89 3.39 2.51 2.26 2.04 1.95 1.78 1.69 1.61 1.56 1.51 1.45 1.29 1.23 1.21 1.19 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 1 1 P:y P:y P:x P:x P:z P:x P:x P:y P:z P:x P:x P:z P:y P:y P:x P:x P:x P:y P:z P:z P:y P:z P:z P:x 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 50 11 27 24 46 17 14 40 50 36 39 43 13 23 49 42 29 14 17 38 24 27 29 23 27 14 24 17 O O O O O O O O O O O O O O O O O O O O O O O O O O O O -5.934 1.00 276 A 7.28 7.18 6.79 6.16 5.59 4.30 3.17 3.01 2.91 2.84 2.78 2.76 2.61 2.53 2.51 2.43 2.40 2.39 2.19 1.84 1.78 1.74 1.54 1.52 1.47 1.40 1.13 1.09 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:y P:z P:x P:x P:x P:z P:z P:x P:y P:z P:x P:z P:z P:z P:x P:y P:x P:x P:z P:z P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 43 46 11 40 50 50 31 32 28 35 36 35 41 28 39 31 47 32 23 39 29 36 27 14 32 31 17 24 43 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -5.914 1.00 277 A 15.22 9.70 8.37 8.15 7.30 6.44 5.95 4.71 4.13 2.74 2.52 1.50 1.18 1.14 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:y P:x P:x P:z P:x P:y P:y P:z P:y P:z P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 12 40 18 44 43 48 46 11 11 43 46 47 41 40 26 O O O O O O O O O O O O O O O -5.857 1.00 278 A 11.64 8.21 3.82 3.71 3.52 3.40 3.34 3.30 3.12 2.96 2.02 1.94 1.89 1.85 1.77 1.69 1.58 1.57 1.50 1.49 1.45 1.32 1.29 1.29 1.25 1.23 1.21 1.14 1.13 1.12 1.09 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 1 1 1 1 1 1 1 P:z P:y P:x P:x P:x P:x P:z P:x P:x P:x P:y P:z P:y P:y P:y P:z P:y P:y P:y P:z P:z P:x P:x P:x P:z P:z P:z P:z P:z P:x D:xz 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 -6.613 -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 1.00 1.33 1.33 50 50 39 48 36 29 36 42 23 49 13 38 14 39 11 17 23 46 41 47 39 35 32 24 48 32 29 46 31 27 52 11 49 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O Tc O O -5.700 1.00 279 A 5.33 5.10 4.77 4.50 4.34 4.31 4.30 4.16 4.13 4.02 3.89 3.69 3.63 3.59 3.58 3.57 3.44 3.34 3.31 2.94 2.61 1.83 1.60 1.58 1.41 1.24 1.22 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 P:y P:z P:z P:z P:x P:y P:x P:y P:z P:x P:y P:x P:z P:x P:x P:y P:y P:x P:z P:x P:z P:y P:z 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 -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 13 31 47 38 17 39 24 41 36 27 14 35 17 14 28 23 28 32 29 31 32 27 35 24 35 28 29 41 O O O O O O O O O O O O O O O O O O O O O O O O O O O O -5.603 1.00 280 A 8.83 7.69 7.33 6.73 6.55 6.17 5.92 5.37 4.16 2.29 1.65 1.65 1.61 1.53 1.52 1.51 1.50 1.42 1.38 1.27 1.24 1.23 1.19 1.18 1.09 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 P:x P:x P:y P:y P:x P:x P:z P:z P:y P:z P:x P:z P:z P:y P:x P:x P:x P:y P:y P:z P:z P:y 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 -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 12 48 11 40 18 44 43 46 46 11 17 36 48 14 32 35 14 23 39 17 47 41 43 32 13 29 O O O O O O O O O O O O O O O O O O O O O O O O O O -5.409 1.00 281 A 34.34 22.80 6.62 5.49 4.95 4.56 2.95 2.68 1.84 1.75 1.11 1 1 1 1 1 1 1 1 1 1 1 P:y P:z D:xy P:x P:x D:xz P:x P:x P:x P:x P:y -9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 19 19 51 13 38 51 47 41 30 37 38 O O Tc O O Tc O O O O O -5.329 1.00 282 A 32.80 21.09 6.26 4.62 4.38 3.86 3.13 3.10 1.45 1.34 1 1 1 1 1 1 1 1 1 1 P:z P:y D:xz P:x P:x D:xy P:x P:x P:x P:x -9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 19 19 51 38 13 51 47 41 30 37 O O Tc O O Tc O O O O -3.967 1.00 283 A 49.55 5.03 4.87 4.53 4.13 3.29 2.97 1.94 1.22 1.07 1.05 1 1 1 1 1 1 1 1 1 1 1 D:yz P:y P:z P:y P:z P:x P:x D:xy D:xy D:z2 D:x2-y2 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -4.498 -6.613 -6.613 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 0.80 1.00 1.00 52 23 29 39 36 44 18 52 9 52 52 Tc O O O O O O Tc W Tc Tc -3.075 1.00 284 A 28.94 18.97 18.08 12.82 2.68 1.21 1 1 1 1 1 1 D:xy D:xz P:y P:z D:z2 P:z -6.613 -6.613 -9.089 -9.089 -6.613 -9.089 1.00 1.00 1.33 1.33 1.00 1.33 52 52 50 50 52 39 Tc Tc O O Tc O -3.050 1.00 285 A 22.74 19.49 17.31 13.05 4.37 3.55 1.74 1.14 1.06 1 1 1 1 1 1 1 1 2 D:xz D:xy P:z P:y D:z2 D:x2-y2 D:yz P:z D:xz -6.613 -6.613 -9.089 -9.089 -6.613 -6.613 -6.613 -9.089 3.846 1.00 1.00 1.33 1.33 1.00 1.00 1.00 1.33 0.00 52 52 50 50 52 52 52 39 52 Tc Tc O O Tc Tc Tc O Tc -2.859 0.00 286 A 37.22 4.01 3.88 3.73 3.47 2.86 2.78 2.69 2.48 2.00 1.83 1.66 1.51 1.47 1.27 1.17 1.08 1.07 1.06 1.05 1.04 1.02 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:xy D:xz P:x D:x2-y2 D:xy D:z2 P:x D:z2 D:xz D:x2-y2 D:yz D:yz D:z2 D:xy D:x2-y2 P:z P:z P:x P:y P:x D:yz -6.613 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 1.00 0.80 0.80 1.33 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 51 3 4 12 1 8 7 48 2 7 2 8 1 51 7 3 46 48 17 11 14 2 Tc W W O W W W O W W W W W Tc W W O O O O O W -2.688 0.00 287 A 8.12 8.06 7.27 5.81 4.20 3.31 3.12 3.00 2.81 2.60 2.49 2.41 2.33 2.13 1.97 1.63 1.54 1.53 1.31 1.28 1.27 1.19 1.12 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 D:xy D:xz D:xy D:xz D:xy D:xz D:xy P:y D:z2 P:y P:z P:z D:xz D:yz D:x2-y2 P:y P:z D:z2 P:y D:xy D:yz D:yz D:yz P:z -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -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 1.33 0.80 1.33 1.33 1.33 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80 0.80 0.80 0.80 1.33 9 4 3 10 6 5 8 23 10 41 29 47 7 8 3 39 36 7 13 7 9 6 5 38 W W W W W W W O W O O O W W W O O W O W W W W O -2.440 0.00 288 A 11.36 7.64 7.51 4.13 3.58 3.40 3.34 3.17 3.14 2.91 2.68 2.48 1.83 1.77 1.47 1.44 1.34 1.27 1.25 1.23 1.19 1.13 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 D:x2-y2 D:z2 D:x2-y2 D:yz P:y P:z D:xz D:xy D:yz P:y D:z2 P:z D:xy D:xy D:xz D:xz P:y D:xy P:y P:z D:yz P:z P:y P:x -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33 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 2 2 1 40 43 4 3 2 11 1 46 9 6 10 5 41 8 39 47 8 36 13 35 W W W W O O W W W O W O W W W W O W O O W O O O -2.357 0.00 289 A 6.59 5.71 5.52 4.97 4.34 3.98 3.84 3.75 3.15 3.06 3.01 2.90 2.78 2.65 2.30 2.20 1.86 1.84 1.78 1.68 1.64 1.57 1.07 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 D:xy D:xy D:xz D:xy D:xz D:xz D:xz D:xy D:yz P:y P:y P:z P:z D:z2 P:z P:y D:xy D:z2 D:yz D:yz P:z P:y D:x2-y2 P:x P:x D:xy -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 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -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 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 1.33 0.80 6 9 5 8 10 7 4 3 8 39 13 36 38 7 29 23 7 10 6 5 47 41 5 14 17 5 W W W W W W W W W O O O O W O O W W W W O O W O O W -2.167 0.00 290 A 11.13 10.88 8.34 6.25 3.60 3.39 2.96 2.89 2.31 2.26 2.15 2.09 2.06 2.06 2.05 1.91 1.52 1.39 1.25 1.25 1.08 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:yz D:x2-y2 D:x2-y2 D:z2 D:z2 D:yz D:yz D:yz D:xy D:xy P:x P:x P:x D:xz D:xz P:x P:z P:y P:y P:z P:z -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.00 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 51 1 2 2 1 1 52 2 9 6 24 28 27 5 10 31 31 39 23 36 29 Tc W W W W W Tc W W W O O O W W O O O O O O -2.082 0.00 291 A 9.47 7.11 5.28 5.24 5.01 4.81 4.36 4.30 4.25 2.68 2.58 2.48 2.42 2.25 2.16 2.00 1.92 1.87 1.76 1.68 1.66 1.58 1.41 1.37 1.29 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 D:xy D:xz P:x P:x D:yz D:yz D:yz D:yz D:xy D:yz P:y P:y P:z P:z P:y D:xz P:z P:y D:z2 D:xy D:yz P:z D:xy D:xz D:xz D:yz -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 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 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 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 2 1 22 45 3 9 4 10 1 6 33 16 25 26 42 2 49 37 5 8 8 30 6 7 5 7 W W O O W W W W W W O O O O O W O O W W W O W W W W -2.068 0.00 292 A 7.84 5.35 4.91 4.91 4.90 4.12 3.66 3.46 3.00 2.75 2.68 2.60 2.51 2.50 2.50 2.36 2.17 1.98 1.93 1.90 1.86 1.64 1.62 1.57 1.52 1.50 1.46 1.35 1.33 1.04 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 D:z2 D:z2 D:yz D:yz D:yz D:yz D:yz P:z P:y D:x2-y2 P:z P:y P:z P:y P:z D:xy D:yz D:xz D:x2-y2 P:y P:y P:z P:z D:xy P:y D:xz D:z2 D:xy D:yz D:yz D:xz -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -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 -9.089 -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 1.33 1.33 0.80 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 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1 2 3 9 10 4 2 45 33 1 26 16 22 22 25 8 6 7 2 37 42 49 30 6 45 5 5 9 8 7 4 W W W W W W W O O W O O O O O W W W W O O O O W O W W W W W W -1.856 0.00 293 A 7.24 5.85 5.26 4.17 3.88 3.70 3.27 3.21 3.12 2.54 2.46 2.43 2.38 2.33 2.26 2.11 2.00 1.79 1.75 1.65 1.53 1.15 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 D:xz D:xy D:xy D:z2 D:xy D:xz D:x2-y2 D:z2 D:xz D:xy D:x2-y2 P:x D:xz P:x P:x D:z2 D:yz D:x2-y2 P:x D:x2-y2 D:z2 D:yz P:y P:z P:y -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 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0.80 1.00 0.80 0.80 0.80 1.00 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.33 0.80 1.00 1.33 1.33 1.33 0.80 1.33 0.80 1.33 0.80 0.80 0.80 3 52 4 10 9 8 7 51 6 8 7 52 40 10 11 6 38 9 13 43 5 51 41 46 29 5 47 8 23 9 7 7 W Tc W W W W W Tc W W W Tc O W O W O W O O W Tc O O O W O W O W W W -1.794 0.00 295 A 13.94 10.47 8.01 7.30 7.26 3.97 1.68 1.40 1.25 1.23 1.17 1.06 1.00 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xy D:xz D:xy P:x P:x D:xz D:xz D:xz D:xy D:yz D:x2-y2 D:yz D:xy -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 2 1 1 45 22 2 4 3 9 4 9 3 10 W W W O O W W W W W W W W -1.767 0.00 296 A 13.32 8.46 6.74 5.78 4.87 4.78 2.70 2.66 2.30 1.73 1.65 1.53 1.51 1.46 1.42 1.38 1.33 1.22 1.21 1.08 1.07 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 D:xz D:xy P:z D:z2 D:z2 P:y D:x2-y2 D:yz P:z P:z P:y D:yz D:xy D:x2-y2 D:z2 D:yz D:xz D:x2-y2 D:yz D:yz D:x2-y2 P:y D:xy -6.613 -6.613 -9.089 -4.498 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0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 1.33 0.80 0.80 0.80 3 51 9 4 51 10 6 7 5 8 42 6 19 49 8 7 5 19 25 3 37 33 16 26 4 30 5 8 5 W Tc W W Tc W W W W W O W O O W W W O O W O O O O W O W W W -1.719 0.00 298 A 17.19 12.19 9.34 6.16 2.98 2.90 2.56 2.22 1.97 1.69 1.68 1.64 1.46 1.43 1.36 1.29 1.19 1.15 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xy D:xz P:y P:z D:yz D:yz D:x2-y2 P:z D:z2 P:y D:x2-y2 D:yz D:xy D:yz D:x2-y2 D:yz D:xz D:z2 D:yz -6.613 -6.613 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 1.00 1.00 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 51 51 19 19 7 8 8 30 7 37 51 3 4 9 5 4 3 6 10 Tc Tc O O W W W O W O Tc W W W W W W W W -1.681 0.00 299 A 11.33 7.66 6.45 5.81 5.17 3.67 3.62 2.89 2.76 2.50 2.20 2.09 1.93 1.82 1.81 1.64 1.28 1.04 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:xz D:z2 D:xy P:z D:z2 P:y D:yz D:x2-y2 P:z D:x2-y2 D:z2 P:z P:y D:x2-y2 D:xz D:yz 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3.73 3.62 2.97 2.63 2.47 2.13 2.04 1.89 1.87 1.79 1.78 1.65 1.65 1.52 1.49 1.49 1.46 1.33 1.32 1.28 1.27 1.23 1.20 1.15 1.13 1.13 1.09 1.09 1.07 1.06 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:yz D:yz D:xz D:z2 D:xy D:x2-y2 D:xy D:xz D:yz P:z D:xz D:yz D:z2 P:y P:y D:xy D:xy D:x2-y2 P:z P:y P:x P:x P:x D:x2-y2 P:z P:z P:x P:y D:yz D:z2 P:x D:xy P:x -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -9.089 -4.498 -4.498 -4.498 -9.089 -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 -4.498 -4.498 -9.089 -4.498 -9.089 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 1.33 0.80 0.80 0.80 1.33 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 0.80 0.80 1.33 0.80 1.33 51 9 5 10 6 6 9 4 52 47 10 10 5 13 41 3 2 9 38 23 14 17 44 1 29 36 32 39 8 7 35 8 18 Tc W W W W W W W Tc O W W W O O W W W O O O O O W O O O O W W O W O -1.411 0.00 302 A 7.26 6.71 6.30 4.18 3.94 3.92 3.73 3.72 3.07 3.06 3.05 2.73 2.27 2.24 2.02 1.93 1.87 1.86 1.60 1.52 1.27 1.18 1.10 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 D:xy D:xz D:xy D:xz P:x D:z2 D:x2-y2 D:x2-y2 P:x D:x2-y2 P:x P:x P:x D:x2-y2 P:x D:z2 D:x2-y2 P:x D:z2 P:x P:x P:x D:z2 D:xy D:yz D:z2 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -6.613 -9.089 -9.089 -9.089 -4.498 -6.613 -4.498 -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 1.33 0.80 1.33 0.80 0.80 1.33 1.00 1.33 1.33 1.33 0.80 1.00 0.80 0.80 10 3 4 9 26 9 10 4 33 7 25 16 29 9 47 8 5 23 52 41 43 40 6 51 10 3 W W W W O W W W O W O O O W O W W O Tc O O O W Tc W W -1.397 0.00 303 A 7.92 7.15 5.91 5.69 4.90 3.21 2.67 2.59 2.10 1.95 1.86 1.84 1.70 1.67 1.66 1.41 1.28 1.25 1.23 1.20 1.16 1.15 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 D:xy D:xz D:xz D:xy D:z2 P:x P:x P:x P:x D:x2-y2 D:yz D:xy P:x D:x2-y2 D:z2 D:z2 D:x2-y2 P:x P:x D:x2-y2 P:x D:xy P:x 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2.26 2.26 2.23 2.13 2.10 2.08 1.93 1.88 1.75 1.71 1.43 1.43 1.31 1.29 1.24 1.21 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 D:x2-y2 D:xy D:xz D:z2 D:xz D:x2-y2 D:x2-y2 P:x P:x P:x D:x2-y2 D:z2 P:y P:x D:xy P:x P:x D:xy D:yz D:xz P:z D:yz D:yz P:y D:xy D:yz -4.498 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 0.80 1.00 1.00 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 5 51 51 6 6 6 7 36 42 49 8 8 19 39 2 38 13 5 10 1 19 5 7 49 1 9 W Tc Tc W W W W O O O W W O O W O O W W W O W W O W W -1.084 0.00 307 A 10.53 8.08 6.59 4.11 3.94 3.59 3.53 2.69 2.28 2.25 2.20 1.95 1.88 1.70 1.67 1.52 1.45 1.36 1.33 1.24 1.18 1.17 1.15 1.11 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 2 D:x2-y2 D:xz D:z2 D:xy D:xz D:z2 D:x2-y2 P:x P:z P:x P:x P:x D:x2-y2 P:x D:xy P:y P:y D:xy D:xy 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O W O O O O W W -0.922 0.00 310 A 5.33 4.39 3.73 3.72 3.47 3.28 3.24 3.08 3.04 2.74 2.45 2.38 1.91 1.73 1.72 1.72 1.40 1.36 1.35 1.33 1.31 1.13 1.11 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 D:yz D:yz D:xy D:yz D:yz D:yz D:yz D:xz D:z2 D:z2 D:xz D:xy P:y P:y P:z P:z D:z2 D:z2 D:yz D:yz P:x P:x D:z2 P:y 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 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -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 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80 3 10 9 4 9 6 8 10 5 7 4 3 16 33 26 25 2 1 7 5 44 12 4 42 8 W W W W W W W W W W W W O O O O W W W W O O W O W -0.864 0.00 311 A 8.46 7.26 5.28 3.58 3.29 3.22 2.74 2.59 2.52 2.49 2.31 1.94 1.94 1.75 1.73 1.64 1.53 1.14 1.10 1.09 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 2 D:xy D:xy D:xz D:xz P:x P:x D:yz D:x2-y2 P:z P:y D:z2 D:z2 P:y P:z D:z2 D:yz D:xz D:x2-y2 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O W W W W W W W O -0.782 0.00 313 A 6.63 6.31 5.90 5.46 4.88 2.96 2.58 2.17 2.13 2.00 1.93 1.93 1.87 1.86 1.84 1.69 1.58 1.53 1.51 1.43 1.39 1.34 1.28 1.15 1.11 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 D:yz D:yz D:yz D:yz D:yz D:yz D:yz P:y P:z P:y D:xy P:z D:yz D:z2 P:y P:z D:xz P:z P:z D:xz P:z D:xz D:xy P:y P:y P:y -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 1.33 0.80 0.80 1.33 1.33 0.80 1.33 1.33 0.80 1.33 0.80 0.80 1.33 1.33 1.33 3 9 10 6 4 5 8 33 26 16 9 25 7 5 42 12 4 49 18 10 44 5 6 35 44 37 W W W W W W W O O O W O W W O O W O O W O W W O O O -0.700 0.00 314 A 5.05 3.89 3.18 2.62 2.40 2.35 2.24 2.14 2.14 2.05 1.97 1.94 1.89 1.74 1.59 1.55 1.49 1.46 1.43 1.34 1.33 1.31 1.30 1.20 1.19 1.18 1.18 1.12 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 1 1 1 1 1 1 D:yz D:x2-y2 D:yz D:x2-y2 D:z2 D:x2-y2 D:xy D:x2-y2 D:xz D:z2 D:xz D:x2-y2 D:z2 P:z D:xy P:z D:xy P:x D:xz P:y D:yz P:y P:x D:yz D:xy D:x2-y2 P:x D:yz P:z D:z2 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -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 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 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 1.33 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33 0.80 6 10 5 9 9 3 8 52 3 1 5 4 4 40 10 18 4 50 7 42 7 43 26 3 6 5 33 8 49 2 W W W W W W W Tc W W W W W O W O W O W O W O O W W W O W O W -0.626 0.00 315 A 5.99 5.14 4.63 4.45 4.02 3.93 2.40 2.22 1.95 1.92 1.73 1.65 1.61 1.43 1.40 1.31 1.25 1.24 1.22 1.21 1.15 1.15 1.08 1.06 1.06 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 D:yz D:xy D:yz D:yz D:xz D:yz D:x2-y2 D:x2-y2 P:z D:xz D:xy D:z2 D:xz P:y P:y P:y D:xy D:yz D:yz D:xz P:z D:xy D:xy P:z P:x P:x -4.498 -4.498 -4.498 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0.80 1.33 1.00 1.33 0.80 1.00 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 7 8 5 7 8 6 11 46 13 38 6 8 51 7 37 52 30 10 51 30 50 5 9 42 49 36 5 W W W W W W O O O O W W Tc W O Tc O W Tc O O W W O O O W -0.381 0.00 317 A 9.44 8.06 7.59 4.85 4.58 4.31 4.19 3.25 3.16 3.12 2.64 2.15 2.05 2.02 1.99 1.89 1.79 1.72 1.65 1.50 1.45 1.39 1.30 1.23 1.19 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 2 1 D:x2-y2 D:z2 D:x2-y2 P:z D:x2-y2 D:z2 P:y P:x D:xz P:x D:x2-y2 D:xy P:x D:xy P:x P:x D:yz P:x P:x P:z P:x D:z2 D:xz D:xy D:x2-y2 P:z -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -6.613 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 4.055 -6.613 -4.498 4.055 -9.089 0.80 0.80 0.80 1.33 0.80 0.80 1.33 1.33 0.80 1.33 0.80 1.00 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.00 1.00 0.80 0.00 1.33 7 8 5 11 8 6 46 13 6 38 6 51 36 7 30 39 7 37 42 37 49 8 51 5 7 46 W W W O W W O O W O W Tc O W O O W O O O O W Tc W W O -0.349 0.00 318 A 5.33 4.51 3.89 3.07 2.90 2.73 2.62 2.46 2.27 2.20 2.16 2.12 1.86 1.49 1.44 1.30 1.28 1.19 1.19 1.19 1.19 1.18 1.11 1.09 1.07 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 D:z2 D:xz D:x2-y2 D:xy D:xy D:z2 D:yz D:x2-y2 D:xz D:x2-y2 D:yz D:yz D:x2-y2 D:z2 D:x2-y2 P:y D:z2 P:y P:z D:x2-y2 P:z P:x P:x P:z P:x D:z2 D:yz -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -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 -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 1.00 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 0.80 0.80 2 4 1 9 3 8 8 7 10 5 6 51 10 6 3 14 7 28 31 4 17 12 27 43 44 5 5 W W W W W W W W W W W Tc W W W O W O O W O O O O O W W -0.217 0.00 319 A 21.66 7.47 5.78 5.19 4.97 4.58 3.78 2.04 1.87 1.79 1.63 1.52 1.50 1.45 1.45 1.43 1.23 1.08 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 D:z2 D:x2-y2 D:xy P:y D:xz P:z D:z2 P:y D:z2 D:x2-y2 P:z D:xy P:z D:xz P:y P:x D:yz D:xy D:z2 -6.613 -6.613 -4.498 -9.089 -4.498 -9.089 -6.613 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -6.613 4.055 -4.498 1.00 1.00 0.80 1.33 0.80 1.33 1.00 1.33 0.80 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.00 0.00 0.80 52 52 10 29 9 23 51 36 9 4 39 5 40 6 43 23 52 10 3 Tc Tc W O W O Tc O W W O W O W O O Tc W W -0.176 0.00 320 A 13.30 8.74 6.70 3.95 2.91 2.61 2.27 2.26 1.92 1.70 1.70 1.68 1.62 1.56 1.47 1.44 1.38 1.28 -1.23 1.20 1.18 1.11 1.09 1.08 1 3 1 1 1 2 1 1 1 1 1 1 3 1 1 1 1 2 3 1 1 3 3 1 D:x2-y2 S P:x D:z2 D:xy S D:x2-y2 D:xz D:xz D:xz D:xy D:x2-y2 S D:z2 D:z2 D:x2-y2 P:y P:x S P:y P:z S S P:x -6.613 0.762 -9.089 -6.613 -4.498 -5.052 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 0.762 -4.498 -4.498 -4.498 -9.089 -1.119 3.091 -9.089 -9.089 1.231 1.231 -9.089 1.00 0.00 1.33 1.00 0.80 2.00 0.80 0.80 1.00 0.80 0.80 0.80 0.00 0.80 0.80 0.80 1.33 0.00 0.00 1.33 1.33 0.00 0.00 1.33 52 52 50 52 10 52 7 9 52 3 4 5 51 6 8 6 43 52 53 29 40 4 3 39 Tc Tc O Tc W Tc W W Tc W W W Tc W W W O Tc P O O W W O 0.048 0.00 321 A 15.53 8.65 5.06 4.92 4.91 4.84 4.84 4.64 4.63 4.40 4.39 3.82 3.80 3.02 -2.94 -2.87 2.51 1.87 1.87 1.86 1.63 1.58 -1.54 1.37 1.36 1.01 1.00 3 1 1 3 3 3 3 3 3 3 3 3 3 3 2 3 1 2 1 2 2 2 2 2 2 2 2 S D:x2-y2 P:x S S S S S S S S S S S S S D:z2 S D:xz S S P:x S S S S S 0.762 -6.613 -9.089 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 0.762 -5.052 3.091 -6.613 -5.688 -6.613 -5.688 -5.052 -1.119 -13.975 -5.688 -5.688 -5.688 -5.688 0.00 1.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 1.00 2.00 1.00 2.00 2.00 0.00 2.00 2.00 2.00 2.00 2.00 51 52 50 7 8 1 2 9 10 5 6 3 4 52 52 53 52 10 52 9 51 52 53 5 6 2 1 Tc Tc O W W W W W W W W W W Tc Tc P Tc W Tc W Tc Tc P W W W W 0.182 0.00 322 A 26.89 9.33 5.27 4.89 4.20 4.00 3.91 3.70 1.67 1.44 1.30 1.30 1.14 1.09 1 1 1 1 1 1 1 1 1 1 1 1 2 1 D:z2 D:x2-y2 D:xz D:xy P:z D:xz P:y D:xy D:yz P:z P:y P:y D:xz P:z -6.613 -6.613 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -6.613 -9.089 -9.089 -9.089 4.055 -9.089 1.00 1.00 0.80 0.80 1.33 0.80 1.33 0.80 1.00 1.33 1.33 1.33 0.00 1.33 51 51 3 4 41 8 47 7 51 40 43 38 3 13 Tc Tc W W O W O W Tc O O O W O 0.308 0.00 323 A 23.38 8.68 8.34 5.61 -5.55 3.98 3.68 3.35 -2.25 2.10 2.00 1.81 1.79 1.79 1.78 1.73 1.62 1.52 -1.48 1.45 1.45 1.43 1.34 1.15 1.12 1.07 1.06 1.04 3 1 2 3 3 1 1 2 2 1 2 3 1 3 2 1 1 1 2 3 1 3 1 1 3 1 1 1 S D:x2-y2 S S P:x D:z2 P:x S P:x D:z2 S S D:xy S P:x D:xz D:xy D:yz P:x S D:xz S D:yz D:z2 S P:y D:yz P:z 0.762 -6.613 -5.052 0.762 2.188 -6.613 -9.089 -5.052 -5.506 -4.498 -13.975 1.231 -4.498 1.231 -1.119 -4.498 -4.498 -4.498 -1.119 1.231 -4.498 1.231 -4.498 -4.498 3.091 -9.089 -4.498 -9.089 0.00 1.00 2.00 0.00 0.00 1.00 1.33 2.00 1.00 0.80 2.00 0.00 0.80 0.00 0.00 0.80 0.80 0.80 0.00 0.00 0.80 0.00 0.80 0.80 0.00 1.33 0.80 1.33 52 51 52 51 53 51 19 51 53 3 53 6 4 5 51 8 7 4 52 10 3 9 2 6 53 25 1 16 Tc Tc Tc Tc P Tc O Tc P W P W W W Tc W W W Tc W W W W W P O W O 0.395 0.00 324 A 9.11 5.40 4.92 4.56 3.69 3.41 3.37 2.50 2.43 2.28 -2.27 2.26 2.12 1.70 1.68 1.47 1.46 1.43 1.39 1.35 1.35 1.35 1.28 1.25 1.24 1.21 1.19 1.18 1.06 1.05 1.04 3 1 1 3 2 3 3 1 2 3 3 3 1 1 1 1 1 1 1 1 1 2 1 2 2 2 1 2 1 1 1 S D:yz D:yz S S S S D:yz S S P:x S D:x2-y2 P:y D:z2 P:z D:x2-y2 D:x2-y2 D:yz P:y P:z S P:x S S S D:z2 S D:x2-y2 D:xz D:yz 0.762 -4.498 -4.498 0.762 -5.052 1.231 1.231 -4.498 -5.052 1.231 2.188 1.231 -4.498 -9.089 -4.498 -9.089 -6.613 -4.498 -4.498 -9.089 -9.089 -13.975 -9.089 -5.688 -5.688 -5.688 -4.498 -5.688 -4.498 -4.498 -4.498 0.00 0.80 0.80 0.00 2.00 0.00 0.00 0.80 2.00 0.00 0.00 0.00 0.80 1.33 0.80 1.33 1.00 0.80 0.80 1.33 1.33 2.00 1.33 2.00 2.00 2.00 0.80 2.00 0.80 0.80 0.80 51 2 1 52 52 3 4 10 51 6 53 5 8 45 7 22 51 9 9 35 32 53 48 6 5 3 5 4 6 6 5 Tc W W Tc Tc W W W Tc W P W W O W O Tc W W O O P O W W W W W W W W 0.456 0.00 325 A 11.39 10.35 5.38 5.24 -4.84 4.76 4.36 2.24 2.09 2.04 1.74 1.71 1.71 1.70 1.69 1.66 1.64 1.55 1.51 1.39 -1.11 1.05 3 3 2 2 3 1 1 1 1 1 3 3 3 1 3 1 1 2 2 1 2 1 S S S S P:x D:xz D:xy D:z2 D:z2 D:yz S S S D:x2-y2 S D:yz D:z2 S S D:z2 P:x D:z2 0.762 0.762 -5.052 -5.052 2.188 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 1.231 1.231 -4.498 1.231 -4.498 -4.498 -5.688 -5.688 -4.498 -1.119 -4.498 0.00 0.00 2.00 2.00 0.00 0.80 0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.80 0.00 0.80 0.80 2.00 2.00 0.80 0.00 0.80 51 52 52 51 53 1 2 3 9 10 9 8 7 8 10 4 7 9 10 5 52 4 Tc Tc Tc Tc P W W W W W W W W W W W W W W W Tc W 0.504 0.00 326 A 9.95 9.87 9.81 9.77 7.95 7.92 7.13 7.08 -6.60 5.78 5.68 5.65 5.58 4.93 4.91 -4.49 4.39 4.39 1.35 1.29 -1.15 -1.07 1.07 3 3 3 3 3 3 3 3 3 2 2 2 2 2 2 3 2 2 1 3 2 2 1 S S S S S S S S P:z S S S S S S P:y S S D:z2 S P:z P:z D:yz 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 2.188 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 2.188 -5.688 -5.688 -4.498 0.762 -1.119 -5.506 -4.498 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 2.00 2.00 0.80 0.00 0.00 1.00 0.80 7 10 8 9 5 6 4 3 53 7 8 10 9 4 3 53 6 5 9 51 52 53 10 W W W W W W W W P W W W W W W P W W W Tc Tc P W 0.515 0.00 327 A 19.59 19.36 10.74 10.72 -7.43 6.13 6.13 5.59 5.58 -4.86 4.58 4.42 4.37 4.26 3.95 3.86 3.43 3.35 2.49 2.45 2.41 2.41 -1.90 -1.24 3 3 2 2 3 3 3 3 3 3 3 3 3 3 2 2 2 2 2 2 2 2 2 2 S S S S P:y S S S S P:z S S S S S S S S S S S S P:y P:z 1.231 1.231 -5.688 -5.688 2.188 1.231 1.231 1.231 1.231 2.188 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.506 -5.506 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00 2 1 1 2 53 10 9 3 4 53 6 5 8 7 9 10 3 4 6 5 7 8 53 53 W W W W P W W W W P W W W W W W W W W W W W P P 0.594 0.00 328 A 16.52 8.75 6.56 3.22 2.46 2.36 2.32 2.14 1.86 1.84 1.81 1.53 1.38 1.35 1.27 1.14 1.07 1.03 1.01 1.00 1 1 1 3 2 3 3 1 1 3 1 1 1 1 1 1 1 2 1 1 D:x2-y2 P:x D:z2 S P:x S S D:x2-y2 D:yz S D:x2-y2 D:z2 D:xz P:x D:z2 D:xz D:xz S D:xy D:z2 -6.613 -9.089 -6.613 0.762 -1.119 1.231 1.231 -6.613 -4.498 0.762 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -5.688 -6.613 -4.498 1.00 1.33 1.00 0.00 0.00 0.00 0.00 1.00 0.80 0.00 0.80 0.80 0.80 1.33 0.80 0.80 0.80 2.00 1.00 0.80 51 19 51 51 51 4 3 52 4 52 3 5 1 50 4 2 8 5 51 6 Tc O Tc Tc Tc W W Tc W Tc W W W O W W W W Tc W 0.826 0.00 329 A 18.69 14.54 13.52 13.26 6.33 6.32 5.87 5.84 -2.66 -2.21 1.60 1.59 1.40 1.39 3 3 2 2 2 2 3 3 2 2 3 3 2 2 S S S S S S S S P:x P:x S S S S 0.762 0.762 -5.052 -5.052 -5.688 -5.688 1.231 1.231 -1.119 -1.119 1.231 1.231 -5.688 -5.688 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 51 52 51 52 1 2 1 2 51 52 5 6 6 5 Tc Tc Tc Tc W W W W Tc Tc W W W W 0.903 0.00 330 A 10.24 10.01 9.62 9.53 8.93 8.54 8.33 8.31 2.40 1.60 1.42 1.39 1.34 1.06 2 2 2 2 3 3 3 3 1 1 2 1 1 1 S S S S S S S S D:z2 D:xz P:y D:xy D:z2 D:x2-y2 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -4.498 -4.498 -5.506 -4.498 -4.498 -4.498 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.80 0.80 1.00 0.80 0.80 0.80 7 3 6 10 7 3 6 10 6 6 53 7 3 10 W W W W W W W W W W P W W W 0.906 0.00 331 A 11.90 10.93 10.75 10.57 9.96 9.91 9.34 8.70 2.38 2.06 1.97 1.95 -1.93 -1.92 1.92 1.81 1.80 1.79 1.46 -1.33 1.33 -1.20 2 2 2 2 3 3 3 3 2 3 2 2 2 2 2 3 1 3 1 2 3 2 S S S S S S S S S S S S P:z P:z S S D:xz S D:xy P:y S P:y -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 1.231 -5.688 -5.688 -1.119 -1.119 -5.688 1.231 -4.498 1.231 -4.498 -1.119 1.231 -1.119 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 0.00 2.00 2.00 0.00 0.00 2.00 0.00 0.80 0.00 0.80 0.00 0.00 0.00 8 4 5 9 4 8 9 5 7 3 6 3 51 52 10 7 8 10 5 51 6 52 W W W W W W W W W W W W Tc Tc W W W W W Tc W Tc 1.111 0.00 332 A 9.74 9.72 7.88 7.87 2.86 2.73 2.15 2.10 2.07 1.73 1.65 1.63 1.62 1.59 1.52 1.38 1.37 1.36 1.33 1.31 1.10 1.09 1.08 1.05 1.04 3 3 2 2 1 1 1 2 2 1 2 1 2 1 1 1 3 1 3 1 3 1 1 3 2 S S S S D:z2 D:z2 D:x2-y2 S S D:yz S D:yz S D:z2 D:xy D:xz S D:z2 S D:x2-y2 S D:xz D:z2 S S 1.231 1.231 -5.688 -5.688 -4.498 -4.498 -4.498 -5.688 -5.688 -4.498 -5.688 -4.498 -5.688 -4.498 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4.62 4.30 4.16 2.75 2.34 1.85 1.81 1.78 1.72 1.67 1.55 1.49 1.43 1.41 1.39 1.34 1.31 1.29 1.28 1.25 1.14 1.10 1.10 1.06 1.05 1.01 1.00 2 1 2 1 3 3 2 1 3 1 2 1 1 1 3 1 2 3 1 2 2 1 3 1 2 1 1 1 3 1 S D:z2 S D:z2 S S S D:yz S P:z S D:x2-y2 D:z2 P:y S D:z2 S S D:xy P:z S D:z2 S D:x2-y2 P:y D:xz D:x2-y2 P:z S D:xy -5.688 -4.498 -5.688 -4.498 1.231 1.231 -5.688 -4.498 1.231 -9.089 -5.688 -4.498 -4.498 -9.089 1.231 -4.498 -5.688 1.231 -4.498 -0.500 -5.688 -4.498 1.231 -4.498 -0.500 -4.498 -4.498 -9.089 0.762 -4.498 2.00 0.80 2.00 0.80 0.00 0.00 2.00 0.80 0.00 1.33 2.00 0.80 0.80 1.33 0.00 0.80 2.00 0.00 0.80 0.00 2.00 0.80 0.00 0.80 0.00 0.80 0.80 1.33 0.00 0.80 2 3 1 4 2 1 6 4 6 16 5 3 9 25 7 5 10 10 5 3 7 10 5 4 4 6 10 27 51 4 W W W W W W W W W O W W W O W W W W W W W W W W W W W O Tc W 1.195 0.00 336 A 8.67 8.36 7.72 7.67 6.35 6.25 5.68 5.63 5.57 5.48 5.21 5.16 5.07 4.99 4.75 4.73 2.21 2.10 -1.36 -1.36 -1.20 -1.17 2 2 2 2 3 3 3 3 3 3 2 3 3 2 2 2 1 1 2 2 2 2 S S S S S S S S S S S S S S S S 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W W W W W O W W W W W O O O W W W 1.427 0.00 338 A 10.07 7.68 7.44 7.38 6.83 6.75 6.62 6.55 5.94 5.90 5.04 -4.47 3.90 3.88 -3.53 3.34 3.30 3.26 3.26 2.94 2.93 1.87 1.11 2 2 2 2 2 2 2 2 2 2 3 2 3 3 2 3 3 3 3 3 3 3 1 S S S S S S S S S S S P:x S S P:x S S S S S S S D:z2 -5.052 -5.052 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 0.762 -1.119 1.231 1.231 -1.119 1.231 1.231 1.231 1.231 1.231 1.231 0.762 -4.498 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 51 52 3 4 10 9 7 8 6 5 51 51 7 8 52 6 5 3 4 10 9 52 3 Tc Tc W W W W W W W W Tc Tc W W Tc W W W W W W Tc W 1.556 0.00 339 A 9.28 9.28 9.27 9.25 7.94 7.89 7.67 7.64 4.84 4.79 4.75 4.75 3.27 3.22 3.11 3.08 1.37 1.16 1.07 1.04 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 1 1 1 1 S S S S S S S S S S S S S S S S D:xz D:xy D:xz D:xy -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -4.498 -4.498 -4.498 -4.498 2.00 2.00 2.00 2.00 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0.00 1.33 1.33 0.00 0.00 2.00 0.00 9 53 9 10 10 3 26 33 53 51 4 10 9 16 2 25 10 23 3 1 7 29 8 4 52 4 3 47 41 10 9 9 5 W P W W W W O O P Tc W W W O W O W O W W W O W W Tc W W O O W W W W 1.952 0.00 344 A 9.24 4.33 3.71 3.25 2.95 2.73 2.51 2.28 2.23 1.77 1.69 1.68 1.68 1.65 1.64 1.61 1.50 1.43 1.40 1.35 1.22 1.21 1.21 1.16 1.09 1.04 1.03 1.02 1.02 1.00 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 3 1 1 1 1 1 2 1 1 2 1 1 3 1 1 D:z2 D:z2 D:x2-y2 D:z2 P:z P:y D:z2 D:xz D:x2-y2 D:xy D:xy S D:z2 D:xz D:yz S P:y P:y D:xy D:yz P:z P:z D:xz P:z P:y D:xz D:xy S D:xz P:y -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 -4.498 -4.498 -4.498 1.231 -9.089 -9.089 -4.498 -4.498 -9.089 -0.500 -4.498 -9.089 -0.500 -4.498 -4.498 1.231 -4.498 -9.089 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.00 0.80 0.80 0.80 0.00 1.33 1.33 0.80 0.80 1.33 0.00 0.80 1.33 0.00 0.80 0.80 0.00 0.80 1.33 3 9 4 4 16 25 10 8 10 4 7 5 6 6 4 6 12 26 5 5 33 3 1 42 4 9 2 4 5 44 W W W W O O W W W W W W 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P:y D:xy P:z -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 0.80 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.00 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 7 30 5 37 38 13 8 6 42 49 3 11 36 4 46 46 51 16 39 7 12 25 41 44 12 47 11 51 39 W O W O O O W W O O W O O W O O Tc O O W O O O O O O O Tc O -9.456 1.00 191 A 3.87 3.76 3.68 3.33 3.23 2.90 2.26 2.20 2.19 2.12 2.10 2.10 2.05 1.81 1.69 1.54 1.53 1.51 1.47 1.46 1.46 1.42 1.36 1.36 1.35 1.35 1.34 1.31 1.27 1.17 1.15 1.11 1.09 1.09 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 P:z D:yz P:y P:x D:yz P:x P:z P:x D:yz P:y P:y D:xy P:z P:y D:xz D:yz D:xy P:y P:y P:y P:z P:z P:z D:xy D:z2 P:x P:z P:z P:y D:xz P:z P:x P:z P:y P:y -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 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-9.089 -9.089 -9.089 0.80 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 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 3 16 25 40 37 43 47 10 30 4 26 18 41 6 45 33 22 4 9 15 48 31 2 42 21 8 18 8 23 48 49 28 7 39 36 29 W O O O O O O W O W O O O W O O O W W O O O W O O W O W O O O O W O O O -9.245 1.00 197 A 4.38 3.18 2.61 2.55 2.40 2.24 2.15 2.14 2.03 2.00 1.92 1.89 1.87 1.79 1.78 1.75 1.68 1.63 1.49 1.44 1.41 1.39 1.38 1.26 1.21 1.20 1.19 1.19 1.17 1.17 1.13 1.13 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:xy D:xz P:z P:x P:y D:xy D:xz P:y P:y P:x P:z P:x P:z P:z P:y P:z P:x P:x P:z P:x P:x P:y P:x D:xy P:x P:z P:x D:x2-y2 D:z2 P:z P:z P:y P:z P:y -4.498 -4.498 -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 -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 -9.089 -9.089 -9.089 0.80 0.80 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 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 1.33 1.33 1.33 10 9 33 23 26 4 3 25 13 29 38 12 16 15 39 21 47 44 48 45 22 21 41 2 26 29 21 5 6 24 36 27 18 15 W W O O O W W O O O O O O O O O O O O O O O O W O O O W W O O O O O -9.169 1.00 198 A 6.20 5.80 3.74 3.04 2.97 2.93 2.82 2.55 2.31 2.21 2.07 1.98 1.94 1.92 1.90 1.73 1.59 1.36 1.35 1.26 1.20 1.19 1.11 1.09 1.06 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 P:x D:x2-y2 P:y D:z2 P:y P:z P:x P:y P:x D:yz P:z D:yz P:z P:x P:x P:z P:z P:y P:y D:x2-y2 P:x P:z P:z P:y P:z -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -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 -9.089 -9.089 1.33 1.33 0.80 1.33 0.80 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 0.80 1.33 1.33 1.33 1.33 1.33 37 30 7 45 8 12 22 13 18 38 2 12 1 46 49 42 18 11 11 38 5 24 33 13 26 39 O O W O W O O O O O W O W O O O O O O O W O O O O O -9.113 1.00 199 A 5.47 4.33 4.02 3.89 3.86 3.39 3.01 2.92 2.64 2.63 2.42 2.40 2.22 1.98 1.88 1.73 1.66 1.58 1.53 1.35 1.14 1.06 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 D:xz P:x D:xy P:z D:z2 P:x P:y P:x P:y D:x2-y2 P:x P:x P:x P:x P:x P:x P:z P:z P:y P:z -9.089 -9.089 -4.498 -9.089 -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 1.33 1.33 0.80 1.33 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 44 49 1 42 2 44 6 22 48 45 12 5 36 28 34 39 31 20 48 12 28 27 O O W O W O W O O O O W O O O O O O O O O O -9.106 1.00 200 A 7.88 7.23 6.84 6.24 3.10 2.65 2.54 2.13 2.08 1.99 1.97 1.89 1.85 1.85 1.68 1.31 1.28 1.24 1.24 1.18 1.09 1.09 1.08 1.07 1.06 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:y P:y P:z P:z P:y P:y P:x P:z P:y P:x P:z P:x P:x P:y D:x2-y2 P:z P:x D:z2 P:x D:x2-y2 P:x D:x2-y2 D:xz 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 -4.498 -9.089 -9.089 -4.498 -9.089 -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 0.80 1.33 1.33 0.80 1.33 0.80 1.33 0.80 0.80 1.33 1.33 14 17 31 28 27 24 32 12 35 41 32 47 35 44 23 3 29 24 10 18 8 17 6 4 27 39 O O O O O O O O O O O O O O O W O O W O W O W W O O -9.001 1.00 201 A 6.94 5.69 5.30 5.20 5.14 4.10 3.69 3.43 3.03 2.59 2.43 2.26 2.25 2.24 1.72 1.70 1.64 1.62 1.21 1.17 1.10 1.07 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 P:y P:y P:x P:y P:x P:y P:x P:z P:z P:x P:x P:z P:y P:z P:z P:y P:z P:x P:y P:y P:z D:z2 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 -9.089 -9.089 -9.089 -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 1.33 1.33 0.80 0.80 31 17 17 32 31 24 28 35 27 24 32 14 20 28 12 14 18 14 28 22 48 4 10 O O O O O O O O O O O O O O O O O O O O O W W -9.000 1.00 202 A 5.21 5.17 3.85 3.72 3.39 3.33 3.24 3.23 2.75 2.57 2.51 2.45 2.20 2.08 1.76 1.54 1.53 1.51 1.38 1.37 1.33 1.32 1.23 1.22 1.22 1.11 1.09 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 P:z P:y P:z P:x P:z P:y P:x P:x P:y P:z P:z P:x P:z P:z D:z2 P:z P:z P:z P:x P:y P:z P:y D:z2 P:z P:x P:z 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 -4.498 -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 1.33 1.33 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 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 14 12 34 35 28 44 28 27 18 27 17 14 12 31 8 46 33 35 37 48 44 20 6 45 24 29 47 16 11 O O O O O O O O O O O O O O W O O O O O O O W O O O O O O -8.965 1.00 203 A 5.16 4.75 4.11 3.42 3.19 3.12 3.03 2.81 2.58 2.34 2.26 2.16 1.97 1.97 1.95 1.83 1.49 1.25 1.24 1.23 1.21 1.19 1.18 1.16 1.14 1.10 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 P:y P:y P:y P:z P:x P:z P:y P:x P:z P:x P:x P:x P:z D:xy D:xz P:x P:x P:x P:y P:x P:y P:x D:x2-y2 D:z2 P:x P:y 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 -4.498 -4.498 -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 1.33 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 1.33 1.33 1.33 48 44 18 48 49 44 12 42 18 20 34 37 12 1 2 30 32 22 33 45 16 36 5 6 35 25 26 35 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 O O O -8.934 1.00 204 A 4.27 3.79 2.89 2.74 2.58 2.47 2.38 2.38 2.34 2.23 2.19 2.15 2.11 1.98 1.94 1.83 1.82 1.58 1.53 1.37 1.33 1.32 1.32 1.29 1.17 1.11 1.11 1.08 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 P:y P:z P:x P:x P:y P:y P:z P:z D:yz P:y D:yz P:z P:y P:x P:x P:x P:y D:yz D:z2 P:y P:z P:z D:z2 P:z P:x D:yz P:x P:z P:x P:y -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 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -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 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 45 22 25 21 16 33 15 34 10 20 4 26 26 15 16 33 25 3 3 21 16 21 9 25 44 9 26 33 39 15 O O O O O O O O W O W O O O O O O W W O O O W O O W O O O O -8.888 1.00 205 A 3.63 3.56 3.23 3.20 2.55 2.38 2.36 2.12 2.09 2.04 2.03 1.90 1.88 1.85 1.82 1.72 1.71 1.71 1.68 1.67 1.65 1.64 1.56 1.40 1.39 1.36 1.30 1.29 1.22 1.19 1.19 1.11 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 1 1 1 1 1 1 1 1 1 P:z P:y P:x P:x P:x P:x P:y D:xy P:x D:xy D:xz P:z P:x P:y P:x P:y P:z P:y P:z P:x P:z D:xz P:y P:z P:z D:xy D:x2-y2 D:xz D:xy D:xy P:x D:xz P:y P:x P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -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 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 1.33 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 1.33 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33 35 24 18 48 12 44 39 3 17 6 10 38 28 32 26 13 49 37 30 33 27 4 42 29 36 8 10 7 9 7 23 5 38 47 41 O O O O O O O W O W W O O O O O O O O O O W O O O W W W W W O W O O O -8.881 1.00 206 A 5.72 5.49 3.05 2.83 2.38 2.31 2.21 2.04 1.83 1.81 1.78 1.62 1.57 1.48 1.45 1.38 1.34 1.33 1.33 1.25 1.18 1.17 1.17 1.15 1.13 1.12 1.11 1.08 1.06 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:y P:z P:z P:x P:x P:y P:z P:y P:x P:y P:y D:xz P:x P:y D:xy P:z P:z P:x P:z D:yz P:z P:z P:z P:z P:y P:y P:y P:z D:z2 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10 16 26 3 9 26 47 23 4 41 33 29 16 25 29 9 15 21 O O W O O W W O O O W O O O O O O W O O -8.802 1.00 208 A 4.04 3.88 2.75 2.58 2.49 2.36 2.32 2.28 2.24 1.94 1.91 1.85 1.84 1.77 1.77 1.69 1.60 1.52 1.51 1.51 1.50 1.49 1.43 1.41 1.36 1.34 1.32 1.24 1.23 1.20 1.19 1.17 1.14 1.14 1.10 1.07 1.06 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:x P:x P:x P:x P:y P:x P:x P:z P:z P:x D:x2-y2 P:x P:z P:y D:yz P:z D:x2-y2 D:yz P:y D:xz P:x P:x D:yz P:z D:z2 P:x D:x2-y2 P:x P:x D:yz P:x P:x D:xy P:y P:x P:x P:x D:x2-y2 D:z2 -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 -4.498 -4.498 -9.089 -6.613 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -6.613 -4.498 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 0.80 0.80 1.33 1.00 1.33 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.00 0.80 38 13 49 22 42 45 42 49 30 26 5 33 23 29 6 39 6 5 37 51 47 41 7 18 5 44 10 36 11 8 46 34 2 36 21 20 39 51 6 O O O O O O O O O O W O O O W O W W O Tc O O W O W O W O O W O O W O O O O Tc W -8.756 1.00 209 A 5.12 4.50 4.40 3.84 3.59 3.41 3.40 3.32 2.95 2.82 2.81 2.47 2.15 1.72 1.60 1.39 1.32 1.20 1.16 1.15 1.13 1.13 1.09 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 P:y P:z P:y P:x P:x P:z P:z P:x P:x P:z P:x P:y P:y P:x P:z P:z P:y D:x2-y2 P:z P:y P:y 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 -4.498 -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 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 22 41 47 29 39 45 23 23 36 13 41 29 38 47 11 30 45 8 39 46 36 16 37 21 15 O O O O O O O O O O O O O O O O O W O O O O O O O -8.731 1.00 210 A 5.36 4.35 3.07 2.88 2.73 2.68 2.64 2.43 2.42 2.24 2.19 2.18 2.06 1.98 1.96 1.95 1.88 1.87 1.75 1.66 1.57 1.29 1.14 1.09 1.06 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 P:y P:z P:x P:y P:x P:x P:y P:z P:z P:y P:x P:x P:x P:x P:y P:z P:z P:x P:x P:z P:x D:x2-y2 D:xy P:z 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 -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 0.80 1.33 1.33 1.33 1.33 47 41 29 45 13 38 36 39 23 22 23 36 41 39 29 38 45 16 47 22 25 4 7 25 27 24 13 O 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 -8.687 1.00 211 A 3.45 3.07 2.97 2.97 2.85 2.74 2.66 2.45 2.03 2.03 2.02 1.97 1.94 1.90 1.85 1.85 1.79 1.77 1.64 1.60 1.59 1.59 1.46 1.38 1.29 1.28 1.23 1.20 1.20 1.17 1.16 1.14 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 P:x P:y D:yz P:x P:y P:z D:z2 P:x P:z P:y P:x P:y P:z P:z P:z P:z D:yz D:x2-y2 P:z P:y D:yz P:z P:x P:z P:y P:z P:y P:y P:x P:y P:y D:yz P:y P:z -9.089 -9.089 -4.498 -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 -4.498 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 1.33 1.33 0.80 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 0.80 0.80 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 24 30 1 27 45 37 2 35 14 22 32 49 42 22 31 17 2 1 28 39 51 29 44 36 17 45 28 13 12 23 14 52 31 32 O O W O O O W O O O O O O O O O W W O O Tc O O O O O O O O O O Tc O O -8.662 1.00 212 A 5.19 4.72 4.19 3.86 3.54 3.15 2.86 2.69 2.64 2.51 2.50 2.30 2.27 2.20 2.04 2.02 1.94 1.86 1.83 1.82 1.78 1.60 1.35 1.35 1.32 1.30 1.29 1.27 1.22 1.22 1.21 1.16 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 P:z P:y P:y P:z P:y P:z P:x P:x P:z P:y D:x2-y2 P:z D:xz P:x P:y P:y D:z2 P:x P:x P:z D:x2-y2 P:x P:x P:x P:y D:yz D:xy D:z2 P:x D:z2 P:z D:xy D:z2 -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 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -6.613 -9.089 -4.498 -9.089 -4.498 -6.613 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 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.00 1.33 0.80 1.33 0.80 1.00 37 30 49 42 38 13 43 40 39 36 5 23 6 42 29 33 8 36 49 26 7 46 11 39 35 9 5 51 30 6 32 7 52 O O O O O O O O O O W O W O O O W O O O W O O O O W W Tc O W O W Tc -8.647 1.00 213 A 5.64 3.92 3.59 2.82 2.37 2.19 2.00 1.92 1.91 1.91 1.89 1.80 1.76 1.69 1.68 1.64 1.62 1.61 1.60 1.56 1.54 1.52 1.41 1.38 1.36 1.32 1.29 1.29 1.28 1.27 1.26 1.26 1.22 1.21 1.13 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 P:y P:z D:x2-y2 P:y P:x P:x D:z2 P:x P:y D:x2-y2 P:y P:x P:z P:x P:z P:x P:z P:x P:x P:z P:x P:x P:z P:y P:y P:x P:y P:x P:x P:x P:y P:x P:z P:x P:x P:x -9.089 -9.089 -4.498 -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 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -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 0.80 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 22 45 2 45 29 18 1 41 26 1 47 23 16 24 22 49 36 33 27 33 42 31 37 30 39 32 25 47 35 37 17 28 41 26 30 44 O O W O O 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 -8.599 1.00 214 A 5.18 4.70 4.59 4.03 3.37 3.16 2.35 2.24 2.21 1.90 1.75 1.70 1.65 1.58 1.54 1.52 1.51 1.43 1.37 1.30 1.21 1.18 1.17 1.16 1.15 1.09 1.07 1.06 1.05 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:y P:y P:z D:z2 P:x P:x P:x P:x P:x P:z D:x2-y2 P:x P:x D:z2 P:y P:z P:y P:y P:x P:x D:xy D:yz P:x P:y P:x P:z P:x -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 -6.613 -9.089 -9.089 -4.498 -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 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 1.00 1.33 1.33 0.80 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 45 30 37 22 29 23 1 40 43 48 33 26 13 51 15 49 2 42 22 38 25 19 42 8 6 46 16 11 16 21 O O O O O O W O O O O O O Tc O O W O O O O O O W W O O O O O -8.594 1.00 215 A 6.80 6.32 3.43 2.98 2.14 2.11 2.02 2.01 1.97 1.95 1.94 1.82 1.54 1.54 1.49 1.48 1.47 1.35 1.34 1.31 1.24 1.18 1.14 1.12 1.09 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 P:y P:z P:z P:y P:x P:z P:x P:x P:x P:z P:y D:xz P:z P:x D:z2 P:y D:z2 P:y P:x D:x2-y2 P:y P:x P:x P:z D:x2-y2 D:yz -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 -4.498 -9.089 -9.089 -6.613 -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 0.80 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.00 1.33 1.33 1.33 1.33 0.80 0.80 49 42 22 45 40 45 16 43 25 41 47 5 39 18 2 22 1 36 37 52 29 21 15 30 1 2 O O O O O O O O O O O W O O W O W O O Tc O O O O W W -8.571 1.00 216 A 6.12 5.01 4.05 3.67 3.58 3.12 3.11 2.93 2.17 2.05 1.87 1.84 1.79 1.73 1.57 1.57 1.43 1.43 1.41 1.39 1.24 1.14 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 P:z P:y P:y P:y P:z D:yz P:y P:z P:z D:yz P:z P:y P:y P:y P:z P:z D:yz D:z2 P:z P:y P:y P:z P:y -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 -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 0.80 1.33 1.33 1.33 0.80 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 25 16 45 42 49 3 22 22 45 4 26 27 37 33 30 16 6 5 24 17 14 23 47 O O O O O W O O O W O O O O O O W W O O O O O -8.564 1.00 217 A 7.38 7.30 6.66 5.61 5.60 5.57 3.95 3.66 3.46 3.42 3.23 2.62 2.06 2.06 1.40 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x P:y P:z P:y P:z P:y P:y D:xy P:z P:z D:xz P:x P:x D:xy -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 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 22 45 26 16 25 33 30 49 2 37 42 1 34 20 1 O O O O O O O O W O O W O O W -8.555 1.00 218 A 6.55 6.29 5.94 5.37 4.22 4.14 3.43 3.05 2.55 2.11 1.94 1.84 1.78 1.75 1.36 1.22 1.20 1.18 1.10 1.08 1.08 1.06 1.05 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:z P:y P:z P:y P:z P:z P:y P:y D:yz D:yz P:z D:yz P:y P:z P:z P:z D:yz D:xy D:yz P:z P:y P:y P:y D:z2 P:y -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 -4.498 -4.498 -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 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33 30 37 26 33 25 49 42 16 9 10 33 3 35 16 32 37 8 8 4 42 28 31 26 7 27 O O O O O O O O W W O W O O O O W W W O O O O W O -8.464 1.00 219 A 8.61 8.49 3.85 3.72 3.72 3.07 2.23 2.20 2.07 1.94 1.77 1.65 1.64 1.52 1.50 1.39 1.33 1.30 1.30 1.25 1.21 1.20 1.20 1.18 1.17 1.10 1.05 1.05 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 P:x P:x P:x P:z P:x P:y D:x2-y2 D:z2 P:x P:x D:z2 D:x2-y2 P:z P:z P:x P:x P:x D:z2 P:x D:z2 P:z P:y D:x2-y2 P:x P:x P:y P:y P:y P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -6.613 -9.089 -9.089 -6.613 -4.498 -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 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.00 1.33 1.33 1.00 0.80 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 1.33 1.33 1.33 1.33 11 46 40 42 43 49 6 51 38 39 52 8 23 37 13 36 16 5 25 7 49 13 7 20 34 29 30 36 39 O O O O O O W Tc O O Tc W O O O O O W O W O O W O O O O O O -8.407 1.00 220 A 8.57 8.40 6.53 6.12 5.58 4.80 3.68 3.64 2.40 2.34 1.85 1.85 1.60 1.44 1.41 1.35 1.30 1.07 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:y P:y P:z P:x P:x P:x P:x P:x P:z P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 30 42 37 16 26 49 25 33 30 37 42 49 33 20 34 49 26 30 O O O O O O O O O O O O O O O O O O -8.394 1.00 221 A 6.58 5.93 5.40 5.37 5.22 4.81 4.65 3.81 3.73 3.49 2.87 1.93 1.59 1.42 1.25 1.17 1.16 1.13 1.06 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 P:y P:z P:x P:z P:x P:y P:z P:z P:y P:y P:x P:x P:z P:x P:x P:y D:x2-y2 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 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 1.33 1.33 1.33 1.33 25 16 11 33 46 49 37 42 26 30 37 49 23 30 33 47 51 25 25 29 41 O O O O O O O O O O O O O O O O Tc O O O O -8.250 1.00 222 A 7.23 5.27 5.25 5.09 5.09 4.66 4.21 3.84 3.77 3.07 2.89 2.34 1.82 1.76 1.62 1.37 1.37 1.17 1.13 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 P:y P:z P:y P:y P:z P:z P:z P:y P:y P:z P:z P:y P:x P:z P:z P:x P:z P:y D:yz 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 1.33 1.33 1.33 1.33 1.33 1.33 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 45 34 22 20 22 16 33 26 25 45 21 21 21 15 25 19 26 15 53 49 33 O O O O O O O O O O O O O O O O O O P O O -8.242 1.00 223 A 8.86 8.66 3.14 2.91 2.58 2.22 2.18 1.96 1.79 1.76 1.71 1.60 1.42 1.39 1.35 1.34 1.31 1.28 1.28 1.26 1.17 1.14 1.10 1.10 1.09 1.09 1.07 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 P:x P:x P:y P:z P:y D:yz D:xy P:z P:z D:xz P:x P:z P:y D:yz P:y P:x P:x 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0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 42 35 27 24 16 49 17 14 25 37 6 32 30 8 28 12 44 5 7 4 31 22 9 26 45 33 12 3 44 49 42 32 10 O O O O O O O O O O W O O W O O O W W W O O W O O O O W O O O O W -8.218 1.00 226 A 8.08 5.53 3.25 2.76 2.72 2.56 2.52 2.39 2.39 2.38 2.23 2.18 1.96 1.91 1.90 1.86 1.84 1.79 1.75 1.41 1.38 1.29 1.27 1.20 1.19 1.17 1.13 1.11 1.10 1.06 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 P:x P:x P:z P:x P:x P:x P:x P:x P:y P:x P:x P:x P:x P:x P:x P:z P:x P:x P:x P:z P:y P:y P:z P:y P:z P:x P:x P:y 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 -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 15 21 15 34 49 37 30 25 30 16 46 20 43 42 11 37 40 26 33 13 15 36 33 38 39 50 29 49 47 41 42 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -8.066 1.00 227 A 8.89 8.39 4.49 3.76 3.65 3.56 3.43 3.42 2.93 2.89 2.71 2.54 2.51 1.90 1.69 1.66 1.64 1.27 1.26 1.22 1.17 1.11 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 P:y P:z P:y P:x P:y P:x P:x P:x P:z P:y P:z P:x P:y P:y P:y P:x P:z P:z P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 25 16 21 20 30 37 34 25 21 16 37 30 12 15 26 16 12 27 15 33 49 24 33 O O O O O O O O O O O O O O O O O O O O O O O -8.038 1.00 228 A 8.89 7.13 4.62 3.24 3.17 3.10 2.99 2.10 2.08 1.88 1.88 1.62 1.60 1.50 1.43 1.40 1.39 1.27 1.27 1.25 1.25 1.16 1.16 1.09 1.09 1.08 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 P:y P:z P:z P:y P:y P:y P:y P:z P:z P:x P:z P:z P:y P:y P:z P:z P:y P:y P:z P:z P:x P:y P:x P:z P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 26 33 42 44 33 49 15 15 44 33 26 45 22 32 47 35 12 16 20 23 17 31 49 16 25 34 41 24 O O O O O O O O O O O O O O O O O O O O O O O O O O O O -8.031 1.00 229 A 5.89 4.74 3.87 3.63 3.29 3.26 3.26 3.16 3.13 3.01 2.99 2.91 2.68 2.49 2.28 2.13 1.74 1.73 1.64 1.62 1.59 1.40 1.30 1.28 1.26 1.22 1.20 1.19 1.07 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 P:z P:y P:z P:y P:z P:z P:z P:z P:y P:z P:y P:y P:y P:z P:x P:x P:z P:y P:y P:y P:z P:z P:y P:y P:y P:x P:y D:xz 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 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O O O O O O O O O O O Tc O O O O O O O -7.730 1.00 233 A 4.33 4.15 3.52 3.33 3.06 2.87 2.86 2.72 2.72 2.70 2.69 2.48 2.47 2.18 2.17 2.06 2.00 1.86 1.69 1.66 1.57 1.53 1.44 1.28 1.22 1.18 1.12 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 P:x P:x P:x P:z D:xz P:z P:x P:z P:y P:y P:x P:x P:x P:y D:xy P:y P:x P:z P:x P:z P:z P:x P:y P:z P:y P:z P:x P:y P:y -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -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 1.00 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 30 37 38 19 51 39 13 16 36 25 29 46 11 19 51 28 23 31 43 48 23 40 29 21 35 32 16 48 27 O O O O Tc O O O O O O O O O Tc O O O O O O O O O O O O O O -7.708 1.00 234 A 3.73 3.26 3.24 2.81 2.75 2.64 2.61 2.49 2.46 2.42 2.22 2.19 2.13 2.07 2.03 2.02 1.99 1.97 1.82 1.76 1.73 1.67 1.66 1.56 1.53 1.38 1.35 1.31 1.19 1.13 1.08 1.07 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 1 P:x P:x P:x P:x P:x P:y P:y P:y P:z P:z P:z P:z P:y P:y P:y P:z P:z P:y P:x P:x P:z P:z P:z P:z P:x P:x P:y P:z P:z P:x 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 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -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 48 41 47 39 36 14 35 27 17 11 24 40 38 43 29 32 13 46 44 49 18 33 12 23 42 31 26 42 37 46 28 12 31 44 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.684 1.00 235 A 6.01 5.72 4.07 3.94 3.81 3.15 3.12 2.81 2.72 2.61 2.60 2.09 1.95 1.88 1.85 1.81 1.74 1.72 1.72 1.66 1.65 1.61 1.50 1.39 1.29 1.18 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 D:xy P:y D:xz P:z P:z P:z P:x P:y P:x P:z P:y P:x P:z P:x P:y P:x P:y P:y P:x P:x P:x P:x P:z P:y P:x P:y P:y -6.613 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.00 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 51 19 51 23 19 29 43 20 40 34 29 16 39 38 36 30 23 41 13 25 47 37 47 22 41 45 13 Tc O Tc O O O O O O O O O O O O O O O O O O O O O O O O -7.635 1.00 236 A 4.09 4.01 3.64 3.30 3.09 2.69 2.38 2.37 2.31 2.27 2.18 2.13 2.10 2.06 1.99 1.83 1.66 1.61 1.52 1.48 1.42 1.41 1.37 1.37 1.36 1.33 1.29 1.28 1.24 1.14 1.12 1.07 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 1 1 1 1 1 P:z P:z P:y P:x P:z P:x P:z P:z P:y P:y D:xz P:y D:xy P:z P:x P:y P:x P:y P:x P:x D:xy P:y P:x P:y P:z D:xy D:xz D:xy P:x P:y 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32 35 36 45 20 O O O O O Tc O O O O Tc O O O O O O O O O O O O O O O O O -7.504 1.00 239 A 8.32 6.86 6.75 5.89 3.29 3.15 3.00 2.46 2.46 2.35 2.10 1.98 1.94 1.69 1.64 1.58 1.54 1.45 1.40 1.27 1.19 1.12 1.02 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 P:z P:x P:x P:y P:z P:x P:x P:x P:x P:x P:z P:x P:x P:y P:x P:z P:y P:z P:y P:z P:x P:x D:yz 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 -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 1.33 1.33 1.33 1.33 0.80 1.33 1.33 38 46 11 13 13 39 36 40 29 23 41 27 24 39 43 34 47 36 20 23 33 26 8 50 39 O O O O O O O O O O O O O O O O O O O O O O W O O -7.418 1.00 240 A 5.47 4.76 4.50 4.03 3.99 3.89 3.51 2.51 2.45 2.36 2.18 2.17 2.04 2.01 2.00 1.98 1.95 1.83 1.72 1.65 1.64 1.58 1.41 1.40 1.39 1.23 1.19 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 1 1 1 1 1 P:y P:z P:y P:z P:y P:z D:x2-y2 P:y P:y D:z2 P:x D:x2-y2 D:xz P:y D:xy P:z P:x P:y D:xy P:z P:z P:z D:yz P:z D:xz D:xy P:y D:yz D:xz -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 0.80 0.80 1.33 0.80 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 1.33 0.80 0.80 1.33 0.80 0.80 40 43 39 46 11 36 1 47 38 2 35 2 4 41 3 13 32 23 6 29 47 41 1 28 5 9 13 2 10 O O O O O O W O O W O W W O W O O O W O O O W O W W O W W -7.378 1.00 241 A 5.18 3.18 2.93 2.67 2.43 2.33 2.25 2.14 2.05 1.99 1.98 1.95 1.86 1.79 1.78 1.75 1.71 1.68 1.57 1.55 1.55 1.52 1.50 1.50 1.47 1.41 1.38 1.31 1.29 1.28 1.27 1.26 1.23 1.16 1.05 1.04 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 P:x P:x P:x P:y P:z P:x P:x P:x P:z P:y P:z P:z D:xz P:y P:z P:z P:z P:y P:x P:x P:y P:z P:y P:y P:x P:z P:y D:xy P:x P:z P:x 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 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 12 27 24 23 43 48 31 28 47 40 38 46 51 13 29 19 28 39 32 42 24 41 11 41 17 17 14 51 35 31 26 49 14 48 18 36 27 O O O O O O O O O O O O Tc O O O O O O O O O O O O O O Tc O O O O O O O O O -7.335 1.00 242 A 9.72 8.47 4.19 3.84 3.83 3.82 3.42 3.35 2.54 2.49 2.18 2.06 2.05 1.95 1.63 1.60 1.48 1.39 1.37 1.33 1.31 1.30 1.15 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 P:x P:x P:x P:y P:y P:y P:z P:x P:z P:z P:y P:y P:x D:xy P:x P:z P:z P:z P:y P:y P:y P:x 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 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 34 20 33 20 30 15 37 26 34 15 42 29 25 52 16 39 49 23 49 36 26 23 52 16 O O O O O O O O O O O O O Tc O O O O O O O O Tc O -7.180 1.00 243 A 4.61 3.66 3.51 3.48 3.42 3.05 2.75 2.70 2.48 2.41 2.37 2.36 2.30 1.91 1.89 1.84 1.81 1.81 1.78 1.76 1.65 1.59 1.58 1.56 1.51 1.46 1.44 1.38 1.28 1.24 1.24 1.18 1.09 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 P:y P:z D:xz P:x P:z P:x P:x P:x D:xy P:x P:x P:y P:z P:x P:x P:y P:z P:y P:x P:y P:z P:z P:y P:y P:y P:z P:y P:y P:z P:z P:z P:x P:x P:x -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -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 1.00 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 29 23 52 23 39 44 18 29 52 26 33 36 15 42 49 17 50 35 14 27 40 24 28 15 43 12 14 50 17 31 32 16 17 25 O O Tc O O O O O Tc O O O O O O O O O O O O O O O O O O O O O O O O O -7.140 1.00 244 A 29.26 9.44 4.29 3.59 3.41 2.77 2.74 2.12 2.03 2.01 1.93 1.50 1.18 1.16 1.12 1.11 1.09 1.06 1.03 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:x D:x2-y2 P:x P:z P:z P:y D:x2-y2 P:x P:y P:x D:z2 P:y P:y P:x P:z P:z P:z P:y -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 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 1.33 1.33 1.33 1.33 1.33 19 50 51 21 12 25 16 52 38 12 13 51 27 46 25 24 21 11 21 O O Tc O O O O Tc O O O Tc O O O O O O O -7.115 1.00 245 A 11.43 7.40 5.27 4.77 4.24 3.26 3.22 2.71 2.58 2.49 2.48 2.10 2.09 1.97 1.90 1.83 1.61 1.54 1.48 1.46 1.35 1.35 1.34 1.19 1.19 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 P:y P:z P:z P:z P:y P:y P:y D:xy P:x P:z P:y P:z P:y P:z D:xz P:x P:x P:x P:z P:y P:z P:x P:y P:z P:z P:z P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 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 21 21 30 34 37 20 19 51 37 16 25 19 28 20 51 30 20 31 13 35 31 34 38 32 42 26 33 O O O O O O O Tc O O O O O O Tc O O O O O O O O O O O O -7.048 1.00 246 A 5.64 5.02 4.37 4.09 3.89 3.61 3.52 3.36 2.72 2.65 2.59 2.39 2.11 1.95 1.72 1.57 1.49 1.48 1.45 1.41 1.40 1.30 1.28 1.19 1.12 1.12 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 P:y P:z P:y P:z P:z P:y P:z P:y P:z P:y P:z P:y P:z P:x P:y P:y P:z P:y P:z P:x P:x P:y 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 -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 28 44 35 12 31 44 32 29 23 27 24 12 48 31 31 48 39 14 26 41 47 36 17 50 42 40 23 28 O O O O O O O O O O O O O O O O O O O O O O O O O O O O -7.020 1.00 247 A 9.15 8.12 4.84 4.44 4.04 3.75 3.73 3.01 3.00 2.97 2.65 2.58 2.35 2.10 1.98 1.91 1.82 1.78 1.67 1.63 1.43 1.16 1.09 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 P:z P:y P:x P:x P:x P:x P:x P:z P:x P:x P:z P:y P:x P:y P:z P:z P:z P:y P:y P:y P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 11 46 36 39 13 38 47 39 23 41 40 43 29 14 46 41 17 36 47 42 36 49 16 49 O O O O O O O O O O O O O O O O O O O O O O O O -6.956 1.00 248 A 8.35 5.01 4.77 4.47 4.31 4.14 3.56 3.43 3.41 2.53 2.51 2.48 2.36 2.18 2.12 2.06 1.78 1.69 1.58 1.52 1.43 1.40 1.30 1.12 1.10 1.10 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 D:yz P:x D:yz P:z P:x P:y P:x P:x P:x P:y P:x P:x P:x P:z P:y P:x P:x P:y P:y P:y P:z P:z P:z P:z P:y P:z P:z P:x -6.613 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 1.00 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 51 48 52 29 44 23 17 12 14 39 18 24 27 31 28 32 35 36 33 13 26 38 36 18 18 39 47 28 Tc O Tc O O O O O O O O O O O O O O O O O O O O O O O O O -6.949 1.00 249 A 7.85 5.08 4.66 4.57 4.37 3.20 3.04 2.77 2.35 2.26 2.06 2.06 2.02 1.99 1.91 1.88 1.77 1.74 1.72 1.70 1.67 1.52 1.44 1.42 1.40 1.29 1.27 1.25 1.21 1.20 1.19 1.18 1.10 1.08 1.06 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:y P:x P:z P:x P:y P:y P:z P:z D:xy P:x P:x P:x P:z P:x P:x P:z P:y P:y P:z P:z P:y P:x D:xz P:y P:z P:z P:z P:z P:z P:y P:y P:z P:y P:y P:x P:z -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -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 1.00 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 15 23 15 29 29 42 23 49 52 41 49 14 17 47 42 36 14 50 24 33 27 26 52 46 40 39 20 43 11 34 26 50 38 16 33 25 O O O O O O O O Tc O O O O O O O O O O O O O Tc O O O O O O O O O O O O O -6.937 1.00 250 A 7.37 3.35 3.25 3.07 3.02 2.95 2.91 2.56 2.49 2.32 2.10 2.07 2.03 1.89 1.77 1.74 1.70 1.65 1.51 1.48 1.48 1.45 1.37 1.35 1.31 1.24 1.19 1.17 1.16 1.09 1.09 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 P:x P:z P:x P:x P:x P:x P:x P:x P:y P:x P:x P:x P:z P:x P:z P:x P:y P:x P:y P:z P:z P:x P:x P:y P:x P:x D:x2-y2 P:x 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 -6.613 -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 1.00 1.33 1.33 1.33 1.33 1.33 50 26 44 36 20 34 48 39 33 33 35 32 21 23 37 47 49 26 21 23 42 28 31 29 16 30 52 25 29 30 41 41 O O O O O O O O O O O O O O O O O O O O O O O O O O Tc O O O O O -6.907 1.00 251 A 8.16 7.47 6.13 2.97 2.96 2.85 2.46 2.32 2.24 2.02 2.00 1.88 1.83 1.82 1.77 1.74 1.51 1.42 1.41 1.37 1.37 1.31 1.21 1.17 1.15 1.13 1.13 1.09 1.07 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 P:y P:z P:x P:x P:z P:x P:y P:z P:x P:z P:z P:x P:y P:z P:z P:y P:x D:yz P:x P:x P:y P:z P:x P:x P:y P:z P:x P:y 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 -6.613 -9.089 -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 1.00 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 14 17 19 36 40 39 43 11 47 41 18 27 47 46 39 46 41 52 44 24 17 36 13 29 24 45 21 11 18 38 43 O O O O O O O O O O O O O O O O O Tc O O O O O O O O O O O O O -6.838 1.00 252 A 6.77 5.65 5.42 3.94 3.82 3.55 2.87 2.60 2.26 1.81 1.67 1.60 1.45 1.40 1.40 1.35 1.34 1.31 1.30 1.24 1.14 1.14 1.13 1.12 1.10 1.09 1.07 1.03 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 1 1 1 1 P:x P:z P:x P:x P:y P:z P:y P:y P:z P:z P:y P:x P:x P:x P:z P:z P:y P:y P:y P:z D:yz P:z P:z P:x P:y P:z 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 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 18 44 12 19 44 36 39 16 25 47 33 49 42 48 26 15 41 46 40 48 52 12 41 50 31 11 48 22 11 28 O O O O O O O O O O O O O O O O O O O O Tc O O O O O O O O O -6.768 1.00 253 A 22.68 6.36 4.60 3.84 3.76 3.05 2.33 2.30 2.02 1.95 1.77 1.72 1.66 1.61 1.59 1.41 1.32 1.19 1.05 1.02 1.00 1.00 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:z P:x P:y P:z D:x2-y2 P:x P:y P:x P:z P:z P:z P:z P:x P:x P:z P:z P:y P:y P:y -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -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 1.00 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 50 28 22 12 45 12 31 52 34 35 20 25 44 48 17 15 42 24 43 14 48 16 O O O O O O O Tc O O O O O O O O O O O O O O -6.767 1.00 254 A 8.06 7.43 3.81 3.75 2.89 2.70 2.33 2.23 2.23 1.98 1.96 1.92 1.90 1.78 1.70 1.66 1.66 1.58 1.51 1.48 1.47 1.43 1.41 1.39 1.33 1.29 1.27 1.24 1.19 1.13 1.09 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 P:y P:z P:z P:z P:x P:x P:y P:z P:x P:x D:xy P:z P:x P:y P:x P:x P:z P:y P:y P:x P:y P:y P:y P:y P:z P:y P:x P:y P:y 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 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -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 1.00 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 20 34 32 31 26 33 35 39 49 31 52 40 41 27 36 47 50 30 37 42 29 36 28 50 37 16 50 49 13 31 13 33 O O O O O O O O O O Tc O O O O O O O O O O O O O O O O O O O O O -6.721 1.00 255 A 7.53 6.60 5.45 4.16 3.48 3.39 3.12 2.96 2.76 2.65 2.41 2.30 2.18 2.01 1.89 1.82 1.75 1.60 1.55 1.52 1.51 1.45 1.40 1.33 1.22 1.11 1.09 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 P:z P:z P:y P:y P:z P:y P:y P:y P:z P:y P:x P:z P:z P:x P:x P:y P:x P:z P:x P:y P:z P:y P:y P:x 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 45 22 22 45 24 27 35 13 38 39 16 36 32 27 31 41 25 25 32 24 47 33 16 28 37 24 43 26 23 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.652 1.00 256 A 7.06 6.77 6.48 5.69 5.20 4.69 4.59 3.25 3.05 3.03 2.55 2.25 2.12 2.12 1.79 1.72 1.72 1.60 1.59 1.48 1.43 1.27 1.25 1.18 1.11 1.08 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 P:z P:z P:y P:y P:z P:z P:y P:z P:y P:z P:z P:z P:y P:y P:x P:x P:y P:z P:y P:x P:y P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 45 24 27 35 32 22 22 48 45 18 17 12 48 18 37 30 14 44 12 49 28 36 39 13 31 44 42 41 O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.646 1.00 257 A 5.33 5.07 4.59 4.10 3.82 3.13 2.81 2.61 2.46 2.41 2.33 2.31 2.24 2.20 2.10 2.01 1.85 1.81 1.77 1.57 1.51 1.50 1.41 1.40 1.38 1.34 1.28 1.28 1.27 1.24 1.22 1.10 1.09 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 1 1 1 1 1 1 1 1 P:y P:x P:x P:z P:x P:x P:y P:x P:y P:y P:x P:x P:y P:x P:z P:z P:x P:z P:x P:y P:x P:x P:x P:y P:y P:x P:x P:x P:x P:y P:x P:z 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 -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 14 42 36 17 39 49 17 14 28 49 45 22 42 30 49 39 25 31 16 36 34 47 38 37 31 23 20 13 17 15 37 42 33 14 31 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.577 1.00 258 A 8.82 7.52 6.38 6.22 5.53 4.63 3.82 3.81 3.76 2.91 2.39 2.36 2.27 1.76 1.62 1.60 1.57 1.49 1.23 1.23 1.23 1.20 1.20 1.14 1.12 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 1 1 1 P:y P:z P:y P:z P:z P:z P:x P:y P:y P:z P:z P:x P:y P:y P:y P:y P:z P:z P:y P:x P:y P:y 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 -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 37 30 16 25 12 48 48 48 12 44 40 16 43 27 23 44 29 24 41 22 30 25 47 25 26 45 O O O O O O O O O O O O O O O O O O O O O O O O O O -6.539 1.00 259 A 12.57 9.37 6.25 5.36 5.17 4.79 4.39 4.25 3.97 3.71 3.50 3.43 3.10 2.51 1.54 1.54 1.30 1.19 1.06 1.05 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:z P:x P:y P:x P:z P:y P:y P:z P:x P:y P:y P:x 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 -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 33 26 35 44 32 22 16 45 25 44 27 24 26 32 26 33 24 35 31 28 O O O O O O O O O O O O O O O O O O O O -6.530 1.00 260 A 13.56 13.00 12.40 7.13 6.77 5.16 5.03 4.08 2.68 2.50 1.96 1.41 1.28 1.08 1.03 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:y P:z P:z P:x P:y P:x P:y P:z P:z P:y P:y P:x P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 42 18 49 18 18 48 37 30 48 48 49 50 16 25 27 24 O O O O O O O O O O O O O O O O -6.520 1.00 261 A 13.14 12.42 10.63 9.87 8.41 7.77 3.70 3.57 3.24 3.03 2.03 1.97 1.61 1.39 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:y P:z P:y P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 45 22 35 27 24 32 25 33 26 16 24 32 32 27 O O O O O O O O O O O O O O -6.441 1.00 262 A 7.33 7.27 4.82 4.40 3.92 3.86 3.75 3.40 3.26 3.04 2.53 2.41 2.36 2.29 2.28 2.27 2.09 1.95 1.91 1.88 1.67 1.48 1.44 1.39 1.38 1.33 1.17 1.10 1.06 1.04 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 P:x P:x P:y P:x P:y P:x P:x P:x P:y P:z P:z P:z P:x P:x P:x P:z P:x P:x P:x P:y P:z P:y P:y P:z P:z P:y P:z P:z P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 20 34 21 47 15 23 41 29 28 21 15 31 16 36 25 30 13 39 38 14 17 37 27 41 24 16 25 49 16 26 37 42 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.417 1.00 263 A 6.53 5.92 5.57 5.53 4.74 4.72 3.89 3.29 3.27 3.22 2.95 2.92 2.47 2.25 2.09 1.70 1.67 1.55 1.53 1.37 1.34 1.29 1.11 1.07 1.03 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 P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:z P:y P:x P:x P:y P:x P:z P:x P:x P:x 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 44 31 28 14 48 17 12 45 22 32 35 27 18 24 28 17 34 20 42 47 49 50 43 40 41 23 36 31 O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.413 1.00 264 A 5.70 4.72 3.73 3.21 3.14 3.03 2.68 2.62 2.50 2.39 2.34 2.33 2.30 2.24 2.11 1.91 1.91 1.89 1.86 1.82 1.80 1.79 1.74 1.70 1.69 1.55 1.51 1.49 1.40 1.36 1.27 1.20 1.11 1.08 1.06 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 P:z P:y P:x P:y P:y P:z P:x P:x P:z P:y P:x P:z P:y P:z P:y P:y P:z P:z P:z P:y P:z P:z P:z P:y P:y P:y P:z P:y P:x P:z P:x P:y P:y 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 -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 11 46 42 16 37 25 12 49 48 33 30 26 27 45 35 49 43 32 24 22 46 22 30 48 28 40 31 30 37 18 17 45 14 12 37 42 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.385 1.00 265 A 8.63 8.24 6.65 5.66 5.46 5.27 5.24 4.72 2.58 2.47 2.25 2.12 1.82 1.67 1.51 1.42 1.38 1.36 1.24 1.16 1.13 1.08 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 P:y P:y P:y P:y P:z P:z P:y P:z P:x P:z P:y P:y P:z P:y P:z P:y P:x P:x P:x P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 23 41 46 40 29 47 11 43 49 11 35 27 32 29 24 47 30 33 42 49 26 33 22 40 O O O O O O O O O O O O O O O O O O O O O O O O -6.383 1.00 266 A 11.52 7.08 6.10 4.06 3.42 3.11 3.10 2.84 2.74 2.29 2.25 2.12 2.04 2.01 1.80 1.79 1.54 1.48 1.38 1.38 1.29 1.21 1.09 1.07 1.04 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 P:z P:y P:z P:y P:z P:z P:x P:z P:z P:y P:z P:x P:z P:z P:x P:z P:y P:z P:z P:z P:y 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 -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 46 11 11 42 47 49 42 30 29 37 38 37 43 18 49 44 13 48 28 36 39 12 37 26 14 46 O O O O O O O O O O O O O O O O O O O O O O O O O O -6.378 1.00 267 A 16.49 14.68 4.82 4.71 4.32 4.20 3.81 3.09 2.45 1.99 1.76 1.56 1.50 1.42 1.36 1.34 1.28 1.11 1.07 1.05 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:x P:z P:y P:y P:z P:z P:y P:z P:y P:z P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 43 40 26 33 16 25 46 40 11 47 33 41 29 23 26 45 49 14 22 49 O O O O O O O O O O O O O O O O O O O O -6.340 1.00 268 A 12.87 11.90 8.33 7.84 4.55 3.74 3.49 2.94 2.11 2.00 1.99 1.97 1.81 1.66 1.64 1.40 1.39 1.30 1.25 1.23 1.22 1.21 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 P:z P:y P:x P:x P:x P:x P:x P:x P:z P:z P:y P:z P:y P:x P:z P:y P:x P:x P:y P:x P:z 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 40 43 25 16 19 26 33 21 21 30 37 43 21 48 48 48 13 47 16 38 33 18 41 41 O O O O O O O O O O O O O O O O O O O O O O O O -6.313 1.00 269 A 10.07 8.44 7.40 7.29 6.66 5.91 3.80 3.51 3.13 2.84 2.62 2.53 1.86 1.66 1.32 1.32 1.28 1.21 1.15 1.13 1.12 1.10 1.08 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 P:z P:y P:z P:z P:y P:y P:x P:x P:z P:z P:x P:x P:y P:y P:x P:y P:z P:y P:x P:y P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 11 46 40 34 20 43 49 42 46 43 37 30 15 21 25 40 15 11 33 14 17 16 28 30 21 O O O O O O O O O O O O O O O O O O O O O O O O O -6.285 1.00 270 A 17.32 6.74 5.89 4.23 3.64 3.38 3.00 2.82 2.68 2.25 2.00 1.75 1.65 1.64 1.63 1.52 1.47 1.38 1.33 1.33 1.31 1.29 1.26 1.16 1.15 1.07 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:x P:x P:z P:x P:x P:x P:x P:y P:x P:y P:x P:z P:z P:x P:z P:z P:x P:y P:x P:z P:z P:z P:y P:x P:z P:x P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 50 15 15 21 19 33 26 15 23 29 29 18 23 36 26 40 39 43 47 31 21 44 21 20 50 34 18 28 44 49 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.146 1.00 271 A 7.05 6.86 6.32 5.52 4.30 3.60 3.24 2.51 2.39 2.34 2.31 2.29 2.12 2.12 1.96 1.93 1.90 1.86 1.82 1.79 1.74 1.59 1.48 1.47 1.42 1.30 1.29 1.27 1.22 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 1 P:y P:y P:z P:z P:y P:z P:z P:y P:z P:z P:y P:x P:z P:x P:y P:z P:y P:x P:x P:y P:y P:z P:x P:y P:y P:x P:x P:y P:x 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 13 39 38 36 28 17 29 41 47 24 35 24 31 35 46 45 23 29 28 38 11 11 17 14 19 47 41 22 25 46 27 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.143 1.00 272 A 7.84 4.50 4.40 4.11 4.01 3.69 3.56 2.80 2.70 2.65 2.52 2.31 2.26 2.04 1.90 1.88 1.87 1.81 1.76 1.73 1.66 1.65 1.59 1.57 1.55 1.44 1.11 1.10 1.05 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 P:z P:z P:y P:x P:x P:z P:y P:x P:x P:x P:x P:x P:y P:x P:x P:z P:z P:y P:y P:x P:x P:x P:z P:x P:y P:x P:y P:z 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 -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 19 32 14 27 32 31 19 38 13 35 24 14 27 48 30 30 13 37 23 44 17 18 17 31 38 37 35 36 36 35 49 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -6.037 1.00 273 A 10.81 7.14 4.90 4.47 3.74 3.61 3.58 3.57 3.33 3.27 2.95 2.72 2.71 2.64 2.63 2.60 2.56 2.45 2.36 2.35 2.10 1.98 1.68 1.46 1.33 1.20 1.16 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 P:y P:z P:x P:y P:y P:x P:x P:x P:x P:x P:x P:z P:x P:x P:y P:x P:x P:y P:x P:z P:y P:z P:z P:z P:z D:xy 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 -6.613 -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 1.00 1.33 1.33 19 19 13 38 41 17 24 27 14 38 30 13 28 31 39 35 37 47 32 47 23 36 41 29 37 51 13 36 O O O O O O O O O O O O O O O O O O O O O O O O O Tc O O -5.980 1.00 274 A 12.11 8.06 6.29 4.56 4.43 4.22 4.18 3.71 3.52 3.52 3.28 2.99 2.83 2.78 2.23 2.17 2.08 1.98 1.80 1.65 1.51 1.38 1.29 1.25 1.05 1.04 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 P:x P:x P:x P:z P:y P:z P:y P:z P:x P:z P:y P:z P:y P:z P:x P:x P:y P:x P:z P:x P:x P:y P:x P:x P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 12 18 48 36 39 29 41 38 44 47 23 48 13 19 46 11 19 40 44 43 13 18 47 38 48 43 12 O O O O O O O O O O O O O O O O O O O O O O O O O O O -5.952 1.00 275 A 6.76 4.83 4.77 4.64 4.63 4.57 4.32 4.31 3.68 3.67 3.66 3.42 2.71 2.35 2.34 2.23 2.02 1.92 1.91 1.85 1.79 1.71 1.50 1.29 1.10 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 P:y P:z P:z P:y P:x P:x P:x P:x P:x P:x P:z P:y P:z P:z P:z P:z P:y P:x P:z P:z P:x P:x P:y P:y 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 -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 19 19 46 11 13 32 38 35 31 28 43 40 31 35 47 32 39 37 36 28 30 41 41 28 32 47 14 O O O O O O O O O O O O O O O O O O O O O O O O O O O -5.935 1.00 276 A 8.17 8.09 6.83 5.98 5.66 3.78 3.59 3.53 3.36 3.23 2.75 2.58 2.40 2.23 1.99 1.97 1.90 1.89 1.86 1.76 1.69 1.67 1.41 1.40 1.39 1.37 1.36 1.35 1.34 1.30 1 1 1 1 1 1 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:z P:y P:x P:x P:x P:x P:z P:y P:x P:y P:z P:x P:z P:y P:x P:z P:z P:x P:y P:z P:z P:y P:z P:y P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 40 11 46 43 19 14 27 17 24 19 23 38 13 29 47 27 24 13 14 38 41 17 28 35 14 17 32 31 24 27 O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O -5.913 1.00 277 A 15.46 8.85 8.44 7.63 7.25 6.21 6.05 4.35 4.21 2.85 2.83 1.80 1.26 1.12 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 P:x P:y P:x P:z P:x P:x P:y P:y P:z P:z P:y P:y 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 44 40 48 43 12 18 46 11 11 46 43 23 29 40 19 O O O O O O O O O O O O O O O -5.858 1.00 278 A 12.37 7.87 4.54 4.22 4.09 3.06 2.90 2.69 2.68 2.30 2.23 2.15 2.08 2.04 1.82 1.77 1.70 1.62 1.59 1.54 1.51 1.45 1.24 1.23 1.21 1.20 1.14 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:z P:y P:x P:x P:x P:x P:x P:x P:x P:y P:z P:z P:y P:z P:z P:y P:y P:y P:x P:x P:y P:z P:z D:xz 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 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -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 1.00 1.33 1.33 1.33 1.33 19 19 38 18 13 30 41 37 47 13 47 31 39 38 36 11 28 46 24 27 23 29 37 51 41 46 35 17 O O O O O O O O O O O O O O O O O O O O O O O Tc O O O O -5.700 1.00 279 A 5.17 5.07 4.95 4.43 4.40 4.33 4.32 4.06 3.98 3.98 3.88 3.74 3.70 3.61 3.57 3.55 3.42 3.41 3.41 2.90 2.66 1.76 1.59 1.45 1.43 1.40 1.37 1 1 1 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:y P:x P:x P:z P:y P:x P:z P:z P:x P:x P:z P:x P:y P:y P:x P:x P:z P:y P:z P:z 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 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 39 31 36 23 13 17 24 29 14 27 47 38 35 14 17 28 28 41 32 31 32 27 24 28 35 35 29 O O O O O O O O O O O O O O O O O O O O O O O O O O O -5.603 1.00 280 A 8.75 8.32 7.30 6.80 6.29 6.07 5.82 5.39 4.16 2.23 1.96 1.84 1.80 1.57 1.52 1.35 1.33 1.28 1.22 1.21 1.20 1.18 1.17 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:x P:x P:z P:z P:y P:z P:z P:x P:x P:y P:z P:x P:y 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 -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 44 18 11 40 12 48 43 46 46 11 31 27 24 13 47 28 23 38 31 28 41 29 43 39 O O O O O O O O O O O O O O O O O O O O O O O O -5.405 1.00 281 A 34.64 22.55 6.82 4.92 4.55 4.12 3.11 2.77 2.03 1.89 1.52 1 1 1 1 1 1 1 1 1 1 1 P:y P:z D:xy P:x P:x D:xz P:x P:x P:x P:x P:z -9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 50 50 52 36 39 52 23 29 42 49 39 O O Tc O O Tc O O O O O -5.325 1.00 282 A 30.80 21.60 5.13 4.01 3.90 3.89 3.42 3.38 2.11 1.60 1.58 1.52 1.28 1 1 1 1 1 1 1 1 1 1 1 1 1 P:z P:y D:xz P:x P:x D:xy P:x P:x P:x P:z P:x P:x P:z -9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 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 50 50 52 39 36 52 29 23 50 36 42 49 39 O O Tc O O Tc O O O O O O O -3.968 1.00 283 A 50.39 4.90 4.86 4.56 4.40 3.55 2.61 1.67 1.28 1.23 1.21 1.06 1 1 1 1 1 1 1 1 1 1 1 1 D:yz P:y P:z P:y P:z P:x P:x D:z2 D:xz D:xy P:z D:z2 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -4.498 -4.498 -9.089 -4.498 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 0.80 0.80 1.33 0.80 51 41 47 13 38 12 48 51 4 3 48 7 Tc O O O O O O Tc W W O W -3.075 1.00 284 A 28.59 20.83 18.14 12.75 1.81 1.02 1 1 1 1 1 1 D:xy D:xz P:y P:z D:x2-y2 P:z -6.613 -6.613 -9.089 -9.089 -6.613 -9.089 1.00 1.00 1.33 1.33 1.00 1.33 51 51 19 19 51 41 Tc Tc O O Tc O -3.049 1.00 285 A 29.60 18.76 18.38 12.62 2.58 1.14 1.12 1 1 1 1 1 2 1 D:xz D:xy P:z P:y D:x2-y2 D:xz P:y -6.613 -6.613 -9.089 -9.089 -6.613 3.846 -9.089 1.00 1.00 1.33 1.33 1.00 0.00 1.33 51 51 19 19 51 51 38 Tc Tc O O Tc Tc O -2.859 0.00 286 A 36.42 3.80 3.46 3.39 3.29 3.05 3.03 2.80 2.52 1.88 1.71 1.67 1.48 1.25 1.21 1.13 1.07 1.07 1.04 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:yz D:xy P:x D:x2-y2 D:xy P:x D:xz D:xz D:z2 D:x2-y2 D:z2 D:xy D:yz D:z2 D:x2-y2 P:y P:x P:x D:yz -6.613 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 1.00 0.80 1.33 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 0.80 1.33 1.33 1.33 0.80 52 9 44 1 6 18 5 10 2 2 10 52 1 5 6 11 24 27 2 Tc W O W W O W W W W W Tc W W W O O O W -2.689 0.00 287 A 8.34 7.86 7.58 5.51 3.58 3.54 2.89 2.87 2.86 2.82 2.63 2.54 2.36 2.23 2.17 1.77 1.70 1.51 1.46 1.29 1.14 1.09 1.07 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 D:xz D:xy D:xy D:xz D:xy D:xy D:xz D:xz P:y P:z P:y D:z2 D:yz P:z D:x2-y2 D:z2 P:y P:z D:xy P:y D:yz P:z D:yz D:yz -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 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 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 1.33 0.80 0.80 1.33 1.33 0.80 1.33 0.80 1.33 0.80 0.80 4 3 9 10 6 8 5 7 41 47 23 10 8 29 3 7 13 38 7 39 9 36 5 6 W W W W W W W W O O O W W O W W O O W O W O W W -2.439 0.00 288 A 11.49 7.53 7.40 4.17 3.61 3.36 3.28 3.10 2.91 2.71 2.62 2.46 1.79 1.75 1.56 1.47 1.39 1.35 1.25 1.21 1.21 1.19 1.15 1.07 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 D:x2-y2 D:z2 D:x2-y2 D:yz P:y P:z D:xy D:yz P:y D:z2 D:xz P:z D:xy D:xz D:xy P:y D:xy D:xz P:y P:x P:x D:yz D:xz P:z P:z P:y -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 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 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 0.80 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1 2 2 1 40 43 9 2 11 1 10 46 3 4 6 23 8 5 13 24 27 8 7 29 38 39 W W W W O O W W O W W O W W W O W W O O O W W O O O -2.358 0.00 289 A 5.86 5.83 5.75 5.54 4.81 4.59 3.80 3.47 3.03 2.99 2.93 2.84 2.77 2.75 2.39 2.22 1.79 1.62 1.61 1.55 1.51 1.33 1.10 1.10 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 D:xy D:xy D:xz D:xy D:xz D:xz D:xy D:yz P:y P:y P:z D:z2 P:z D:xz P:z P:y D:xy P:z D:yz P:y D:yz D:z2 D:xy D:x2-y2 P:z -4.498 -4.498 -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 -9.089 -4.498 -9.089 -4.498 -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 0.80 1.33 0.80 1.33 1.33 0.80 1.33 0.80 1.33 0.80 0.80 0.80 0.80 1.33 6 3 4 8 5 7 9 8 13 39 38 7 36 10 47 41 7 29 6 23 5 10 5 3 28 W W W W W W W W O O O W O W O O W O W O W W W W O -2.167 0.00 290 A 11.04 10.57 8.53 6.41 3.47 3.47 2.99 2.80 2.42 2.40 2.39 2.22 1.92 1.86 1.82 1.60 1.36 1.27 1.20 1.18 1.06 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 D:yz D:x2-y2 D:x2-y2 D:z2 D:yz D:z2 D:yz D:yz D:xy D:xz P:x P:x P:x D:xy P:x D:xz P:y P:z P:y P:z P:y -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 1.00 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 0.80 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 52 1 2 2 1 1 51 2 3 4 17 14 35 8 32 7 13 47 41 38 14 Tc W W W W W Tc W W W O O O W O W O O O O O -2.082 0.00 291 A 9.41 7.09 5.74 5.26 5.22 4.97 4.28 4.16 3.75 2.83 2.76 2.52 2.24 2.02 1.99 1.96 1.95 1.80 1.79 1.75 1.68 1.64 1.49 1.30 1.21 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 1 1 D:xy D:xz D:yz P:x P:x D:yz D:xy D:yz D:yz P:y P:z D:yz P:y P:y P:y D:xz P:z D:xy P:z D:yz P:z D:z2 D:xz D:xy D:xz 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O O O W O O O O O O O W W O O O -1.107 0.00 306 A 7.39 6.72 6.18 4.34 3.88 2.87 2.31 2.10 2.06 1.98 1.90 1.89 1.82 1.81 1.76 1.60 1.55 1.51 1.47 1.42 1.32 1.31 1.19 1.07 1.03 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 D:xy D:x2-y2 D:z2 D:xz D:x2-y2 D:x2-y2 P:x P:x P:y P:x D:xy D:xy P:x D:yz D:x2-y2 P:x P:x P:z D:z2 D:xz P:z D:yz D:xz D:xy D:yz D:yz -6.613 -4.498 -4.498 -6.613 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 1.00 0.80 0.80 1.00 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 52 7 8 52 8 5 13 38 50 30 7 2 37 7 6 36 39 37 6 1 50 3 6 1 4 5 Tc W W Tc W W O O O O W W O W W O O O W W O W W W W W -1.085 0.00 307 A 9.17 9.02 5.71 4.94 4.67 2.79 2.56 2.50 2.38 2.32 2.23 1.98 1.96 1.92 1.83 1.68 1.58 1.55 1.52 1.49 1.25 1.23 1.17 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:x2-y2 D:z2 D:xz 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4.78 3.52 3.44 3.40 2.68 2.54 2.43 2.12 2.11 1.67 1.55 1.52 1.38 1.28 1.10 1.08 1.03 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 D:xy D:xy D:xz D:xz P:x P:x D:x2-y2 P:y D:yz D:z2 P:y P:z D:xy D:yz P:z D:x2-y2 D:x2-y2 D:xy D:xz D:xy D:xy -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 4.055 -6.613 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.00 1.00 2 1 1 2 45 22 7 35 9 8 28 32 8 10 31 1 10 9 7 2 52 W W W W O O W O W W O O W W O W W W W W Tc -0.832 0.00 312 A 10.87 9.75 3.87 3.29 3.11 3.10 2.36 2.31 2.28 2.14 2.11 2.01 1.80 1.78 1.73 1.55 1.36 1.29 1.19 1.09 1.01 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 D:z2 D:z2 D:x2-y2 D:yz D:yz P:z P:y D:yz P:z P:y D:x2-y2 P:y P:z D:yz P:z D:yz D:z2 D:z2 D:z2 D:yz D:z2 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 4.055 4.055 -4.498 -4.498 -4.498 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3.87 3.20 2.53 2.53 2.33 2.13 1.99 1.96 1.85 1.84 1.76 1.68 1.59 1.52 1.44 1.40 1.38 1.33 1.33 1.32 1.30 1.29 1.26 1.25 1.17 1.06 1.04 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 1 1 1 1 1 D:x2-y2 D:yz D:yz D:x2-y2 D:xz D:xy D:x2-y2 D:x2-y2 D:z2 D:x2-y2 D:xz D:z2 D:yz P:z D:xy P:x D:xy D:x2-y2 D:x2-y2 P:y P:z D:xz P:y D:z2 P:x D:xz P:x D:z2 D:yz P:z P:y -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -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 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -6.613 -4.498 -9.089 -9.089 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 1.33 0.80 1.33 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.00 0.80 1.33 1.33 4 8 7 9 3 8 51 3 10 7 5 1 6 40 10 19 6 10 2 37 48 7 43 3 16 4 25 51 10 30 28 W W W W W W Tc W W W W W W O W O W W W O O W O W O W O Tc W O O -0.626 0.00 315 A 6.67 5.07 4.26 4.16 4.00 3.99 2.90 2.65 2.04 1.84 1.73 1.71 1.70 1.68 1.63 1.43 1.39 1.31 1.23 1.18 1.08 1.03 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 D:yz D:xy D:yz D:yz D:yz D:xz D:x2-y2 D:z2 P:z D:x2-y2 D:xy D:xy D:yz D:z2 D:xz P:y P:y P:y D:z2 P:z P:z P:x P:x -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 -9.089 -9.089 -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 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 6 1 7 5 8 2 10 9 18 5 2 9 3 4 10 42 14 18 5 17 49 22 45 W W W W W W W W O W W W W W W O O O W O O O O -0.522 0.00 316 A 5.25 4.56 4.47 4.26 3.78 3.77 2.94 2.89 2.63 2.43 2.16 2.02 2.01 2.00 1.88 1.79 1.77 1.51 1.43 1.41 1.28 1.25 1.14 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 D:x2-y2 D:yz D:z2 D:yz D:z2 D:x2-y2 P:z P:y D:xz P:x P:x P:x D:xy D:xz D:xz P:x D:x2-y2 D:xy D:yz P:x D:x2-y2 D:xy D:xy D:x2-y2 P:y D:z2 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -6.613 -4.498 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11 46 6 6 8 36 39 42 13 52 38 49 7 30 7 5 52 5 37 8 5 49 37 W W W W O O W W W O O O O Tc O O W O W W Tc W O W W O O -0.349 0.00 318 A 5.30 3.99 3.89 3.52 2.91 2.90 2.38 2.28 2.19 2.09 2.07 1.99 1.97 1.82 1.31 1.29 1.24 1.22 1.15 1.12 1.11 1.10 1.10 1.10 1.10 1.08 1.07 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 D:z2 D:x2-y2 D:xy D:xz D:xz D:x2-y2 D:yz D:xy D:yz D:z2 D:z2 D:x2-y2 D:yz D:x2-y2 P:x P:y P:z P:y D:x2-y2 D:x2-y2 P:z D:x2-y2 D:xz D:z2 D:z2 P:z P:x 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 -6.613 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -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 1.00 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 2 1 9 4 10 5 8 3 6 8 6 10 52 7 44 28 31 14 3 4 17 9 6 7 5 43 32 5 W W W W W W W W W W W W Tc W O O O O W W O W W W W O O W -0.218 0.00 319 A 21.47 7.88 6.56 5.73 5.19 5.01 3.17 2.00 1.83 1.65 1.63 1.59 1.55 1.47 1.45 1.44 1.38 1.31 1.24 1.10 1.05 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1 D:z2 D:x2-y2 D:xz D:xy P:z P:y D:z2 P:y P:z D:xy D:x2-y2 P:z D:xz P:y D:x2-y2 D:yz D:x2-y2 D:z2 D:xz P:x P:x -6.613 -6.613 -4.498 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -6.613 -6.613 -4.498 4.055 -9.089 -9.089 1.00 1.00 0.80 0.80 1.33 1.33 1.00 1.33 1.33 0.80 0.80 1.33 0.80 1.33 0.80 1.00 1.00 0.80 0.00 1.33 1.33 51 51 3 4 41 47 52 38 13 7 10 40 8 43 4 51 52 9 3 47 16 Tc Tc W W O O Tc O O W W O W O W Tc Tc W W O O -0.181 0.00 320 A 13.06 8.61 7.06 6.00 2.80 2.70 2.53 2.11 1.87 1.75 1.74 1.42 1.40 1.22 1.19 1.18 -1.17 1.16 1.15 1.14 1.11 1.06 1.04 1 3 1 1 1 2 1 1 1 1 1 3 1 1 2 1 3 1 1 1 1 3 1 D:x2-y2 S P:x D:z2 D:xz S D:xy D:x2-y2 D:x2-y2 D:xy D:z2 S P:z P:y P:x P:z S P:x D:xz D:xz D:x2-y2 S P:x -6.613 0.762 -9.089 -6.613 -4.498 -5.052 -4.498 -4.498 -4.498 -4.498 -4.498 0.762 -9.089 -9.089 -1.119 -9.089 3.091 -9.089 -4.498 -4.498 -4.498 1.231 -9.089 1.00 0.00 1.33 1.00 0.80 2.00 0.80 0.80 0.80 0.80 0.80 0.00 1.33 1.33 0.00 1.33 0.00 1.33 0.80 0.80 0.80 0.00 1.33 51 51 19 51 3 51 4 7 5 10 6 52 40 43 51 41 53 38 9 8 8 9 13 Tc Tc O Tc W Tc W W W W W Tc O O Tc O P O W W W W O 0.046 0.00 321 A 15.66 8.49 4.98 4.97 4.97 4.90 4.89 4.70 4.68 4.46 4.45 3.88 3.87 3.33 3.25 -2.93 -2.91 1.91 1.88 1.58 -1.58 1.56 1.40 1.39 1.03 1.03 3 1 3 3 1 3 3 3 3 3 3 3 3 1 3 3 2 2 2 2 2 2 2 2 2 2 S D:x2-y2 S S P:x S S S S S S S S D:z2 S S S S S P:x S S S S S S 0.762 -6.613 1.231 1.231 -9.089 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -6.613 0.762 3.091 -5.052 -5.688 -5.688 -1.119 -13.975 -5.052 -5.688 -5.688 -5.688 -5.688 0.00 1.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 2.00 2.00 2.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 52 51 6 5 19 2 1 3 4 7 8 10 9 51 51 53 51 3 4 51 53 52 7 8 2 1 Tc Tc W W O W W W W W W W W Tc Tc P Tc W W Tc P Tc W W W W 0.183 0.00 322 A 26.79 9.31 4.81 4.64 4.22 3.58 3.57 3.45 1.60 1.37 1.33 1.27 1.15 1.07 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 D:z2 D:x2-y2 D:xy D:xz P:y D:xy P:z D:xz D:yz P:y P:y P:z P:x D:xz D:xy -6.613 -6.613 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -6.613 -9.089 -9.089 -9.089 -9.089 -4.498 4.055 1.00 1.00 0.80 0.80 1.33 0.80 1.33 0.80 1.00 1.33 1.33 1.33 1.33 0.80 0.00 52 52 10 9 29 5 23 6 52 43 36 40 23 3 10 Tc Tc W W O W O W Tc O O O O W W 0.311 0.00 323 A 22.98 8.16 8.02 5.32 -5.18 3.43 3.20 2.47 2.25 2.19 -2.15 2.12 2.09 1.78 1.74 1.73 1.56 -1.51 1.48 1.47 1.43 1.26 1.25 1.17 1.14 1.06 1.01 3 2 1 3 3 1 2 1 1 1 2 2 1 2 3 3 1 2 1 3 3 1 1 3 1 1 1 S S D:x2-y2 S P:x P:x S D:z2 D:xz D:xy P:x S D:xz P:x S S D:xy P:x D:xz S S D:yz D:yz S P:y D:z2 P:z 0.762 -5.052 -6.613 0.762 2.188 -9.089 -5.052 -6.613 -6.613 -4.498 -5.506 -13.975 -4.498 -1.119 1.231 1.231 -4.498 -1.119 -4.498 1.231 1.231 -4.498 -4.498 3.091 -9.089 -4.498 -9.089 0.00 2.00 1.00 0.00 0.00 1.33 2.00 1.00 1.00 0.80 1.00 2.00 0.80 0.00 0.00 0.00 0.80 0.00 0.80 0.00 0.00 0.80 0.80 0.00 1.33 0.80 1.33 51 51 52 52 53 50 52 52 52 10 53 53 9 52 7 8 5 51 6 3 4 1 2 53 26 9 33 Tc Tc Tc Tc P O Tc Tc Tc W P P W Tc W W W Tc W W W W W P O W O 0.396 0.00 324 A 10.24 5.69 5.36 4.78 4.33 3.64 3.62 -3.05 2.87 2.56 2.45 2.41 2.15 1.76 1.62 1.48 1.47 1.43 1.33 1.31 1.31 1.30 1.29 1.28 1.27 1.27 1.19 1.15 1.13 1.10 1.10 1.06 -1.03 1.03 1.02 3 3 1 1 2 3 3 3 2 1 3 3 1 1 1 1 1 1 1 2 2 2 2 1 1 2 1 1 1 1 1 1 2 1 1 S S D:yz D:yz S S S P:x S D:yz S S D:z2 D:x2-y2 P:y D:x2-y2 D:xy P:z D:z2 S S S S P:y D:x2-y2 S P:z D:yz P:x D:x2-y2 D:yz D:z2 P:x D:xy D:z2 0.762 0.762 -4.498 -4.498 -5.052 1.231 1.231 2.188 -5.052 -4.498 1.231 1.231 -4.498 -4.498 -9.089 -6.613 -4.498 -9.089 -4.498 -5.688 -5.688 -5.688 -5.688 -9.089 -4.498 -13.975 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -5.506 -4.498 -4.498 0.00 0.00 0.80 0.80 2.00 0.00 0.00 0.00 2.00 0.80 0.00 0.00 0.80 0.80 1.33 1.00 0.80 1.33 0.80 2.00 2.00 2.00 2.00 1.33 0.80 2.00 1.33 0.80 1.33 0.80 0.80 0.80 1.00 0.80 0.80 52 51 2 1 51 10 9 53 52 4 7 8 5 8 45 52 7 22 6 10 7 9 8 27 6 53 24 5 18 3 3 7 53 6 3 Tc Tc W W Tc W W P Tc W W W W W O Tc W O W W W W W O W P O W O W W W P W W 0.456 0.00 325 A 10.43 9.89 5.00 4.99 4.97 -4.41 4.13 2.37 2.36 2.17 1.98 1.91 1.88 1.83 1.82 1.71 1.69 1.49 1.40 1.34 1.16 1.04 3 3 2 1 2 3 1 1 1 1 1 3 3 3 3 2 2 1 1 1 1 1 S S S D:xz S P:x D:xy D:z2 D:yz D:z2 D:z2 S S S S S S D:z2 D:z2 D:yz D:x2-y2 D:xz 0.762 0.762 -5.052 -4.498 -5.052 2.188 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 1.231 1.231 1.231 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 -4.498 0.00 0.00 2.00 0.80 2.00 0.00 0.80 0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.00 2.00 2.00 0.80 0.80 0.80 0.80 0.80 52 51 51 1 52 53 2 5 4 3 9 4 3 6 5 4 3 6 4 10 6 2 Tc Tc Tc W Tc P W W W W W W W W W W W W W W W W 0.505 0.00 326 A 10.08 10.01 9.49 9.28 8.13 7.68 7.39 -7.03 6.84 5.84 5.72 5.49 5.27 5.15 4.80 4.47 4.24 -4.13 1.84 1.35 1.23 -1.23 -1.14 -1.04 3 3 3 3 3 3 3 3 3 2 2 2 2 2 2 2 2 3 1 1 3 2 2 2 S S S S S S S P:z S S S S S S S S S P:y D:z2 D:yz S P:z P:z P:z 1.231 1.231 1.231 1.231 1.231 1.231 1.231 2.188 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 2.188 -4.498 -4.498 0.762 -5.506 -1.119 -1.119 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.80 0.80 0.00 1.00 0.00 0.00 6 3 5 4 8 7 9 53 10 6 3 5 4 9 10 8 7 53 3 4 52 53 52 51 W W W W W W W P W W W W W W W W W P W W Tc P Tc Tc 0.515 0.00 327 A 19.64 19.28 10.75 10.69 -7.70 6.51 5.90 5.73 5.30 4.70 -4.58 4.53 4.30 4.08 4.08 3.70 3.55 3.25 2.63 2.57 2.33 2.25 -1.95 -1.19 3 3 2 2 3 3 3 3 3 3 3 3 3 3 2 2 2 2 2 2 2 2 2 2 S S S S P:y S S S S S P:z S S S S S S S S S S S P:y P:z 1.231 1.231 -5.688 -5.688 2.188 1.231 1.231 1.231 1.231 1.231 2.188 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.506 -5.506 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00 2 1 2 1 53 4 10 3 9 7 53 5 8 6 4 3 10 9 7 5 8 6 53 53 W W W W P W W W W W P W W W W W W W W W W W P P 0.597 0.00 328 A 16.63 8.71 5.11 3.20 2.82 2.55 2.37 2.35 2.18 1.92 1.72 1.67 1.38 1.37 1.10 1.02 1.01 1.01 1 1 1 3 1 2 3 3 1 1 3 1 1 1 1 2 2 1 D:x2-y2 P:x D:z2 S D:xz P:x S S D:x2-y2 D:yz S D:x2-y2 P:x D:x2-y2 D:z2 S S D:xy -6.613 -9.089 -6.613 0.762 -6.613 -1.119 1.231 1.231 -6.613 -4.498 0.762 -4.498 -9.089 -4.498 -4.498 -5.688 -5.688 -4.498 1.00 1.33 1.00 0.00 1.00 0.00 0.00 0.00 1.00 0.80 0.00 0.80 1.33 0.80 0.80 2.00 2.00 0.80 52 50 52 52 52 52 9 10 51 10 51 9 19 8 7 8 7 2 Tc O Tc Tc Tc Tc W W Tc W Tc W O W W W W W 0.827 0.00 329 A 18.77 14.46 13.50 13.22 6.32 6.32 5.88 5.85 -2.69 -2.15 1.63 1.60 1.43 1.39 3 3 2 2 2 2 3 3 2 2 3 3 2 2 S S S S S S S S P:x P:x S S S S 0.762 0.762 -5.052 -5.052 -5.688 -5.688 1.231 1.231 -1.119 -1.119 1.231 1.231 -5.688 -5.688 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 52 51 52 51 1 2 1 2 52 51 7 8 7 8 Tc Tc Tc Tc W W W W Tc Tc W W W W 0.903 0.00 330 A 10.23 10.02 9.56 9.46 8.88 8.59 8.32 8.20 2.17 1.78 1.59 1.42 1.22 1.07 1.02 1.01 1.01 2 2 2 2 3 3 3 3 1 1 1 2 1 1 3 2 1 S S S S S S S S D:z2 D:xy D:z2 P:y D:xz D:z2 S S D:z2 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -4.498 -4.498 -4.498 -5.506 -4.498 -4.498 1.231 -5.688 -4.498 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.80 0.80 0.80 1.00 0.80 0.80 0.00 2.00 0.80 6 10 7 3 6 10 7 3 6 7 3 53 6 7 8 9 8 W W W W W W W W W W W P W W W W W 0.906 0.00 331 A 11.80 11.00 10.81 10.46 9.90 9.89 9.38 8.66 2.38 -2.03 2.02 2.02 1.99 1.97 1.96 1.88 1.85 -1.81 1.32 1.31 -1.27 -1.26 2 2 2 2 3 3 3 3 2 2 3 2 1 2 2 3 3 2 3 1 2 2 S S S S S S S S S P:z S S D:xz S S S S P:z S D:xy P:y P:y -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -1.119 1.231 -5.688 -4.498 -5.688 -5.688 1.231 1.231 -1.119 1.231 -4.498 -1.119 -1.119 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 2.00 0.80 2.00 2.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 5 9 8 4 5 9 4 8 6 52 10 7 8 3 10 3 6 51 7 5 52 51 W W W W W W W W W Tc W W W W W W W Tc W W Tc Tc 1.111 0.00 332 A 9.92 9.78 8.08 7.93 3.06 2.47 2.29 1.92 1.91 1.87 1.82 1.81 1.74 1.62 1.52 1.47 1.28 1.25 1.21 1.16 1.13 1.10 1.06 1.02 3 3 2 2 1 1 1 2 1 2 2 2 1 1 1 1 3 3 3 1 1 3 1 1 S S S S D:z2 D:z2 D:x2-y2 S D:yz S S S D:xy D:z2 D:xz D:yz S S S D:x2-y2 D:z2 S D:yz D:yz 1.231 1.231 -5.688 -5.688 -4.498 -4.498 -4.498 -5.688 -4.498 -5.688 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 1.231 1.231 1.231 -4.498 -4.498 1.231 -4.498 -4.498 0.00 0.00 2.00 2.00 0.80 0.80 0.80 2.00 0.80 2.00 2.00 2.00 0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.80 0.80 0.00 0.80 0.80 1 2 1 2 10 4 9 9 7 3 10 4 7 9 8 5 3 4 9 3 3 10 2 8 W W W W W W W W W W W W W W W W W W W W W W W W 1.139 0.00 333 A 9.26 6.57 4.90 2.68 2.39 2.06 1.88 1.81 1.81 1.79 1.63 1.60 1.54 1.51 1.43 1.38 1.36 1.27 1.24 1.18 1.13 1.12 1.11 1.10 1.09 1.09 1.09 1.08 1.01 1 1 1 1 1 1 1 2 3 1 1 3 1 3 1 1 1 1 3 2 2 3 3 1 1 1 2 1 1 D:yz D:yz D:x2-y2 D:yz P:y P:y D:z2 P:y S D:x2-y2 D:z2 S P:z S D:z2 P:z P:y D:z2 S S P:z S S D:z2 D:xy P:y P:y D:z2 D:yz -4.498 -4.498 -4.498 -4.498 -9.089 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1.33 4 5 5 3 8 6 6 9 8 7 9 4 7 3 10 16 25 18 8 17 3 27 14 W W W W W W W W W W W W W W W O O O W O W O O 1.180 0.00 335 A 7.50 7.39 4.75 4.69 4.24 3.93 3.36 2.36 1.88 1.83 1.80 1.66 1.63 1.58 1.57 1.46 1.42 1.28 1.23 1.23 1.22 1.18 1.18 1.15 1.10 1.09 1.09 1.05 1.04 1.04 1.04 2 2 3 3 1 1 1 2 1 1 3 2 1 2 3 1 1 3 3 1 1 1 2 1 3 1 1 3 1 2 3 S S S S D:z2 D:z2 D:z2 S D:z2 D:x2-y2 S S D:x2-y2 S S P:y D:yz S S D:yz D:xz D:xy S P:z S P:z D:x2-y2 S D:xy S S -5.688 -5.688 1.231 1.231 -4.498 -4.498 -4.498 -5.688 -4.498 -4.498 1.231 -5.688 -4.498 -5.688 1.231 -9.089 -4.498 1.231 1.231 -4.498 -4.498 -4.498 -5.688 -9.089 1.231 -9.089 -4.498 0.762 -4.498 -5.688 1.231 2.00 2.00 0.00 0.00 0.80 0.80 0.80 2.00 0.80 0.80 0.00 2.00 0.80 2.00 0.00 1.33 0.80 0.00 0.00 0.80 0.80 0.80 2.00 1.33 0.00 1.33 0.80 0.00 0.80 2.00 0.00 1 2 1 2 3 9 10 7 4 9 7 6 10 8 6 26 10 3 8 4 9 10 3 33 10 16 2 52 7 5 5 W W W W W W W W W W W W W W W O W W W W W W W O W O W Tc W W W 1.195 0.00 336 A 8.46 8.45 7.79 7.76 6.31 6.13 5.75 5.68 5.53 5.46 5.26 5.17 5.10 4.96 4.85 4.70 2.25 2.04 -1.36 -1.36 -1.19 -1.18 2 2 2 2 3 3 3 3 3 3 3 2 3 2 2 2 1 1 2 2 2 2 S S S S S S S S S S S S S S S S D:xz D:xy P:y P:y P:x P:x -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 1.231 -5.688 -5.688 -5.688 -4.498 -4.498 -1.119 -1.119 -0.500 -0.500 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 2.00 2.00 2.00 0.80 0.80 0.00 0.00 0.00 0.00 8 5 7 6 5 8 6 4 7 9 3 4 10 9 3 10 2 1 52 51 1 2 W W W W W W W W W W W W W W W W W W Tc Tc W W 1.330 0.00 337 A 8.77 7.15 5.90 4.21 3.04 2.65 2.28 2.08 1.99 1.99 1.89 1.85 1.83 1.79 1.67 1.65 1.38 1.38 1.37 1.28 1.17 1.16 1.11 1 1 1 1 1 1 1 1 1 1 1 2 2 1 2 2 1 1 1 1 1 1 1 D:xz D:xz D:xy D:xy D:yz D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:yz S S P:y S S D:z2 D:xz P:y D:xy D:z2 P:z P:y -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -5.688 -5.688 -9.089 -5.688 -5.688 -4.498 -4.498 -9.089 -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 2.00 2.00 1.33 2.00 2.00 0.80 0.80 1.33 0.80 0.80 1.33 1.33 2 1 1 2 5 6 5 6 8 7 7 3 4 18 9 10 8 8 48 7 4 18 12 W W W W W W W W W W W W W O W W W W O W W O O 1.427 0.00 338 A 10.11 7.65 7.47 7.39 6.80 6.74 6.62 6.58 5.95 5.88 5.02 -4.39 3.88 3.84 -3.61 3.36 3.33 3.22 3.21 2.98 2.98 1.90 2 2 2 2 2 2 2 2 2 2 3 2 3 3 2 3 3 3 3 3 3 3 S S S S S S S S S S S P:x S S P:x S S S S S S S -5.052 -5.052 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 0.762 -1.119 1.231 1.231 -1.119 1.231 1.231 1.231 1.231 1.231 1.231 0.762 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 51 10 9 3 4 6 5 7 8 52 52 6 5 51 7 8 10 9 4 3 51 Tc Tc W W W W W W W W Tc Tc W W Tc W W W W W W Tc 1.556 0.00 339 A 9.51 9.50 9.06 9.03 7.94 7.88 7.65 7.62 4.89 4.89 4.70 4.65 3.26 3.21 3.12 3.09 1.27 1.14 1.11 1.09 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 1 1 1 1 S S S S S S S S S S S S S S S S D:xz D:xz D:xy D:xy -5.688 -5.688 -5.688 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P:y P:y P:z -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -6.613 0.762 -9.089 -9.089 -13.975 -9.089 -9.089 -9.089 -4.498 -4.498 1.231 -6.613 -9.089 -6.613 -9.089 1.231 -9.089 -9.089 -9.089 0.80 0.80 1.00 0.80 0.80 0.80 0.80 0.80 1.33 1.00 0.00 1.33 1.33 2.00 1.33 1.33 1.33 0.80 0.80 0.00 1.00 1.33 1.00 1.33 0.00 1.33 1.33 1.33 8 1 52 5 6 7 2 2 50 51 51 45 13 53 39 36 19 7 1 7 52 42 52 22 8 38 22 37 W W Tc W W W W W O Tc Tc O O P O O O W W W Tc O Tc O W O O O 1.885 0.00 343 A 7.05 5.09 3.95 3.70 3.34 3.32 3.15 3.03 2.56 2.43 2.33 2.30 2.21 2.18 2.09 2.03 2.00 1.94 1.64 1.59 1.55 1.53 1.50 1.49 1.49 1.47 1.39 1.34 1.26 1.24 1.17 1.07 1.04 1.03 1.01 1.00 1.00 1 2 1 1 1 2 1 1 1 1 1 1 1 1 1 3 1 3 3 1 1 1 1 3 1 3 3 1 1 2 3 3 1 1 1 2 2 D:z2 P:y D:xy D:xz P:z P:z P:y D:x2-y2 D:xy D:xz D:z2 D:z2 D:x2-y2 P:y P:z S D:yz S S D:yz P:y D:z2 P:z S P:z S S P:y D:z2 P:z S S D:yz D:z2 D:z2 P:y S -4.498 -5.506 -4.498 -4.498 -9.089 -5.506 -9.089 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -9.089 -9.089 1.231 -4.498 1.231 1.231 -4.498 -9.089 -6.613 -9.089 1.231 -9.089 1.231 1.231 -9.089 -4.498 -0.500 1.231 1.231 -4.498 10.422 -4.498 -0.500 -5.688 0.80 1.00 0.80 0.80 1.33 1.00 1.33 0.80 0.80 0.80 0.80 1.00 0.80 1.33 1.33 0.00 0.80 0.00 0.00 0.80 1.33 1.00 1.33 0.00 1.33 0.00 0.00 1.33 0.80 0.00 0.00 0.00 0.80 0.00 0.80 0.00 2.00 3 53 4 9 16 53 25 4 10 3 9 52 10 26 33 4 2 3 10 1 47 51 23 9 41 5 6 29 4 3 7 8 4 53 10 4 3 W P W W O P O W W W W Tc W O O W W W W W O Tc O W O W W O W W W W W P W W W 1.951 0.00 344 A 6.44 6.10 3.87 3.40 2.62 2.53 2.47 2.38 2.29 2.24 1.73 1.69 1.69 1.62 1.59 1.51 1.50 1.49 1.42 1.27 1.16 1.15 1.14 1.13 1.11 1.09 1.09 1.08 1.05 1.02 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 3 1 1 1 1 1 3 1 3 1 1 2 1 D:z2 D:z2 D:x2-y2 D:z2 P:y D:z2 D:xz D:x2-y2 P:z D:xz P:z D:xz D:xy D:z2 P:y S D:xy S P:y D:xy D:xz D:yz D:yz S D:xy S P:y D:yz P:y P:z -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 -4.498 -9.089 1.231 -4.498 1.231 -9.089 -4.498 -4.498 -4.498 -4.498 1.231 -4.498 1.231 -9.089 -4.498 -0.500 -9.089 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 0.80 1.33 0.00 0.80 0.00 1.33 0.80 0.80 0.80 0.80 0.00 0.80 0.00 1.33 0.80 0.00 1.33 9 3 10 10 26 4 9 4 33 8 16 6 7 6 25 8 5 7 44 10 1 5 4 5 2 6 12 10 10 42 W W W W O W W W O W O W W W O W W W O W W W W W W W O W W O 2.065 0.00 345 A 4.59 3.96 3.63 3.25 3.13 3.09 2.75 2.41 2.35 2.19 2.09 2.08 2.04 2.02 1.80 1.71 1.68 1.59 1.46 1.45 1.18 1.15 1.15 1.13 1.09 1.08 1.07 1.06 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 D:x2-y2 D:xz D:x2-y2 D:xy D:x2-y2 D:x2-y2 D:z2 D:xz D:x2-y2 D:xz D:xz D:xz D:x2-y2 D:z2 D:xy D:xy D:yz D:z2 D:xz D:yz P:z D:xy P:z P:y P:y P:x D:xy D:xy 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 -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 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 1.33 1.33 1.33 1.33 0.80 0.80 1.33 3 9 6 4 9 8 5 8 4 3 7 10 10 4 10 5 7 7 6 5 23 7 14 17 31 41 3 6 47 W W W W W W W W W W W W W W W W W W W W O W O O O O W W O 2.255 0.00 346 A 5.45 5.31 4.73 4.72 3.69 3.22 2.75 2.72 2.68 2.51 2.44 2.39 2.35 2.26 2.08 1.94 1.92 1.86 1.82 1.79 1.63 1.55 1.42 1.41 1.39 1.33 -1.33 -1.33 1.24 1.24 1.09 1.09 1.08 1.01 2 2 3 3 2 1 1 1 3 1 1 1 1 1 1 1 3 1 1 1 3 1 1 1 1 1 2 2 1 1 1 1 1 1 S P:z S S P:y D:yz D:x2-y2 D:x2-y2 S D:z2 D:x2-y2 D:z2 D:yz D:x2-y2 D:z2 P:y S P:y D:yz D:yz S P:z P:y P:z D:x2-y2 D:z2 S S P:z D:xz P:y D:z2 D:xy D:xy -13.975 -5.506 1.231 1.231 -5.506 -4.498 -4.498 -4.498 0.762 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 0.762 -9.089 -4.498 -4.498 3.091 -9.089 -9.089 -9.089 -4.498 -4.498 -5.688 -5.688 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 2.00 1.00 0.00 0.00 1.00 0.80 0.80 0.80 0.00 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.00 1.33 0.80 0.80 0.00 1.33 1.33 1.33 0.80 0.80 2.00 2.00 1.33 0.80 1.33 0.80 0.80 0.80 53 53 2 1 53 1 3 8 51 5 6 4 2 2 7 45 52 31 5 7 53 28 17 22 9 8 1 2 14 10 22 10 4 3 P P W W P W W W Tc W W W W W W O Tc O W W P O O O W W W W O W O W W W 2.312 0.00 347 A 14.73 6.41 4.78 3.87 3.84 3.45 3.44 3.44 2.89 2.60 2.46 2.02 1.94 1.92 1.87 1.87 1.86 1.72 1.67 1.64 1.45 -1.20 -1.19 -1.19 -1.19 1.16 1.06 1.03 2 1 1 3 3 3 3 1 1 1 1 1 1 1 3 1 3 1 3 3 1 2 2 2 2 1 1 1 P:x D:xz D:xy S S S S D:xz D:xz D:x2-y2 D:xy D:xz D:x2-y2 D:xy S D:x2-y2 S D:xy S S D:xz S S S S D:z2 P:x P:x -5.506 -4.498 -4.498 1.231 1.231 1.231 1.231 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 -4.498 1.231 -4.498 1.231 1.231 -4.498 -5.688 -5.688 -5.688 -5.688 -4.498 -9.089 -9.089 1.00 0.80 0.80 0.00 0.00 0.00 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.80 0.00 0.80 0.00 0.00 0.80 2.00 2.00 2.00 2.00 0.80 1.33 1.33 53 2 1 9 10 3 4 1 8 10 5 6 9 7 7 4 8 2 5 6 9 3 4 9 10 6 40 43 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 W O O