ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 10:16:34 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.33 0.02 0.37 1 2 3 1 1.000 0.000 0.000 0.000 -6.493 2.471 41.409 11.031 S S S P S S P S 1 2 1 3 1.00 0.00 0.00 0.00 -6.4931 2.4706 11.0309 41.4090 1 H -0.0000 1.0000 0.0000 0.0000 0.0000 Apr20-2024 10:16:34 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 10:16:35 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.56 0.02 0.61 1 2 3 4 5 1 2 3 4 5 1 2.000 2.000 0.000 0.000 0.000 6.000 2.000 0.000 0.000 0.000 0.000 -139.491 -10.820 3.478 40.665 286.501 -95.429 -4.086 1.767 16.978 215.955 10.038 S S S S S P P P P P D S P S P P S D P S P S 1 1 2 2 3 3 1 4 4 5 5 2.00 6.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -139.4907 -95.4288 -10.8205 -4.0856 1.7668 3.4780 10.0377 16.9776 40.6653 215.9554 286.5008 1 Si -0.0000 4.0000 8.0000 0.0000 0.0000 Apr20-2024 10:16:34 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 0 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 Silicon (TZP, 1s frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 10:16:36 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.68 0.02 0.74 1 2 3 4 5 1 2 3 4 1 2 3 2.000 1.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 5.000 0.000 0.000 -64.342 -4.108 0.830 10.873 76.897 -38.592 -0.555 16.632 109.646 -3.733 3.575 29.703 S S S S S P P P P D D D S P S D P S D S P D S P 1 1 2 1 2 3 2 4 3 3 5 4 2.00 6.00 1.00 5.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -64.3424 -38.5925 -4.1076 -3.7334 -0.5546 0.8297 3.5751 10.8726 16.6324 29.7028 76.8968 109.6456 1 Mo 0.0000 3.0000 6.0000 5.0000 0.0000 Apr20-2024 10:16:34 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 0 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 Silicon (TZP, 1s frozen) 0 Apr20-2024 10:16:36 Nodes: 1 Procs: 1 Apr20-2024 10:16:36 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 10:16:37 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.41 0.03 0.47 1 2 3 1 2 3 1 2.000 0.000 0.000 4.000 0.000 0.000 0.000 -24.020 24.654 804.880 -9.089 9.585 104.336 29.005 S S S P P P D S P P S D P S 1 1 2 2 1 3 3 2.00 4.00 0.00 0.00 0.00 0.00 0.00 -24.0201 -9.0888 9.5852 24.6539 29.0045 104.3364 804.8804 1 O -0.0000 2.0000 4.0000 0.0000 0.0000 Apr20-2024 10:16:34 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 0 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 Silicon (TZP, 1s frozen) 0 Apr20-2024 10:16:36 Nodes: 1 Procs: 1 Apr20-2024 10:16:36 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Apr20-2024 10:16:37 Nodes: 1 Procs: 1 Apr20-2024 10:16:37 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 10:16:38 Hydrogen (TZP) kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 kimik2219 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.18 0.04 1.27 1 2 3 4 5 6 1 2 3 4 1 2 3 1 2 3 2.000 2.000 0.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 4.000 0.000 0.000 14.000 0.000 0.000 -78.652 -5.688 1.231 15.256 90.545 82874.614 -43.195 -0.500 20.662 126.921 -4.498 4.055 33.318 -33.668 62.370 473.510 S S S S S S P P P P D D D F F F S P F S D P S D S P D F S P F S 1 1 1 2 1 2 3 2 4 3 3 2 5 4 3 6 2.00 6.00 14.00 2.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -78.6522 -43.1946 -33.6680 -5.6882 -4.4976 -0.5002 1.2309 4.0549 15.2562 20.6620 33.3183 62.3697 90.5446 126.9207 473.5096 82874.6143 1 W -0.0000 4.0000 6.0000 4.0000 14.0000 Apr20-2024 10:16:34 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 0 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 Silicon (TZP, 1s frozen) 0 Apr20-2024 10:16:36 Nodes: 1 Procs: 1 Apr20-2024 10:16:36 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Apr20-2024 10:16:37 Nodes: 1 Procs: 1 Apr20-2024 10:16:37 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Apr20-2024 10:16:38 Nodes: 1 Procs: 1 Apr20-2024 10:16:39 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 10:16:41 Hydrogen (TZP) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP TZP 2586.4021000000043 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0.230575 -3.753576 3.708116 -0.199700 -3.824133 -3.622340 0.243434 -3.791713 0.325107 -3.586731 -3.714169 -0.196437 3.791463 3.687825 0.196738 3.760154 -0.546550 -3.394484 -1.282962 1 3 -3 0.099541 -2.577173 2.550216 Rho 0.1240650E+06 3,-3 2 3 -3 -0.064594 -0.041746 -0.040607 Rho 0.1943313E+04 3,-3 3 3 -3 0.125542 2.494716 -2.485854 Rho 0.4361414E+07 3,-3 4 3 -3 -0.096833 2.548387 2.477514 Rho 0.4361414E+07 3,-3 5 3 -3 2.383612 -2.585606 0.008584 Rho 0.4361414E+07 3,-3 6 3 -3 2.595620 2.490979 -0.153137 Rho 0.4361415E+07 3,-3 7 3 -3 -2.564058 2.449726 0.090295 Rho 0.4361414E+07 3,-3 8 3 -3 -2.560631 -2.470980 -0.131527 Rho 0.4361414E+07 3,-3 9 3 -3 -2.423069 -0.290846 -2.657229 Rho 0.4361414E+07 3,-3 10 3 -3 -2.492032 0.140958 2.587060 Rho 0.4361414E+07 3,-3 11 3 -3 2.508196 -0.163626 2.519208 Rho 0.4361415E+07 3,-3 12 3 -3 2.432152 -0.017271 -2.632221 Rho 0.4361415E+07 3,-3 13 3 -3 0.908559 -1.007444 0.889841 Rho 0.3186785E+03 3,-3 14 3 -3 -1.113446 -0.923963 -0.942076 Rho 0.3186373E+03 3,-3 15 3 -3 0.921492 0.887746 -1.004067 Rho 0.3186791E+03 3,-3 16 3 -3 -0.945538 0.951176 0.965557 Rho 0.3186677E+03 3,-3 17 3 -3 -3.000073 -1.118038 1.175606 Rho 0.3188783E+03 3,-3 18 3 -3 2.958118 -1.160451 -1.150420 Rho 0.3188199E+03 3,-3 19 3 -3 -3.025031 1.147749 -1.086699 Rho 0.3190340E+03 3,-3 20 3 -3 2.997378 1.159592 1.179151 Rho 0.3188462E+03 3,-3 21 3 -3 1.302118 -1.155148 -3.329060 Rho 0.3193294E+03 3,-3 22 3 -3 1.096541 1.119595 2.977092 Rho 0.3188753E+03 3,-3 23 3 -3 -1.121696 1.122999 -2.987468 Rho 0.3188312E+03 3,-3 24 3 -3 -1.158633 -1.130453 3.059238 Rho 0.3189374E+03 3,-3 25 3 -3 -1.130793 2.999816 -1.105563 Rho 0.3188611E+03 3,-3 26 3 -3 -1.187053 -2.986552 1.223068 Rho 0.3189655E+03 3,-3 27 3 -3 1.143524 3.007202 1.136477 Rho 0.3188888E+03 3,-3 28 3 -3 1.140750 -3.243064 -1.074902 Rho 0.3192035E+03 3,-3 29 3 -3 3.371364 -1.506998 1.554370 Rho 0.3190079E+03 3,-3 30 3 -3 -3.466396 -1.590866 -1.564396 Rho 0.3189358E+03 3,-3 31 3 -3 3.453739 1.550541 -1.475140 Rho 0.3190449E+03 3,-3 32 3 -3 -3.436847 1.518319 1.580074 Rho 0.3189375E+03 3,-3 33 3 -3 1.462622 -1.497390 3.466282 Rho 0.3189960E+03 3,-3 34 3 -3 1.545934 1.569060 -3.416838 Rho 0.3189268E+03 3,-3 35 3 -3 -1.514743 1.535220 3.463928 Rho 0.3189492E+03 3,-3 36 3 -3 -1.764136 -1.478069 -3.767874 Rho 0.3192694E+03 3,-3 37 3 -3 -1.526620 -3.626538 -1.288081 Rho 0.3187210E+03 3,-3 38 3 -3 -1.523356 3.414151 1.543306 Rho 0.3189583E+03 3,-3 39 3 -3 1.514509 -3.444583 1.606784 Rho 0.3190205E+03 3,-3 40 3 -3 1.507095 3.430241 -1.472580 Rho 0.3189314E+03 3,-3 41 3 -3 -0.245654 -3.748980 3.787863 Rho 0.3194097E+03 3,-3 42 3 -3 3.832027 -0.151614 -3.693018 Rho 0.3192183E+03 3,-3 43 3 -3 -0.217115 3.721757 -3.684417 Rho 0.3192782E+03 3,-3 44 3 -3 0.248396 3.740476 3.714605 Rho 0.3192559E+03 3,-3 45 3 -3 3.719148 -3.716806 -0.174875 Rho 0.3192311E+03 3,-3 46 3 -3 3.761187 3.737797 0.230575 Rho 0.3192638E+03 3,-3 47 3 -3 -3.753576 3.708116 -0.199700 Rho 0.3192435E+03 3,-3 48 3 -3 -3.824133 -3.622340 0.243434 Rho 0.3192808E+03 3,-3 49 3 -3 -3.791713 0.325107 -3.586731 Rho 0.3192155E+03 3,-3 50 3 -3 -3.714169 -0.196437 3.791463 Rho 0.3192741E+03 3,-3 51 3 -3 3.687825 0.196738 3.760154 Rho 0.3192663E+03 3,-3 52 3 -3 -0.546550 -3.394484 -1.282962 Rho 0.4286420E+00 3,-3 53 3 -1 -3.025932 -1.992876 -0.898029 Rho 0.1561616E+00 |GRAD(Rho)| 0.4524282E-13 GRAD(Rho)x -0.1562091E-13 GRAD(Rho)y -0.3441552E-13 GRAD(Rho)z 0.2486910E-13 Laplacian 0.6068073E+00 (-1/4)Del**2(Rho)) -0.1517018E+00 Diamond 0.1301109E+01 Metallicity 0.5142640E+01 Ellipticity 0.7700948E-01 Gb(Abramov) 0.2311592E+00 Vb(Abramov) -0.3106166E+00 Hb(Abramov) -0.7945737E-01 Ex_ueg -0.6210846E-01 Ec_ueg -0.8839105E-02 Delta_ex -0.6591428E-01 Delta_ec 0.1541894E-01 Delta_et -0.2068128E+00 Pxc 0.7026555E+01 Qxc -0.4274889E+01 3,-1 54 3 -1 -2.776861 -1.748737 0.567013 Rho 0.1431134E+00 |GRAD(Rho)| 0.1146390E-15 GRAD(Rho)x -0.4591596E-16 GRAD(Rho)y -0.1050185E-15 GRAD(Rho)z -0.2222614E-17 Laplacian 0.5995504E+00 (-1/4)Del**2(Rho)) -0.1498876E+00 Diamond 0.1149668E+01 Metallicity 0.4500437E+01 Ellipticity 0.1698710E-01 Gb(Abramov) 0.2123517E+00 Vb(Abramov) -0.2748158E+00 Hb(Abramov) -0.6246409E-01 Ex_ueg -0.5528732E-01 Ec_ueg -0.8004141E-02 Delta_ex -0.6366330E-01 Delta_ec 0.1541528E-01 Delta_et -0.2038880E+00 Pxc 0.6907339E+01 Qxc -0.4129883E+01 3,-1 55 3 +1 0.185261 -0.228909 2.969194 Rho 0.6068877E-02 |GRAD(Rho)| 0.7328099E-11 GRAD(Rho)x -0.7169228E-11 GRAD(Rho)y -0.1235296E-11 GRAD(Rho)z 0.8816138E-12 Laplacian 0.2559857E-01 (-1/4)Del**2(Rho)) -0.6399643E-02 Diamond 0.6675589E-03 Metallicity 0.5435564E+00 Ellipticity -0.1949987E+01 Gb(Abramov) 0.4846190E-02 Vb(Abramov) -0.3292737E-02 Hb(Abramov) 0.1553453E-02 Ex_ueg -0.8175785E-03 Ec_ueg -0.1931970E-03 Delta_ex -0.1245104E-02 Delta_ec 0.6689110E-03 Delta_et -0.3903925E-02 Pxc 0.4231838E+01 Qxc -0.1861389E+01 3,+1 56 3 +1 -0.520097 -0.554297 1.688302 Rho 0.8240997E-02 |GRAD(Rho)| 0.2155945E-15 GRAD(Rho)x 0.1955752E-15 GRAD(Rho)y -0.8473213E-16 GRAD(Rho)z 0.3243152E-16 Laplacian 0.3264751E-01 (-1/4)Del**2(Rho)) -0.8161877E-02 Diamond 0.8140626E-03 Metallicity 0.7096802E+00 Ellipticity -0.1399114E+01 Gb(Abramov) 0.6406639E-02 Vb(Abramov) -0.4651400E-02 Hb(Abramov) 0.1755239E-02 Ex_ueg -0.1229395E-02 Ec_ueg -0.2889461E-03 Delta_ex -0.1470564E-02 Delta_ec 0.4506202E-03 Delta_et -0.3053565E-02 Pxc 0.4254756E+01 Qxc -0.3263422E+01 3,+1 57 3 -1 -2.726784 0.462381 -1.827307 Rho 0.7128558E-01 |GRAD(Rho)| 0.2045238E-14 GRAD(Rho)x 0.4816594E-15 GRAD(Rho)y -0.1417625E-14 GRAD(Rho)z -0.1393320E-14 Laplacian 0.2972664E+00 (-1/4)Del**2(Rho)) -0.7431660E-01 Diamond 0.2451502E+00 Metallicity 0.2840993E+01 Ellipticity 0.5864975E-02 Gb(Abramov) 0.8473323E-01 Vb(Abramov) -0.9514985E-01 Hb(Abramov) -0.1041663E-01 Ex_ueg -0.2183001E-01 Ec_ueg -0.3621492E-02 Delta_ex -0.2681420E-01 Delta_ec 0.8885280E-02 Delta_et -0.1025300E+00 Pxc 0.6027906E+01 Qxc -0.3017823E+01 3,-1 58 3 +1 -2.265344 -1.209726 -1.303769 Rho 0.3311834E-01 |GRAD(Rho)| 0.2768031E-16 GRAD(Rho)x 0.1172869E-16 GRAD(Rho)y 0.1366532E-16 GRAD(Rho)z 0.2102133E-16 Laplacian 0.1341445E+00 (-1/4)Del**2(Rho)) -0.3353612E-01 Diamond 0.2460073E-01 Metallicity 0.1754505E+01 Ellipticity -0.3972956E+01 Gb(Abramov) 0.3216396E-01 Vb(Abramov) -0.3079180E-01 Hb(Abramov) 0.1372159E-02 Ex_ueg -0.7854944E-02 Ec_ueg -0.1505548E-02 Delta_ex -0.8906626E-02 Delta_ec 0.2109989E-02 Delta_et -0.1991692E-01 Pxc 0.5217332E+01 Qxc -0.4221171E+01 3,+1 59 3 +1 -2.791915 -0.224984 -0.221240 Rho 0.5848163E-02 |GRAD(Rho)| 0.4939700E-17 GRAD(Rho)x 0.5178482E-18 GRAD(Rho)y -0.4790501E-17 GRAD(Rho)z -0.1087921E-17 Laplacian 0.2422237E-01 (-1/4)Del**2(Rho)) -0.6055593E-02 Diamond 0.5027749E-03 Metallicity 0.5400438E+00 Ellipticity -0.1341573E+01 Gb(Abramov) 0.4582110E-02 Vb(Abramov) -0.3108626E-02 Hb(Abramov) 0.1473483E-02 Ex_ueg -0.7781758E-03 Ec_ueg -0.1835934E-03 Delta_ex -0.1095083E-02 Delta_ec 0.5009384E-03 Delta_et -0.2955054E-02 Pxc 0.4238583E+01 Qxc -0.2186064E+01 3,+1 60 3 +3 -2.371559 0.058201 0.086439 Rho 0.5387676E-02 |GRAD(Rho)| 0.6819251E-17 GRAD(Rho)x 0.7214107E-18 GRAD(Rho)y -0.2119535E-17 GRAD(Rho)z -0.6441221E-17 Laplacian 0.2274021E-01 (-1/4)Del**2(Rho)) -0.5685054E-02 Diamond 0.2490681E-03 Metallicity 0.5017504E+00 Ellipticity -0.2431795E+00 Gb(Abramov) 0.4265449E-02 Vb(Abramov) -0.2845844E-02 Hb(Abramov) 0.1419605E-02 Ex_ueg -0.6975688E-03 Ec_ueg -0.1636340E-03 Delta_ex -0.8636431E-03 Delta_ec 0.2099474E-03 Delta_et -0.1368825E-02 Pxc 0.4262981E+01 Qxc -0.4113616E+01 3,+3 61 3 +1 -2.921211 0.157618 0.194933 Rho 0.6124335E-02 |GRAD(Rho)| 0.2364866E-12 GRAD(Rho)x -0.6748396E-13 GRAD(Rho)y 0.1599054E-12 GRAD(Rho)z 0.1606304E-12 Laplacian 0.2537558E-01 (-1/4)Del**2(Rho)) -0.6343895E-02 Diamond 0.7738353E-03 Metallicity 0.5567097E+00 Ellipticity -0.4842152E+01 Gb(Abramov) 0.4817881E-02 Vb(Abramov) -0.3291868E-02 Hb(Abramov) 0.1526014E-02 Ex_ueg -0.8275552E-03 Ec_ueg -0.1956138E-03 Delta_ex -0.1310264E-02 Delta_ec 0.7945529E-03 Delta_et -0.4587290E-02 Pxc 0.4230556E+01 Qxc -0.1649058E+01 3,+1 62 3 +1 -1.757948 -1.721888 1.799204 Rho 0.1227468E-01 |GRAD(Rho)| 0.6581624E-17 GRAD(Rho)x -0.1505416E-17 GRAD(Rho)y 0.2602826E-17 GRAD(Rho)z -0.5854639E-17 Laplacian 0.6140807E-01 (-1/4)Del**2(Rho)) -0.1535202E-01 Diamond 0.2512160E-02 Metallicity 0.7329453E+00 Ellipticity -0.1249273E+01 Gb(Abramov) 0.1211004E-01 Vb(Abramov) -0.8868069E-02 Hb(Abramov) 0.3241974E-02 Ex_ueg -0.2091216E-02 Ec_ueg -0.4722642E-03 Delta_ex -0.3029261E-02 Delta_ec 0.7840324E-03 Delta_et -0.5921435E-02 Pxc 0.4428063E+01 Qxc -0.3863694E+01 3,+1 63 3 +1 -0.263055 -0.934803 -2.592112 Rho 0.3411056E-02 |GRAD(Rho)| 0.1444816E-16 GRAD(Rho)x 0.1353343E-16 GRAD(Rho)y -0.5059010E-17 GRAD(Rho)z -0.4502510E-19 Laplacian 0.1349552E-01 (-1/4)Del**2(Rho)) -0.3373881E-02 Diamond 0.1408635E-03 Metallicity 0.3946737E+00 Ellipticity -0.1315959E+01 Gb(Abramov) 0.2471184E-02 Vb(Abramov) -0.1568488E-02 Hb(Abramov) 0.9026966E-03 Ex_ueg -0.3792308E-03 Ec_ueg -0.7918831E-04 Delta_ex -0.5512169E-03 Delta_ec 0.2939338E-03 Delta_et -0.1476771E-02 Pxc 0.4788974E+01 Qxc -0.1875310E+01 3,+1 64 3 -1 -1.734919 -0.596395 -1.759116 Rho 0.6746988E-01 |GRAD(Rho)| 0.3201229E-16 GRAD(Rho)x -0.9120004E-17 GRAD(Rho)y 0.9115345E-17 GRAD(Rho)z 0.2930056E-16 Laplacian 0.2638945E+00 (-1/4)Del**2(Rho)) -0.6597362E-01 Diamond 0.1984008E+00 Metallicity 0.2919888E+01 Ellipticity 0.3112173E-01 Gb(Abramov) 0.7608834E-01 Vb(Abramov) -0.8620306E-01 Hb(Abramov) -0.1011472E-01 Ex_ueg -0.2028609E-01 Ec_ueg -0.3401165E-02 Delta_ex -0.2336677E-01 Delta_ec 0.7708218E-02 Delta_et -0.8764214E-01 Pxc 0.5964454E+01 Qxc -0.3031410E+01 3,-1 65 3 +1 -1.715698 -0.457723 0.566389 Rho 0.9784662E-02 |GRAD(Rho)| 0.1603901E-13 GRAD(Rho)x -0.1259065E-13 GRAD(Rho)y -0.7047316E-14 GRAD(Rho)z 0.7004345E-14 Laplacian 0.3992908E-01 (-1/4)Del**2(Rho)) -0.9982270E-02 Diamond 0.1225711E-02 Metallicity 0.7725031E+00 Ellipticity -0.1406849E+01 Gb(Abramov) 0.7940069E-02 Vb(Abramov) -0.5897868E-02 Hb(Abramov) 0.2042201E-02 Ex_ueg -0.1545656E-02 Ec_ueg -0.3582921E-03 Delta_ex -0.1866641E-02 Delta_ec 0.5289954E-03 Delta_et -0.3762659E-02 Pxc 0.4313955E+01 Qxc -0.3528653E+01 3,+1 66 3 +3 -1.094035 -1.093075 1.153913 Rho 0.5077121E-02 |GRAD(Rho)| 0.5384157E-17 GRAD(Rho)x 0.2729418E-17 GRAD(Rho)y 0.2285560E-17 GRAD(Rho)z -0.4039262E-17 Laplacian 0.2006488E-01 (-1/4)Del**2(Rho)) -0.5016219E-02 Diamond 0.1419102E-03 Metallicity 0.5150774E+00 Ellipticity -0.1076434E+00 Gb(Abramov) 0.3774770E-02 Vb(Abramov) -0.2533320E-02 Hb(Abramov) 0.1241450E-02 Ex_ueg -0.6444784E-03 Ec_ueg -0.1502331E-03 Delta_ex -0.6951085E-03 Delta_ec 0.8647250E-04 Delta_et -0.6918908E-03 Pxc 0.4289856E+01 Qxc -0.8038492E+01 3,+3 67 3 -1 -1.777180 -0.539713 2.820723 Rho 0.1544435E+00 |GRAD(Rho)| 0.5013923E-15 GRAD(Rho)x 0.3658640E-15 GRAD(Rho)y -0.3172918E-15 GRAD(Rho)z 0.1298603E-15 Laplacian 0.6489835E+00 (-1/4)Del**2(Rho)) -0.1622459E+00 Diamond 0.1359025E+01 Metallicity 0.4720580E+01 Ellipticity 0.2295046E-01 Gb(Abramov) 0.2358130E+00 Vb(Abramov) -0.3093802E+00 Hb(Abramov) -0.7356715E-01 Ex_ueg -0.6119901E-01 Ec_ueg -0.8728563E-02 Delta_ex -0.7016820E-01 Delta_ec 0.1629419E-01 Delta_et -0.2176481E+00 Pxc 0.7011350E+01 Qxc -0.4306331E+01 3,-1 68 3 +1 -0.251181 -0.466062 -3.178749 Rho 0.3845545E-02 |GRAD(Rho)| 0.4272309E-17 GRAD(Rho)x 0.3598699E-18 GRAD(Rho)y -0.3114567E-17 GRAD(Rho)z -0.2902170E-17 Laplacian 0.1528123E-01 (-1/4)Del**2(Rho)) -0.3820308E-02 Diamond 0.2073314E-03 Metallicity 0.4256486E+00 Ellipticity -0.1575564E+01 Gb(Abramov) 0.2817890E-02 Vb(Abramov) -0.1815472E-02 Hb(Abramov) 0.1002418E-02 Ex_ueg -0.4449681E-03 Ec_ueg -0.9757526E-04 Delta_ex -0.6661390E-03 Delta_ec 0.3797122E-03 Delta_et -0.1947291E-02 Pxc 0.4560255E+01 Qxc -0.1754326E+01 3,+1 69 3 +3 -0.180283 -0.545403 -2.558880 Rho 0.3328109E-02 |GRAD(Rho)| 0.4355444E-15 GRAD(Rho)x -0.2415252E-15 GRAD(Rho)y 0.3520728E-15 GRAD(Rho)z -0.8607693E-16 Laplacian 0.1324378E-01 (-1/4)Del**2(Rho)) -0.3310945E-02 Diamond 0.1112367E-03 Metallicity 0.3860087E+00 Ellipticity -0.8270545E+00 Gb(Abramov) 0.2420306E-02 Vb(Abramov) -0.1529666E-02 Hb(Abramov) 0.8906394E-03 Ex_ueg -0.3669851E-03 Ec_ueg -0.7568963E-04 Delta_ex -0.5022547E-03 Delta_ec 0.2242646E-03 Delta_et -0.1157185E-02 Pxc 0.4848552E+01 Qxc -0.2239563E+01 3,+3 70 3 -1 -1.799305 -1.660804 -0.529053 Rho 0.6521983E-01 |GRAD(Rho)| 0.9988028E-16 GRAD(Rho)x -0.3324689E-16 GRAD(Rho)y -0.8506074E-16 GRAD(Rho)z 0.4043989E-16 Laplacian 0.2539314E+00 (-1/4)Del**2(Rho)) -0.6348286E-01 Diamond 0.1808577E+00 Metallicity 0.2867672E+01 Ellipticity 0.1751377E-01 Gb(Abramov) 0.7266324E-01 Vb(Abramov) -0.8184362E-01 Hb(Abramov) -0.9180380E-02 Ex_ueg -0.1938911E-01 Ec_ueg -0.3272004E-02 Delta_ex -0.2224511E-01 Delta_ec 0.7341090E-02 Delta_et -0.8272890E-01 Pxc 0.5925760E+01 Qxc -0.3030219E+01 3,-1 71 3 +3 -1.132376 1.087413 -1.107757 Rho 0.5279116E-02 |GRAD(Rho)| 0.7272250E-17 GRAD(Rho)x -0.7172205E-17 GRAD(Rho)y -0.4724103E-18 GRAD(Rho)z 0.1105410E-17 Laplacian 0.2091333E-01 (-1/4)Del**2(Rho)) -0.5228334E-02 Diamond 0.1522595E-03 Metallicity 0.5273820E+00 Ellipticity -0.1532971E+00 Gb(Abramov) 0.3945111E-02 Vb(Abramov) -0.2661887E-02 Hb(Abramov) 0.1283223E-02 Ex_ueg -0.6788910E-03 Ec_ueg -0.1589440E-03 Delta_ex -0.7291582E-03 Delta_ec 0.8430081E-04 Delta_et -0.6960393E-03 Pxc 0.4271258E+01 Qxc -0.8649481E+01 3,+3 72 3 +1 -1.184067 1.266643 2.194161 Rho 0.2798559E-01 |GRAD(Rho)| 0.6017642E-16 GRAD(Rho)x 0.1795212E-16 GRAD(Rho)y -0.2564540E-17 GRAD(Rho)z -0.5737897E-16 Laplacian 0.1065859E+00 (-1/4)Del**2(Rho)) -0.2664649E-01 Diamond 0.1546731E-01 Metallicity 0.1667775E+01 Ellipticity -0.3746382E+01 Gb(Abramov) 0.2517105E-01 Vb(Abramov) -0.2369561E-01 Hb(Abramov) 0.1475439E-02 Ex_ueg -0.6275250E-02 Ec_ueg -0.1240178E-02 Delta_ex -0.6756334E-02 Delta_ec 0.1672517E-02 Delta_et -0.1519277E-01 Pxc 0.5059961E+01 Qxc -0.4039622E+01 3,+1 73 3 +1 -1.726220 0.537060 -0.456838 Rho 0.9992264E-02 |GRAD(Rho)| 0.5057661E-14 GRAD(Rho)x -0.6450005E-15 GRAD(Rho)y -0.3457054E-14 GRAD(Rho)z -0.3634927E-14 Laplacian 0.4018818E-01 (-1/4)Del**2(Rho)) -0.1004705E-01 Diamond 0.1257179E-02 Metallicity 0.7948552E+00 Ellipticity -0.1420469E+01 Gb(Abramov) 0.8029021E-02 Vb(Abramov) -0.6010997E-02 Hb(Abramov) 0.2018024E-02 Ex_ueg -0.1589536E-02 Ec_ueg -0.3676967E-03 Delta_ex -0.1884416E-02 Delta_ec 0.5242596E-03 Delta_et -0.3755313E-02 Pxc 0.4322953E+01 Qxc -0.3594433E+01 3,+1 74 3 +1 -0.567163 0.471148 -1.668578 Rho 0.9618367E-02 |GRAD(Rho)| 0.1092839E-16 GRAD(Rho)x 0.1033257E-16 GRAD(Rho)y 0.2573061E-18 GRAD(Rho)z 0.3549842E-17 Laplacian 0.3939170E-01 (-1/4)Del**2(Rho)) -0.9847925E-02 Diamond 0.1192949E-02 Metallicity 0.7609872E+00 Ellipticity -0.1407165E+01 Gb(Abramov) 0.7814307E-02 Vb(Abramov) -0.5780690E-02 Hb(Abramov) 0.2033617E-02 Ex_ueg -0.1510730E-02 Ec_ueg -0.3507719E-03 Delta_ex -0.1837932E-02 Delta_ec 0.5300042E-03 Delta_et -0.3746915E-02 Pxc 0.4306873E+01 Qxc -0.3467769E+01 3,+1 75 3 -1 -0.426144 0.368447 0.375181 Rho 0.1346329E+00 |GRAD(Rho)| 0.2670003E-15 GRAD(Rho)x -0.2077806E-15 GRAD(Rho)y 0.1178502E-15 GRAD(Rho)z 0.1192800E-15 Laplacian 0.6953481E+00 (-1/4)Del**2(Rho)) -0.1738370E+00 Diamond 0.1490774E+01 Metallicity 0.3504798E+01 Ellipticity 0.3744560E-02 Gb(Abramov) 0.2174353E+00 Vb(Abramov) -0.2610336E+00 Hb(Abramov) -0.4359827E-01 Ex_ueg -0.5096281E-01 Ec_ueg -0.7467180E-02 Delta_ex -0.7564339E-01 Delta_ec 0.2331705E-01 Delta_et -0.3156892E+00 Pxc 0.6824907E+01 Qxc -0.3244123E+01 3,-1 76 3 -1 0.497483 -1.763733 1.693049 Rho 0.4344776E-01 |GRAD(Rho)| 0.9206755E-16 GRAD(Rho)x -0.3002414E-16 GRAD(Rho)y -0.5680775E-16 GRAD(Rho)z 0.6593834E-16 Laplacian 0.1698927E+00 (-1/4)Del**2(Rho)) -0.4247317E-01 Diamond 0.7103047E-01 Metallicity 0.2177965E+01 Ellipticity 0.6008677E-02 Gb(Abramov) 0.4373295E-01 Vb(Abramov) -0.4499274E-01 Hb(Abramov) -0.1259787E-02 Ex_ueg -0.1128084E-01 Ec_ueg -0.2056027E-02 Delta_ex -0.1349447E-01 Delta_ec 0.5056001E-02 Delta_et -0.5137235E-01 Pxc 0.5486720E+01 Qxc -0.2669001E+01 3,-1 77 3 -1 -0.074493 0.037859 2.950787 Rho 0.6250487E-02 |GRAD(Rho)| 0.2945712E-14 GRAD(Rho)x 0.2080830E-14 GRAD(Rho)y -0.1931233E-14 GRAD(Rho)z 0.7859446E-15 Laplacian 0.2528667E-01 (-1/4)Del**2(Rho)) -0.6321667E-02 Diamond 0.9157188E-03 Metallicity 0.5779780E+00 Ellipticity 0.2218172E+01 Gb(Abramov) 0.4823409E-02 Vb(Abramov) -0.3325151E-02 Hb(Abramov) 0.1498258E-02 Ex_ueg -0.8503614E-03 Ec_ueg -0.2011170E-03 Delta_ex -0.1395900E-02 Delta_ec 0.9433590E-03 Delta_et -0.5419984E-02 Pxc 0.4228192E+01 Qxc -0.1479712E+01 3,-1 78 3 +3 0.014997 -0.080622 2.262803 Rho 0.4897490E-02 |GRAD(Rho)| 0.8267949E-17 GRAD(Rho)x -0.7839845E-17 GRAD(Rho)y -0.7401130E-18 GRAD(Rho)z 0.2519533E-17 Laplacian 0.2028572E-01 (-1/4)Del**2(Rho)) -0.5071431E-02 Diamond 0.1740457E-03 Metallicity 0.4797834E+00 Ellipticity -0.3541416E+00 Gb(Abramov) 0.3786485E-02 Vb(Abramov) -0.2501540E-02 Hb(Abramov) 0.1284946E-02 Ex_ueg -0.6142565E-03 Ec_ueg -0.1425040E-03 Delta_ex -0.7315364E-03 Delta_ec 0.1513055E-03 Delta_et -0.1014145E-02 Pxc 0.4310450E+01 Qxc -0.4834831E+01 3,+3 79 3 +1 -0.214346 0.182739 2.939816 Rho 0.6216288E-02 |GRAD(Rho)| 0.1428184E-15 GRAD(Rho)x -0.9723539E-16 GRAD(Rho)y 0.9952801E-16 GRAD(Rho)z 0.3219545E-16 Laplacian 0.2593945E-01 (-1/4)Del**2(Rho)) -0.6484863E-02 Diamond 0.7607535E-03 Metallicity 0.5583042E+00 Ellipticity -0.2830902E+01 Gb(Abramov) 0.4926663E-02 Vb(Abramov) -0.3368463E-02 Hb(Abramov) 0.1558200E-02 Ex_ueg -0.8441635E-03 Ec_ueg -0.1996244E-03 Delta_ex -0.1311201E-02 Delta_ec 0.7547806E-03 Delta_et -0.4399759E-02 Pxc 0.4228760E+01 Qxc -0.1737195E+01 3,+1 80 3 +1 -0.523439 1.639639 -0.521694 Rho 0.9085124E-02 |GRAD(Rho)| 0.4183891E-16 GRAD(Rho)x 0.2990622E-16 GRAD(Rho)y -0.2841242E-16 GRAD(Rho)z 0.6989043E-17 Laplacian 0.3596727E-01 (-1/4)Del**2(Rho)) -0.8991817E-02 Diamond 0.9857643E-03 Metallicity 0.7578625E+00 Ellipticity -0.1397393E+01 Gb(Abramov) 0.7130305E-02 Vb(Abramov) -0.5268793E-02 Hb(Abramov) 0.1861512E-02 Ex_ueg -0.1400101E-02 Ec_ueg -0.3267378E-03 Delta_ex -0.1644582E-02 Delta_ec 0.4675781E-03 Delta_et -0.3271968E-02 Pxc 0.4285092E+01 Qxc -0.3517234E+01 3,+1 81 3 +3 0.046431 2.251323 -0.018482 Rho 0.4919900E-02 |GRAD(Rho)| 0.3438272E-17 GRAD(Rho)x 0.9600666E-18 GRAD(Rho)y 0.3257043E-17 GRAD(Rho)z -0.5400526E-18 Laplacian 0.2044070E-01 (-1/4)Del**2(Rho)) -0.5110174E-02 Diamond 0.1776017E-03 Metallicity 0.4797828E+00 Ellipticity -0.2867163E+00 Gb(Abramov) 0.3815412E-02 Vb(Abramov) -0.2520649E-02 Hb(Abramov) 0.1294763E-02 Ex_ueg -0.6180071E-03 Ec_ueg -0.1434674E-03 Delta_ex -0.7390890E-03 Delta_ec 0.1543798E-03 Delta_et -0.1032518E-02 Pxc 0.4307648E+01 Qxc -0.4787471E+01 3,+3 82 3 +1 0.512180 0.441368 1.648311 Rho 0.8735191E-02 |GRAD(Rho)| 0.6778299E-17 GRAD(Rho)x -0.5494424E-17 GRAD(Rho)y 0.2814724E-17 GRAD(Rho)z 0.2798924E-17 Laplacian 0.3515325E-01 (-1/4)Del**2(Rho)) -0.8788312E-02 Diamond 0.9357305E-03 Metallicity 0.7262761E+00 Ellipticity -0.1391252E+01 Gb(Abramov) 0.6922665E-02 Vb(Abramov) -0.5057018E-02 Hb(Abramov) 0.1865647E-02 Ex_ueg -0.1328663E-02 Ec_ueg -0.3110330E-03 Delta_ex -0.1601161E-02 Delta_ec 0.4747843E-03 Delta_et -0.3274236E-02 Pxc 0.4271776E+01 Qxc -0.3372398E+01 3,+1 83 3 +1 0.206909 2.943244 -0.182176 Rho 0.6091775E-02 |GRAD(Rho)| 0.5511806E-16 GRAD(Rho)x -0.5462703E-16 GRAD(Rho)y -0.7269139E-17 GRAD(Rho)z 0.1023709E-17 Laplacian 0.2550992E-01 (-1/4)Del**2(Rho)) -0.6377479E-02 Diamond 0.6938996E-03 Metallicity 0.5488797E+00 Ellipticity -0.2196556E+01 Gb(Abramov) 0.4835064E-02 Vb(Abramov) -0.3292649E-02 Hb(Abramov) 0.1542415E-02 Ex_ueg -0.8216941E-03 Ec_ueg -0.1941947E-03 Delta_ex -0.1259807E-02 Delta_ec 0.6987853E-03 Delta_et -0.4067514E-02 Pxc 0.4231290E+01 Qxc -0.1802853E+01 3,+1 84 3 -1 -0.009251 2.936139 0.029928 Rho 0.6195492E-02 |GRAD(Rho)| 0.3145930E-16 GRAD(Rho)x -0.1399246E-16 GRAD(Rho)y -0.2636373E-16 GRAD(Rho)z -0.9942433E-17 Laplacian 0.2500780E-01 (-1/4)Del**2(Rho)) -0.6251950E-02 Diamond 0.9012436E-03 Metallicity 0.5758782E+00 Ellipticity 0.1991788E+01 Gb(Abramov) 0.4768027E-02 Vb(Abramov) -0.3284104E-02 Hb(Abramov) 0.1483923E-02 Ex_ueg -0.8404001E-03 Ec_ueg -0.1987170E-03 Delta_ex -0.1382630E-02 Delta_ec 0.9408298E-03 Delta_et -0.5388342E-02 Pxc 0.4229131E+01 Qxc -0.1469586E+01 3,-1 85 3 -1 -0.517122 1.715875 1.690863 Rho 0.5296711E-01 |GRAD(Rho)| 0.6991161E-14 GRAD(Rho)x 0.2223774E-14 GRAD(Rho)y 0.5022119E-14 GRAD(Rho)z 0.4325446E-14 Laplacian 0.2041938E+00 (-1/4)Del**2(Rho)) -0.5104845E-01 Diamond 0.1095935E+00 Metallicity 0.2521047E+01 Ellipticity 0.1640302E-01 Gb(Abramov) 0.5548156E-01 Vb(Abramov) -0.5991467E-01 Hb(Abramov) -0.4433110E-02 Ex_ueg -0.1469129E-01 Ec_ueg -0.2579529E-02 Delta_ex -0.1695991E-01 Delta_ec 0.5913600E-02 Delta_et -0.6324270E-01 Pxc 0.5695339E+01 Qxc -0.2867951E+01 3,-1 86 3 +3 2.309397 0.009222 0.005917 Rho 0.4480344E-02 |GRAD(Rho)| 0.1064308E-12 GRAD(Rho)x -0.2069755E-13 GRAD(Rho)y -0.1006995E-12 GRAD(Rho)z 0.2754511E-13 Laplacian 0.1877705E-01 (-1/4)Del**2(Rho)) -0.4694263E-02 Diamond 0.1652740E-03 Metallicity 0.4468599E+00 Ellipticity -0.2413769E+00 Gb(Abramov) 0.3479121E-02 Vb(Abramov) -0.2263980E-02 Hb(Abramov) 0.1215141E-02 Ex_ueg -0.5455069E-03 Ec_ueg -0.1246189E-03 Delta_ex -0.6856950E-03 Delta_ec 0.1833336E-03 Delta_et -0.1130022E-02 Pxc 0.4377401E+01 Qxc -0.3740150E+01 3,+3 87 3 +1 2.180448 1.048556 -1.396982 Rho 0.2436709E-01 |GRAD(Rho)| 0.4114254E-16 GRAD(Rho)x 0.2330680E-16 GRAD(Rho)y 0.2918868E-16 GRAD(Rho)z 0.1724884E-16 Laplacian 0.9035335E-01 (-1/4)Del**2(Rho)) -0.2258834E-01 Diamond 0.1024465E-01 Metallicity 0.1561979E+01 Ellipticity -0.2705800E+01 Gb(Abramov) 0.2093931E-01 Vb(Abramov) -0.1929028E-01 Hb(Abramov) 0.1649029E-02 Ex_ueg -0.5217430E-02 Ec_ueg -0.1056901E-02 Delta_ex -0.5450493E-02 Delta_ec 0.1299924E-02 Delta_et -0.1146106E-01 Pxc 0.4936535E+01 Qxc -0.4192932E+01 3,+1 88 3 -1 1.648459 0.430749 -1.785831 Rho 0.4833664E-01 |GRAD(Rho)| 0.8712103E-13 GRAD(Rho)x 0.5380770E-13 GRAD(Rho)y -0.3170924E-13 GRAD(Rho)z -0.6073985E-13 Laplacian 0.1796825E+00 (-1/4)Del**2(Rho)) -0.4492064E-01 Diamond 0.8529074E-01 Metallicity 0.2459809E+01 Ellipticity 0.1539645E-01 Gb(Abramov) 0.4836312E-01 Vb(Abramov) -0.5180561E-01 Hb(Abramov) -0.3442486E-02 Ex_ueg -0.1300430E-01 Ec_ueg -0.2323138E-02 Delta_ex -0.1458813E-01 Delta_ec 0.5218268E-02 Delta_et -0.5450530E-01 Pxc 0.5597731E+01 Qxc -0.2795588E+01 3,-1 89 3 +1 2.904868 -0.127803 0.136460 Rho 0.5213505E-02 |GRAD(Rho)| 0.4363099E-15 GRAD(Rho)x 0.2678151E-17 GRAD(Rho)y -0.2547633E-15 GRAD(Rho)z 0.3541960E-15 Laplacian 0.2137588E-01 (-1/4)Del**2(Rho)) -0.5343971E-02 Diamond 0.5422960E-03 Metallicity 0.5053265E+00 Ellipticity -0.4240173E+01 Gb(Abramov) 0.4012723E-02 Vb(Abramov) -0.2681474E-02 Hb(Abramov) 0.1331249E-02 Ex_ueg -0.6676643E-03 Ec_ueg -0.1561123E-03 Delta_ex -0.1084581E-02 Delta_ec 0.6966019E-03 Delta_et -0.3821466E-02 Pxc 0.4276819E+01 Qxc -0.1556959E+01 3,+1 90 3 +1 1.665534 0.496829 0.495844 Rho 0.7783244E-02 |GRAD(Rho)| 0.1212541E-16 GRAD(Rho)x -0.7284277E-18 GRAD(Rho)y -0.7931128E-17 GRAD(Rho)z 0.9142880E-17 Laplacian 0.3059509E-01 (-1/4)Del**2(Rho)) -0.7648771E-02 Diamond 0.7147147E-03 Metallicity 0.6884873E+00 Ellipticity -0.1399466E+01 Gb(Abramov) 0.5976861E-02 Vb(Abramov) -0.4304951E-02 Hb(Abramov) 0.1671910E-02 Ex_ueg -0.1139198E-02 Ec_ueg -0.2685857E-03 Delta_ex -0.1362992E-02 Delta_ec 0.4305169E-03 Delta_et -0.2867788E-02 Pxc 0.4241470E+01 Qxc -0.3165942E+01 3,+1 91 3 +3 1.092426 1.063925 1.031612 Rho 0.4682265E-02 |GRAD(Rho)| 0.6027189E-17 GRAD(Rho)x 0.5689516E-17 GRAD(Rho)y 0.1786810E-17 GRAD(Rho)z -0.8739123E-18 Laplacian 0.1850136E-01 (-1/4)Del**2(Rho)) -0.4625341E-02 Diamond 0.1216790E-03 Metallicity 0.4880931E+00 Ellipticity -0.9822353E-01 Gb(Abramov) 0.3459827E-02 Vb(Abramov) -0.2294313E-02 Hb(Abramov) 0.1165514E-02 Ex_ueg -0.5785306E-03 Ec_ueg -0.1332651E-03 Delta_ex -0.6313209E-03 Delta_ec 0.8798533E-04 Delta_et -0.6698092E-03 Pxc 0.4341202E+01 Qxc -0.7175298E+01 3,+3 92 3 -1 1.753907 0.518520 2.746180 Rho 0.1327350E+00 |GRAD(Rho)| 0.5172283E-15 GRAD(Rho)x -0.3084149E-15 GRAD(Rho)y 0.4117529E-15 GRAD(Rho)z 0.5352571E-16 Laplacian 0.5588369E+00 (-1/4)Del**2(Rho)) -0.1397092E+00 Diamond 0.9786161E+00 Metallicity 0.4258964E+01 Ellipticity 0.9998574E-02 Gb(Abramov) 0.1923089E+00 Vb(Abramov) -0.2449086E+00 Hb(Abramov) -0.5259968E-01 Ex_ueg -0.5000719E-01 Ec_ueg -0.7347645E-02 Delta_ex -0.5826096E-01 Delta_ec 0.1462640E-01 Delta_et -0.1912182E+00 Pxc 0.6805879E+01 Qxc -0.3983274E+01 3,-1 93 3 +1 1.310920 1.087690 -2.203763 Rho 0.2919890E-01 |GRAD(Rho)| 0.2872815E-14 GRAD(Rho)x -0.5284486E-15 GRAD(Rho)y 0.2006325E-14 GRAD(Rho)z -0.1987075E-14 Laplacian 0.1124289E+00 (-1/4)Del**2(Rho)) -0.2810722E-01 Diamond 0.1721020E-01 Metallicity 0.1696991E+01 Ellipticity -0.3730675E+01 Gb(Abramov) 0.2668777E-01 Vb(Abramov) -0.2526831E-01 Hb(Abramov) 0.1419458E-02 Ex_ueg -0.6640597E-02 Ec_ueg -0.1302360E-02 Delta_ex -0.7201684E-02 Delta_ec 0.1750110E-02 Delta_et -0.1605619E-01 Pxc 0.5098895E+01 Qxc -0.4114989E+01 3,+1 94 3 -1 2.752084 0.540892 1.803296 Rho 0.1374937E+00 |GRAD(Rho)| 0.2769610E-12 GRAD(Rho)x 0.6594759E-13 GRAD(Rho)y 0.1886854E-12 GRAD(Rho)z -0.1917188E-12 Laplacian 0.5816575E+00 (-1/4)Del**2(Rho)) -0.1454144E+00 Diamond 0.1068501E+01 Metallicity 0.4339277E+01 Ellipticity 0.1233803E-01 Gb(Abramov) 0.2021084E+00 Vb(Abramov) -0.2588025E+00 Hb(Abramov) -0.5669408E-01 Ex_ueg -0.5241178E-01 Ec_ueg -0.7647805E-02 Delta_ex -0.6122577E-01 Delta_ec 0.1521262E-01 Delta_et -0.2002208E+00 Pxc 0.6853180E+01 Qxc -0.4024670E+01 3,-1 95 3 -1 2.953541 0.805360 -2.014349 Rho 0.7583144E-01 |GRAD(Rho)| 0.1457609E-15 GRAD(Rho)x -0.1930727E-16 GRAD(Rho)y -0.1405143E-15 GRAD(Rho)z -0.3360349E-16 Laplacian 0.3039049E+00 (-1/4)Del**2(Rho)) -0.7597621E-01 Diamond 0.2672009E+00 Metallicity 0.3080522E+01 Ellipticity 0.1797100E-02 Gb(Abramov) 0.8965855E-01 Vb(Abramov) -0.1033409E+00 Hb(Abramov) -0.1368233E-01 Ex_ueg -0.2370559E-01 Ec_ueg -0.3886007E-02 Delta_ex -0.2772098E-01 Delta_ec 0.8840870E-02 Delta_et -0.1033926E+00 Pxc 0.6100244E+01 Qxc -0.3135549E+01 3,-1 96 3 +1 1.729641 1.743229 1.740930 Rho 0.1232476E-01 |GRAD(Rho)| 0.7973582E-17 GRAD(Rho)x -0.6167695E-17 GRAD(Rho)y -0.1835238E-17 GRAD(Rho)z 0.4708444E-17 Laplacian 0.6146242E-01 (-1/4)Del**2(Rho)) -0.1536561E-01 Diamond 0.2520970E-02 Metallicity 0.7372830E+00 Ellipticity -0.1255110E+01 Gb(Abramov) 0.1213187E-01 Vb(Abramov) -0.8898135E-02 Hb(Abramov) 0.3233735E-02 Ex_ueg -0.2102598E-02 Ec_ueg -0.4745817E-03 Delta_ex -0.3033123E-02 Delta_ec 0.7809915E-03 Delta_et -0.5907175E-02 Pxc 0.4430424E+01 Qxc -0.3883682E+01 3,+1 97 3 -1 3.188214 -0.088479 -3.204727 Rho 0.2289188E+00 |GRAD(Rho)| 0.3520977E-12 GRAD(Rho)x -0.2796180E-12 GRAD(Rho)y 0.3003701E-13 GRAD(Rho)z 0.2118592E-12 Laplacian 0.8479197E+00 (-1/4)Del**2(Rho)) -0.2119799E+00 Diamond 0.2831627E+01 Metallicity 0.6961896E+01 Ellipticity 0.2086613E-01 Gb(Abramov) 0.3872836E+00 Vb(Abramov) -0.5625873E+00 Hb(Abramov) -0.1753037E+00 Ex_ueg -0.1034253E+00 Ec_ueg -0.1367647E-01 Delta_ex -0.1011843E+00 Delta_ec 0.1897862E-01 Delta_et -0.2623280E+00 Pxc 0.7562286E+01 Qxc -0.5331491E+01 3,-1 98 3 -1 3.042484 1.977933 -0.863239 Rho 0.1890002E+00 |GRAD(Rho)| 0.2203162E-11 GRAD(Rho)x 0.1006848E-11 GRAD(Rho)y -0.1145282E-11 GRAD(Rho)z -0.1590128E-11 Laplacian 0.7346426E+00 (-1/4)Del**2(Rho)) -0.1836607E+00 Diamond 0.1957891E+01 Metallicity 0.5838583E+01 Ellipticity 0.5342310E-01 Gb(Abramov) 0.3011601E+00 Vb(Abramov) -0.4186596E+00 Hb(Abramov) -0.1174994E+00 Ex_ueg -0.8010656E-01 Ec_ueg -0.1098530E-01 Delta_ex -0.8352517E-01 Delta_ec 0.1746874E-01 Delta_et -0.2386661E+00 Pxc 0.7292159E+01 Qxc -0.4781408E+01 3,-1 99 3 -1 2.792412 1.779483 0.557495 Rho 0.1448181E+00 |GRAD(Rho)| 0.1042149E-11 GRAD(Rho)x 0.1973410E-12 GRAD(Rho)y -0.7247427E-12 GRAD(Rho)z 0.7224113E-12 Laplacian 0.6075379E+00 (-1/4)Del**2(Rho)) -0.1518845E+00 Diamond 0.1185641E+01 Metallicity 0.4529787E+01 Ellipticity 0.1379030E-01 Gb(Abramov) 0.2159237E+00 Vb(Abramov) -0.2799629E+00 Hb(Abramov) -0.6403922E-01 Ex_ueg -0.5616711E-01 Ec_ueg -0.8112626E-02 Delta_ex -0.6473983E-01 Delta_ec 0.1564931E-01 Delta_et -0.2075044E+00 Pxc 0.6923420E+01 Qxc -0.4136912E+01 3,-1 100 3 +1 2.911856 0.140228 -0.134419 Rho 0.5203022E-02 |GRAD(Rho)| 0.1625141E-15 GRAD(Rho)x 0.2594219E-16 GRAD(Rho)y -0.1113843E-15 GRAD(Rho)z 0.1154616E-15 Laplacian 0.2132818E-01 (-1/4)Del**2(Rho)) -0.5332045E-02 Diamond 0.5276626E-03 Metallicity 0.5047606E+00 Ellipticity -0.3452191E+01 Gb(Abramov) 0.4003264E-02 Vb(Abramov) -0.2674484E-02 Hb(Abramov) 0.1328781E-02 Ex_ueg -0.6658748E-03 Ec_ueg -0.1556601E-03 Delta_ex -0.1071210E-02 Delta_ec 0.6762426E-03 Delta_et -0.3714843E-02 Pxc 0.4277749E+01 Qxc -0.1584062E+01 3,+1 101 3 +1 -2.175269 1.219142 1.253721 Rho 0.2806556E-01 |GRAD(Rho)| 0.6032543E-16 GRAD(Rho)x 0.5385296E-16 GRAD(Rho)y 0.7070595E-17 GRAD(Rho)z -0.2624925E-16 Laplacian 0.1067062E+00 (-1/4)Del**2(Rho)) -0.2667655E-01 Diamond 0.1571454E-01 Metallicity 0.1673837E+01 Ellipticity -0.4049213E+01 Gb(Abramov) 0.2522640E-01 Vb(Abramov) -0.2377625E-01 Hb(Abramov) 0.1450152E-02 Ex_ueg -0.6299172E-02 Ec_ueg -0.1244265E-02 Delta_ex -0.6784912E-02 Delta_ec 0.1702436E-02 Delta_et -0.1547041E-01 Pxc 0.5062563E+01 Qxc -0.3985415E+01 3,+1 102 3 -1 -2.960645 -0.975552 -2.065282 Rho 0.1266440E+00 |GRAD(Rho)| 0.1039039E-15 GRAD(Rho)x -0.1374226E-16 GRAD(Rho)y 0.1029585E-15 GRAD(Rho)z -0.2588533E-17 Laplacian 0.4838520E+00 (-1/4)Del**2(Rho)) -0.1209630E+00 Diamond 0.8180289E+00 Metallicity 0.4548569E+01 Ellipticity 0.3475800E-01 Gb(Abramov) 0.1723434E+00 Vb(Abramov) -0.2237238E+00 Hb(Abramov) -0.5138042E-01 Ex_ueg -0.4697113E-01 Ec_ueg -0.6965615E-02 Delta_ex -0.5009082E-01 Delta_ec 0.1319046E-01 Delta_et -0.1718168E+00 Pxc 0.6743285E+01 Qxc -0.3797503E+01 3,-1 103 3 -1 -2.746134 -0.526980 1.832796 Rho 0.1341887E+00 |GRAD(Rho)| 0.2742531E-14 GRAD(Rho)x 0.4299065E-15 GRAD(Rho)y 0.1647133E-14 GRAD(Rho)z 0.2150258E-14 Laplacian 0.5603857E+00 (-1/4)Del**2(Rho)) -0.1400964E+00 Diamond 0.9978268E+00 Metallicity 0.4324998E+01 Ellipticity 0.1183347E-01 Gb(Abramov) 0.1943837E+00 Vb(Abramov) -0.2486711E+00 Hb(Abramov) -0.5428732E-01 Ex_ueg -0.5073873E-01 Ec_ueg -0.7439180E-02 Delta_ex -0.5861783E-01 Delta_ec 0.1470229E-01 Delta_et -0.1926865E+00 Pxc 0.6820473E+01 Qxc -0.3986987E+01 3,-1 104 3 -1 -2.926417 0.084315 0.116243 Rho 0.6129340E-02 |GRAD(Rho)| 0.2485284E-17 GRAD(Rho)x -0.7821092E-18 GRAD(Rho)y -0.1091964E-17 GRAD(Rho)z 0.2091065E-17 Laplacian 0.2494196E-01 (-1/4)Del**2(Rho)) -0.6235491E-02 Diamond 0.8415872E-03 Metallicity 0.5671597E+00 Ellipticity 0.3930636E+01 Gb(Abramov) 0.4746414E-02 Vb(Abramov) -0.3257336E-02 Hb(Abramov) 0.1489077E-02 Ex_ueg -0.8284570E-03 Ec_ueg -0.1958320E-03 Delta_ex -0.1344802E-02 Delta_ec 0.8822420E-03 Delta_et -0.5054776E-02 Pxc 0.4230447E+01 Qxc -0.1524301E+01 3,-1 105 3 -1 -3.163023 0.041856 -3.155795 Rho 0.2265560E+00 |GRAD(Rho)| 0.1269144E-13 GRAD(Rho)x 0.1118772E-13 GRAD(Rho)y 0.5961757E-14 GRAD(Rho)z 0.6042801E-15 Laplacian 0.8569204E+00 (-1/4)Del**2(Rho)) -0.2142301E+00 Diamond 0.2814920E+01 Metallicity 0.6770673E+01 Ellipticity 0.2650389E-01 Gb(Abramov) 0.3845671E+00 Vb(Abramov) -0.5549040E+00 Hb(Abramov) -0.1703370E+00 Ex_ueg -0.1020044E+00 Ec_ueg -0.1351472E-01 Delta_ex -0.1019186E+00 Delta_ec 0.1912217E-01 Delta_et -0.2637074E+00 Pxc 0.7547655E+01 Qxc -0.5329866E+01 3,-1 106 3 -1 -3.152175 -0.040193 3.237329 Rho 0.2364723E+00 |GRAD(Rho)| 0.2704365E-15 GRAD(Rho)x -0.1950480E-15 GRAD(Rho)y -0.1095586E-15 GRAD(Rho)z 0.1519509E-15 Laplacian 0.8811169E+00 (-1/4)Del**2(Rho)) -0.2202792E+00 Diamond 0.3048146E+01 Metallicity 0.7072076E+01 Ellipticity 0.2064723E-02 Gb(Abramov) 0.4064914E+00 Vb(Abramov) -0.5927035E+00 Hb(Abramov) -0.1862122E+00 Ex_ueg -0.1080004E+00 Ec_ueg -0.1419560E-01 Delta_ex -0.1059753E+00 Delta_ec 0.1942329E-01 Delta_et -0.2683542E+00 Pxc 0.7608024E+01 Qxc -0.5456093E+01 3,-1 107 3 +1 -1.744686 1.701424 -1.723243 Rho 0.1139523E-01 |GRAD(Rho)| 0.2435105E-16 GRAD(Rho)x -0.5380823E-17 GRAD(Rho)y -0.1846922E-16 GRAD(Rho)z -0.1493012E-16 Laplacian 0.5533381E-01 (-1/4)Del**2(Rho)) -0.1383345E-01 Diamond 0.2089602E-02 Metallicity 0.7186119E+00 Ellipticity -0.1287269E+01 Gb(Abramov) 0.1087911E-01 Vb(Abramov) -0.7924778E-02 Hb(Abramov) 0.2954337E-02 Ex_ueg -0.1893866E-02 Ec_ueg -0.4317231E-03 Delta_ex -0.2690589E-02 Delta_ec 0.7315568E-03 Delta_et -0.5405832E-02 Pxc 0.4386760E+01 Qxc -0.3677895E+01 3,+1 108 3 -1 -1.722058 1.671621 0.525200 Rho 0.5153068E-01 |GRAD(Rho)| 0.2981071E-13 GRAD(Rho)x -0.2035565E-13 GRAD(Rho)y 0.1913915E-13 GRAD(Rho)z -0.1039322E-13 Laplacian 0.1952554E+00 (-1/4)Del**2(Rho)) -0.4881386E-01 Diamond 0.1003045E+00 Metallicity 0.2518372E+01 Ellipticity 0.1333812E-01 Gb(Abramov) 0.5303115E-01 Vb(Abramov) -0.5724844E-01 Hb(Abramov) -0.4217289E-02 Ex_ueg -0.1416249E-01 Ec_ueg -0.2499658E-02 Delta_ex -0.1607793E-01 Delta_ec 0.5608234E-02 Delta_et -0.5953930E-01 Pxc 0.5665772E+01 Qxc -0.2866843E+01 3,-1 109 3 -1 -1.797408 2.728616 -0.543919 Rho 0.1382378E+00 |GRAD(Rho)| 0.2511844E-15 GRAD(Rho)x 0.1975552E-15 GRAD(Rho)y -0.7918742E-16 GRAD(Rho)z -0.1333975E-15 Laplacian 0.5730097E+00 (-1/4)Del**2(Rho)) -0.1432524E+00 Diamond 0.1062001E+01 Metallicity 0.4444566E+01 Ellipticity 0.1005688E-01 Gb(Abramov) 0.2016174E+00 Vb(Abramov) -0.2599824E+00 Hb(Abramov) -0.5836499E-01 Ex_ueg -0.5279031E-01 Ec_ueg -0.7694871E-02 Delta_ex -0.6042272E-01 Delta_ec 0.1501727E-01 Delta_et -0.1979173E+00 Pxc 0.6860455E+01 Qxc -0.4023550E+01 3,-1 110 3 +1 -0.200255 2.922527 0.215472 Rho 0.6123738E-02 |GRAD(Rho)| 0.1999931E-13 GRAD(Rho)x -0.1954222E-13 GRAD(Rho)y -0.4185488E-14 GRAD(Rho)z 0.7454352E-15 Laplacian 0.2562690E-01 (-1/4)Del**2(Rho)) -0.6406725E-02 Diamond 0.7123932E-03 Metallicity 0.5511605E+00 Ellipticity -0.2368462E+01 Gb(Abramov) 0.4859673E-02 Vb(Abramov) -0.3312620E-02 Hb(Abramov) 0.1547053E-02 Ex_ueg -0.8274476E-03 Ec_ueg -0.1955878E-03 Delta_ex -0.1274317E-02 Delta_ec 0.7151198E-03 Delta_et -0.4163079E-02 Pxc 0.4230569E+01 Qxc -0.1781963E+01 3,+1 111 3 -1 -2.002535 2.944046 0.857807 Rho 0.1152529E+00 |GRAD(Rho)| 0.5908371E-16 GRAD(Rho)x 0.1030670E-16 GRAD(Rho)y 0.1097755E-17 GRAD(Rho)z -0.5816745E-16 Laplacian 0.4596482E+00 (-1/4)Del**2(Rho)) -0.1149121E+00 Diamond 0.6780326E+00 Metallicity 0.4092046E+01 Ellipticity 0.1950768E-01 Gb(Abramov) 0.1549789E+00 Vb(Abramov) -0.1950458E+00 Hb(Abramov) -0.4006688E-01 Ex_ueg -0.4142419E-01 Ec_ueg -0.6257939E-02 Delta_ex -0.4631001E-01 Delta_ec 0.1240657E-01 Delta_et -0.1583037E+00 Pxc 0.6619462E+01 Qxc -0.3732700E+01 3,-1 112 3 +1 0.059894 -3.031820 0.159774 Rho 0.5551572E-02 |GRAD(Rho)| 0.3790252E-17 GRAD(Rho)x -0.2818926E-17 GRAD(Rho)y 0.1436568E-17 GRAD(Rho)z 0.2087089E-17 Laplacian 0.2252375E-01 (-1/4)Del**2(Rho)) -0.5630938E-02 Diamond 0.6081031E-03 Metallicity 0.5325156E+00 Ellipticity -0.3824722E+01 Gb(Abramov) 0.4253719E-02 Vb(Abramov) -0.2876500E-02 Hb(Abramov) 0.1377219E-02 Ex_ueg -0.7260051E-03 Ec_ueg -0.1707259E-03 Delta_ex -0.1145691E-02 Delta_ec 0.7142761E-03 Delta_et -0.4000818E-02 Pxc 0.4252461E+01 Qxc -0.1603989E+01 3,+1 113 3 -1 -0.583809 -2.773119 1.844722 Rho 0.1482149E+00 |GRAD(Rho)| 0.4102928E-15 GRAD(Rho)x 0.3635872E-15 GRAD(Rho)y 0.1863439E-15 GRAD(Rho)z 0.3768958E-16 Laplacian 0.6221246E+00 (-1/4)Del**2(Rho)) -0.1555311E+00 Diamond 0.1224400E+01 Metallicity 0.4597859E+01 Ellipticity 0.3780081E-01 Gb(Abramov) 0.2228725E+00 Vb(Abramov) -0.2902138E+00 Hb(Abramov) -0.6734133E-01 Ex_ueg -0.5793054E-01 Ec_ueg -0.8329341E-02 Delta_ex -0.6642855E-01 Delta_ec 0.1550030E-01 Delta_et -0.2052426E+00 Pxc 0.6954997E+01 Qxc -0.4285629E+01 3,-1 114 3 +3 -0.127196 -2.343316 -0.149626 Rho 0.4180713E-02 |GRAD(Rho)| 0.8463380E-17 GRAD(Rho)x 0.4560425E-17 GRAD(Rho)y -0.6451003E-17 GRAD(Rho)z -0.3035766E-17 Laplacian 0.1708027E-01 (-1/4)Del**2(Rho)) -0.4270068E-02 Diamond 0.1164822E-03 Metallicity 0.4377260E+00 Ellipticity -0.2612311E+00 Gb(Abramov) 0.3158232E-02 Vb(Abramov) -0.2046396E-02 Hb(Abramov) 0.1111836E-02 Ex_ueg -0.4974150E-03 Ec_ueg -0.1118277E-03 Delta_ex -0.5889051E-03 Delta_ec 0.1238495E-03 Delta_et -0.8073777E-03 Pxc 0.4448047E+01 Qxc -0.4755006E+01 3,+3 115 3 +1 -0.611595 -1.673222 0.509557 Rho 0.8798423E-02 |GRAD(Rho)| 0.6961891E-15 GRAD(Rho)x 0.5710384E-15 GRAD(Rho)y 0.2721339E-15 GRAD(Rho)z 0.2907534E-15 Laplacian 0.3466868E-01 (-1/4)Del**2(Rho)) -0.8667171E-02 Diamond 0.9339136E-03 Metallicity 0.7453333E+00 Ellipticity -0.1418380E+01 Gb(Abramov) 0.6854769E-02 Vb(Abramov) -0.5042367E-02 Hb(Abramov) 0.1812402E-02 Ex_ueg -0.1341503E-02 Ec_ueg -0.3138668E-03 Delta_ex -0.1582857E-02 Delta_ec 0.4697673E-03 Delta_et -0.3244294E-02 Pxc 0.4274114E+01 Qxc -0.3369449E+01 3,+1 116 3 +1 1.509344 -1.996559 -1.998016 Rho 0.6743647E-02 |GRAD(Rho)| 0.2973774E-16 GRAD(Rho)x 0.1896676E-16 GRAD(Rho)y 0.2220624E-16 GRAD(Rho)z 0.5610534E-17 Laplacian 0.2958011E-01 (-1/4)Del**2(Rho)) -0.7395027E-02 Diamond 0.9547925E-03 Metallicity 0.5607528E+00 Ellipticity -0.2228588E+01 Gb(Abramov) 0.5621148E-02 Vb(Abramov) -0.3847270E-02 Hb(Abramov) 0.1773879E-02 Ex_ueg -0.9409752E-03 Ec_ueg -0.2227039E-03 Delta_ex -0.1512173E-02 Delta_ec 0.8458667E-03 Delta_et -0.5057235E-02 Pxc 0.4225230E+01 Qxc -0.1787720E+01 3,+1 117 3 -1 -0.560589 -1.809856 2.802376 Rho 0.1186669E+00 |GRAD(Rho)| 0.3199700E-13 GRAD(Rho)x -0.1443690E-13 GRAD(Rho)y 0.9796376E-15 GRAD(Rho)z -0.2853813E-13 Laplacian 0.4936408E+00 (-1/4)Del**2(Rho)) -0.1234102E+00 Diamond 0.7502832E+00 Metallicity 0.4000230E+01 Ellipticity 0.5179078E-02 Gb(Abramov) 0.1645517E+00 Vb(Abramov) -0.2056932E+00 Hb(Abramov) -0.4114148E-01 Ex_ueg -0.4306833E-01 Ec_ueg -0.6469092E-02 Delta_ex -0.5002784E-01 Delta_ec 0.1313902E-01 Delta_et -0.1683671E+00 Pxc 0.6657555E+01 Qxc -0.3807578E+01 3,-1 118 3 +1 0.534286 1.663759 0.456816 Rho 0.8128003E-02 |GRAD(Rho)| 0.1257204E-12 GRAD(Rho)x -0.8455472E-13 GRAD(Rho)y -0.8791771E-13 GRAD(Rho)z -0.3044007E-13 Laplacian 0.3230624E-01 (-1/4)Del**2(Rho)) -0.8076559E-02 Diamond 0.7925544E-03 Metallicity 0.7008631E+00 Ellipticity -0.1393936E+01 Gb(Abramov) 0.6327800E-02 Vb(Abramov) -0.4579040E-02 Hb(Abramov) 0.1748759E-02 Ex_ueg -0.1206971E-02 Ec_ueg -0.2839114E-03 Delta_ex -0.1451098E-02 Delta_ec 0.4476535E-03 Delta_et -0.3021262E-02 Pxc 0.4251225E+01 Qxc -0.3241564E+01 3,+1 119 3 -1 0.340505 0.342614 -0.439055 Rho 0.1357909E+00 |GRAD(Rho)| 0.1030610E-12 GRAD(Rho)x -0.5400116E-13 GRAD(Rho)y -0.7195816E-13 GRAD(Rho)z 0.5027383E-13 Laplacian 0.7019229E+00 (-1/4)Del**2(Rho)) -0.1754807E+00 Diamond 0.1521718E+01 Metallicity 0.3521881E+01 Ellipticity 0.2320418E-02 Gb(Abramov) 0.2199909E+00 Vb(Abramov) -0.2645010E+00 Hb(Abramov) -0.4451013E-01 Ex_ueg -0.5154807E-01 Ec_ueg -0.7540226E-02 Delta_ex -0.7652249E-01 Delta_ec 0.2351993E-01 Delta_et -0.3190305E+00 Pxc 0.6836410E+01 Qxc -0.3253516E+01 3,-1 120 3 +1 0.233007 -1.911684 -0.722115 Rho 0.5898507E-02 |GRAD(Rho)| 0.1773974E-14 GRAD(Rho)x 0.5132986E-15 GRAD(Rho)y 0.9352667E-15 GRAD(Rho)z 0.1417317E-14 Laplacian 0.2293260E-01 (-1/4)Del**2(Rho)) -0.5733151E-02 Diamond 0.5753177E-03 Metallicity 0.5786242E+00 Ellipticity -0.2245665E+01 Gb(Abramov) 0.4374990E-02 Vb(Abramov) -0.3016830E-02 Hb(Abramov) 0.1358160E-02 Ex_ueg -0.7871204E-03 Ec_ueg -0.1857818E-03 Delta_ex -0.1108620E-02 Delta_ec 0.5989818E-03 Delta_et -0.3466906E-02 Pxc 0.4236800E+01 Qxc -0.1850841E+01 3,+1 121 3 -1 1.707934 -2.937563 -0.570101 Rho 0.2191278E+00 |GRAD(Rho)| 0.5387633E-15 GRAD(Rho)x 0.4382345E-15 GRAD(Rho)y 0.1312156E-15 GRAD(Rho)z 0.2846031E-15 Laplacian 0.8656449E+00 (-1/4)Del**2(Rho)) -0.2164112E+00 Diamond 0.2712426E+01 Metallicity 0.6340194E+01 Ellipticity 0.2277411E-01 Gb(Abramov) 0.3729557E+00 Vb(Abramov) -0.5295001E+00 Hb(Abramov) -0.1565445E+00 Ex_ueg -0.9756972E-01 Ec_ueg -0.1300822E-01 Delta_ex -0.1019539E+00 Delta_ec 0.1929507E-01 Delta_et -0.2648213E+00 Pxc 0.7500618E+01 Qxc -0.5283935E+01 3,-1 122 3 -1 1.917789 -3.021838 0.857187 Rho 0.1206862E+00 |GRAD(Rho)| 0.1761023E-15 GRAD(Rho)x 0.5951592E-16 GRAD(Rho)y -0.1504331E-16 GRAD(Rho)z 0.1650562E-15 Laplacian 0.4673701E+00 (-1/4)Del**2(Rho)) -0.1168425E+00 Diamond 0.7417008E+00 Metallicity 0.4345587E+01 Ellipticity 0.2446094E-01 Gb(Abramov) 0.1625199E+00 Vb(Abramov) -0.2081973E+00 Hb(Abramov) -0.4567738E-01 Ex_ueg -0.4404825E-01 Ec_ueg -0.6594366E-02 Delta_ex -0.4778017E-01 Delta_ec 0.1278967E-01 Delta_et -0.1650376E+00 Pxc 0.6679680E+01 Qxc -0.3735841E+01 3,-1 123 3 +1 1.128894 -1.300527 2.155036 Rho 0.2497080E-01 |GRAD(Rho)| 0.2775187E-16 GRAD(Rho)x -0.2907988E-17 GRAD(Rho)y -0.2004484E-16 GRAD(Rho)z -0.1897141E-16 Laplacian 0.9381010E-01 (-1/4)Del**2(Rho)) -0.2345253E-01 Diamond 0.1190428E-01 Metallicity 0.1567055E+01 Ellipticity -0.3696641E+01 Gb(Abramov) 0.2176025E-01 Vb(Abramov) -0.2006798E-01 Hb(Abramov) 0.1692275E-02 Ex_ueg -0.5390491E-02 Ec_ueg -0.1087244E-02 Delta_ex -0.5795098E-02 Delta_ec 0.1524823E-02 Delta_et -0.1347166E-01 Pxc 0.4957940E+01 Qxc -0.3800504E+01 3,+1 124 3 +1 1.954089 -2.014848 2.023525 Rho 0.1236189E-01 |GRAD(Rho)| 0.5478997E-17 GRAD(Rho)x -0.2097896E-18 GRAD(Rho)y 0.5239553E-17 GRAD(Rho)z 0.1588231E-17 Laplacian 0.5658499E-01 (-1/4)Del**2(Rho)) -0.1414625E-01 Diamond 0.1770951E-02 Metallicity 0.8048589E+00 Ellipticity -0.1087239E+01 Gb(Abramov) 0.1132845E-01 Vb(Abramov) -0.8510661E-02 Hb(Abramov) 0.2817794E-02 Ex_ueg -0.2111048E-02 Ec_ueg -0.4763006E-03 Delta_ex -0.2639233E-02 Delta_ec 0.4415249E-03 Delta_et -0.3556311E-02 Pxc 0.4432175E+01 Qxc -0.5977540E+01 3,+1 125 3 -1 1.313698 -2.130242 -2.135266 Rho 0.6879086E-02 |GRAD(Rho)| 0.8148803E-17 GRAD(Rho)x -0.4775572E-17 GRAD(Rho)y 0.2597850E-17 GRAD(Rho)z 0.6070262E-17 Laplacian 0.2806112E-01 (-1/4)Del**2(Rho)) -0.7015279E-02 Diamond 0.1284537E-02 Metallicity 0.6110256E+00 Ellipticity 0.8711372E+00 Gb(Abramov) 0.5391272E-02 Vb(Abramov) -0.3767265E-02 Hb(Abramov) 0.1624007E-02 Ex_ueg -0.9662571E-03 Ec_ueg -0.2286527E-03 Delta_ex -0.1655389E-02 Delta_ec 0.1186140E-02 Delta_et -0.6970932E-02 Pxc 0.4225872E+01 Qxc -0.1395610E+01 3,-1 126 3 +1 1.107828 -2.209744 1.304568 Rho 0.2745713E-01 |GRAD(Rho)| 0.3309065E-16 GRAD(Rho)x -0.1752880E-16 GRAD(Rho)y 0.2735480E-16 GRAD(Rho)z 0.6280695E-17 Laplacian 0.1067832E+00 (-1/4)Del**2(Rho)) -0.2669579E-01 Diamond 0.1573320E-01 Metallicity 0.1612633E+01 Ellipticity -0.4289776E+01 Gb(Abramov) 0.2497228E-01 Vb(Abramov) -0.2324877E-01 Hb(Abramov) 0.1723511E-02 Ex_ueg -0.6117753E-02 Ec_ueg -0.1213205E-02 Delta_ex -0.6795149E-02 Delta_ec 0.1785069E-02 Delta_et -0.1612414E-01 Pxc 0.5042637E+01 Qxc -0.3806659E+01 3,+1 127 3 -1 1.615938 -1.761668 0.446129 Rho 0.5633958E-01 |GRAD(Rho)| 0.1300868E-15 GRAD(Rho)x -0.2605219E-16 GRAD(Rho)y 0.1269084E-15 GRAD(Rho)z 0.1175216E-16 Laplacian 0.2132820E+00 (-1/4)Del**2(Rho)) -0.5332049E-01 Diamond 0.1251135E+00 Metallicity 0.2675151E+01 Ellipticity 0.1349208E-01 Gb(Abramov) 0.5932039E-01 Vb(Abramov) -0.6532029E-01 Hb(Abramov) -0.5999897E-02 Ex_ueg -0.1595156E-01 Ec_ueg -0.2768187E-02 Delta_ex -0.1801828E-01 Delta_ec 0.6214329E-02 Delta_et -0.6752992E-01 Pxc 0.5762457E+01 Qxc -0.2899473E+01 3,-1 128 3 +1 1.619967 -0.548983 -0.558311 Rho 0.9273633E-02 |GRAD(Rho)| 0.4779657E-12 GRAD(Rho)x 0.2302930E-12 GRAD(Rho)y 0.4020732E-12 GRAD(Rho)z 0.1172754E-12 Laplacian 0.3802043E-01 (-1/4)Del**2(Rho)) -0.9505107E-02 Diamond 0.1087457E-02 Metallicity 0.7419012E+00 Ellipticity -0.1384556E+01 Gb(Abramov) 0.7512046E-02 Vb(Abramov) -0.5518985E-02 Hb(Abramov) 0.1993061E-02 Ex_ueg -0.1438970E-02 Ec_ueg -0.3352202E-03 Delta_ex -0.1754126E-02 Delta_ec 0.5057496E-03 Delta_et -0.3547478E-02 Pxc 0.4292610E+01 Qxc -0.3468369E+01 3,+1 129 3 -1 1.955179 0.826179 -3.029819 Rho 0.1309868E+00 |GRAD(Rho)| 0.6247915E-12 GRAD(Rho)x 0.2843418E-12 GRAD(Rho)y -0.5029322E-12 GRAD(Rho)z 0.2378514E-12 Laplacian 0.5039162E+00 (-1/4)Del**2(Rho)) -0.1259791E+00 Diamond 0.8819023E+00 Metallicity 0.4619917E+01 Ellipticity 0.2898357E-01 Gb(Abramov) 0.1809882E+00 Vb(Abramov) -0.2359973E+00 Hb(Abramov) -0.5500912E-01 Ex_ueg -0.4913096E-01 Ec_ueg -0.7237747E-02 Delta_ex -0.5252732E-01 Delta_ec 0.1351661E-01 Delta_et -0.1768719E+00 Pxc 0.6788156E+01 Qxc -0.3886132E+01 3,-1 130 3 -1 -2.797364 1.745023 -0.541710 Rho 0.1952917E+00 |GRAD(Rho)| 0.6098035E-15 GRAD(Rho)x -0.1773348E-15 GRAD(Rho)y -0.4521123E-15 GRAD(Rho)z -0.3687914E-15 Laplacian 0.8001208E+00 (-1/4)Del**2(Rho)) -0.2000302E+00 Diamond 0.2190093E+01 Metallicity 0.5661488E+01 Ellipticity 0.2065935E-01 Gb(Abramov) 0.3220982E+00 Vb(Abramov) -0.4441663E+00 Hb(Abramov) -0.1220680E+00 Ex_ueg -0.8368163E-01 Ec_ueg -0.1140356E-01 Delta_ex -0.9153427E-01 Delta_ec 0.1850966E-01 Delta_et -0.2524647E+00 Pxc 0.7338205E+01 Qxc -0.4945217E+01 3,-1 131 3 -1 -3.010078 1.947246 0.883444 Rho 0.1367010E+00 |GRAD(Rho)| 0.5959995E-12 GRAD(Rho)x -0.2626540E-12 GRAD(Rho)y -0.2815307E-12 GRAD(Rho)z 0.4549382E-12 Laplacian 0.5325503E+00 (-1/4)Del**2(Rho)) -0.1331376E+00 Diamond 0.9748738E+00 Metallicity 0.4693952E+01 Ellipticity 0.3423975E-01 Gb(Abramov) 0.1929153E+00 Vb(Abramov) -0.2526930E+00 Hb(Abramov) -0.5977771E-01 Ex_ueg -0.5200926E-01 Ec_ueg -0.7597701E-02 Delta_ex -0.5601602E-01 Delta_ec 0.1401525E-01 Delta_et -0.1844298E+00 Pxc 0.6845394E+01 Qxc -0.3996792E+01 3,-1 132 3 -1 -1.827972 -2.728127 0.585265 Rho 0.1216190E+00 |GRAD(Rho)| 0.3797865E-15 GRAD(Rho)x -0.2985080E-15 GRAD(Rho)y 0.8380544E-16 GRAD(Rho)z -0.2193341E-15 Laplacian 0.5067828E+00 (-1/4)Del**2(Rho)) -0.1266957E+00 Diamond 0.8063826E+00 Metallicity 0.4059384E+01 Ellipticity 0.1902173E-01 Gb(Abramov) 0.1701815E+00 Vb(Abramov) -0.2136674E+00 Hb(Abramov) -0.4348585E-01 Ex_ueg -0.4450274E-01 Ec_ueg -0.6652327E-02 Delta_ex -0.5183382E-01 Delta_ec 0.1371777E-01 Delta_et -0.1770491E+00 Pxc 0.6689801E+01 Qxc -0.3778590E+01 3,-1 133 3 -1 -0.226614 -1.289087 -3.513686 Rho 0.5948306E-02 |GRAD(Rho)| 0.2343848E-16 GRAD(Rho)x 0.2306131E-16 GRAD(Rho)y 0.3592478E-17 GRAD(Rho)z 0.2152364E-17 Laplacian 0.2365447E-01 (-1/4)Del**2(Rho)) -0.5913617E-02 Diamond 0.1044549E-02 Metallicity 0.5688819E+00 Ellipticity 0.1583382E+00 Gb(Abramov) 0.4503103E-02 Vb(Abramov) -0.3092589E-02 Hb(Abramov) 0.1410514E-02 Ex_ueg -0.7959934E-03 Ec_ueg -0.1879478E-03 Delta_ex -0.1472866E-02 Delta_ec 0.1202249E-02 Delta_et -0.6697496E-02 Pxc 0.4235183E+01 Qxc -0.1225092E+01 3,-1 134 3 -1 0.012168 -3.350976 -1.205205 Rho 0.4289796E-01 |GRAD(Rho)| 0.2781714E-16 GRAD(Rho)x -0.2547566E-16 GRAD(Rho)y -0.1061497E-16 GRAD(Rho)z -0.3479413E-17 Laplacian 0.1216904E+00 (-1/4)Del**2(Rho)) -0.3042261E-01 Diamond 0.8113591E-01 Metallicity 0.2976810E+01 Ellipticity 0.6628462E-02 Gb(Abramov) 0.3537546E-01 Vb(Abramov) -0.4032831E-01 Hb(Abramov) -0.4952851E-02 Ex_ueg -0.1109091E-01 Ec_ueg -0.2026234E-02 Delta_ex -0.1128102E-01 Delta_ec 0.6560354E-02 Delta_et -0.6691348E-01 Pxc 0.5473659E+01 Qxc -0.1719576E+01 3,-1 135 3 -1 -0.083764 -3.202601 3.211090 Rho 0.2260989E+00 |GRAD(Rho)| 0.4046873E-10 GRAD(Rho)x -0.8005075E-11 GRAD(Rho)y -0.2726086E-10 GRAD(Rho)z 0.2881810E-10 Laplacian 0.8300955E+00 (-1/4)Del**2(Rho)) -0.2075239E+00 Diamond 0.2733627E+01 Metallicity 0.6965986E+01 Ellipticity 0.2107257E-02 Gb(Abramov) 0.3792840E+00 Vb(Abramov) -0.5510441E+00 Hb(Abramov) -0.1717601E+00 Ex_ueg -0.1017302E+00 Ec_ueg -0.1348347E-01 Delta_ex -0.9875384E-01 Delta_ec 0.1867272E-01 Delta_et -0.2580547E+00 Pxc 0.7544807E+01 Qxc -0.5288668E+01 3,-1 136 3 -1 0.848196 -3.017280 2.038541 Rho 0.1467550E+00 |GRAD(Rho)| 0.4653238E-15 GRAD(Rho)x 0.4086087E-15 GRAD(Rho)y 0.4719668E-16 GRAD(Rho)z -0.2175723E-15 Laplacian 0.5748535E+00 (-1/4)Del**2(Rho)) -0.1437134E+00 Diamond 0.1123375E+01 Metallicity 0.4894527E+01 Ellipticity 0.7864769E-01 Gb(Abramov) 0.2130437E+00 Vb(Abramov) -0.2823741E+00 Hb(Abramov) -0.6933037E-01 Ex_ueg -0.5717096E-01 Ec_ueg -0.8236110E-02 Delta_ex -0.6128679E-01 Delta_ec 0.1445651E-01 Delta_et -0.1913874E+00 Pxc 0.6941500E+01 Qxc -0.4239390E+01 3,-1 137 3 -1 0.817804 -1.994758 3.014021 Rho 0.1275674E+00 |GRAD(Rho)| 0.7369394E-15 GRAD(Rho)x 0.6785954E-15 GRAD(Rho)y 0.2173622E-15 GRAD(Rho)z 0.1879939E-15 Laplacian 0.4991531E+00 (-1/4)Del**2(Rho)) -0.1247883E+00 Diamond 0.8262143E+00 Metallicity 0.4462849E+01 Ellipticity 0.4713495E-01 Gb(Abramov) 0.1760107E+00 Vb(Abramov) -0.2272332E+00 Hb(Abramov) -0.5122246E-01 Ex_ueg -0.4742835E-01 Ec_ueg -0.7023375E-02 Delta_ex -0.5145445E-01 Delta_ec 0.1303078E-01 Delta_et -0.1689770E+00 Pxc 0.6752929E+01 Qxc -0.3948685E+01 3,-1 138 3 -1 2.888352 -2.008516 0.821823 Rho 0.9066126E-01 |GRAD(Rho)| 0.2439436E-15 GRAD(Rho)x -0.1610853E-15 GRAD(Rho)y -0.1083931E-15 GRAD(Rho)z -0.1476853E-15 Laplacian 0.3614253E+00 (-1/4)Del**2(Rho)) -0.9035632E-01 Diamond 0.3975601E+00 Metallicity 0.3488437E+01 Ellipticity 0.8577477E-02 Gb(Abramov) 0.1127713E+00 Vb(Abramov) -0.1351862E+00 Hb(Abramov) -0.2241495E-01 Ex_ueg -0.3008020E-01 Ec_ueg -0.4762906E-02 Delta_ex -0.3439761E-01 Delta_ec 0.1023380E-01 Delta_et -0.1245387E+00 Pxc 0.6315514E+01 Qxc -0.3361175E+01 3,-1 139 3 +1 2.130095 -1.346004 1.111146 Rho 0.2766299E-01 |GRAD(Rho)| 0.2074645E-13 GRAD(Rho)x 0.1130606E-13 GRAD(Rho)y -0.1535419E-13 GRAD(Rho)z -0.8175392E-14 Laplacian 0.1076138E+00 (-1/4)Del**2(Rho)) -0.2690346E-01 Diamond 0.1577842E-01 Metallicity 0.1620231E+01 Ellipticity -0.3864364E+01 Gb(Abramov) 0.2520061E-01 Vb(Abramov) -0.2349776E-01 Hb(Abramov) 0.1702851E-02 Ex_ueg -0.6178986E-02 Ec_ueg -0.1223704E-02 Delta_ex -0.6838908E-02 Delta_ec 0.1758086E-02 Delta_et -0.1591529E-01 Pxc 0.5049412E+01 Qxc -0.3889975E+01 3,+1 140 3 -1 2.955307 -0.882740 1.992761 Rho 0.1751357E+00 |GRAD(Rho)| 0.3658868E-15 GRAD(Rho)x -0.3375663E-15 GRAD(Rho)y 0.7171997E-16 GRAD(Rho)z 0.1215662E-15 Laplacian 0.6816705E+00 (-1/4)Del**2(Rho)) -0.1704176E+00 Diamond 0.1662630E+01 Metallicity 0.5541956E+01 Ellipticity 0.5512626E-01 Gb(Abramov) 0.2710196E+00 Vb(Abramov) -0.3716216E+00 Hb(Abramov) -0.1006020E+00 Ex_ueg -0.7236879E-01 Ec_ueg -0.1007153E-01 Delta_ex -0.7606588E-01 Delta_ec 0.1660873E-01 Delta_et -0.2253715E+00 Pxc 0.7185477E+01 Qxc -0.4579873E+01 3,-1 141 3 -1 -3.242872 -3.092266 0.069008 Rho 0.2352531E+00 |GRAD(Rho)| 0.2581816E-15 GRAD(Rho)x -0.2397171E-15 GRAD(Rho)y -0.4477755E-16 GRAD(Rho)z 0.8478461E-16 Laplacian 0.9026663E+00 (-1/4)Del**2(Rho)) -0.2256666E+00 Diamond 0.3087120E+01 Metallicity 0.6844024E+01 Ellipticity 0.1037029E-02 Gb(Abramov) 0.4078556E+00 Vb(Abramov) -0.5900447E+00 Hb(Abramov) -0.1821890E+00 Ex_ueg -0.1072586E+00 Ec_ueg -0.1411159E-01 Delta_ex -0.1083322E+00 Delta_ec 0.1977051E-01 Delta_et -0.2724153E+00 Pxc 0.7600746E+01 Qxc -0.5479484E+01 3,-1 142 3 +1 -1.308904 2.164819 1.152988 Rho 0.2878282E-01 |GRAD(Rho)| 0.1188341E-16 GRAD(Rho)x -0.9706433E-17 GRAD(Rho)y -0.4576020E-17 GRAD(Rho)z -0.5104951E-17 Laplacian 0.1112650E+00 (-1/4)Del**2(Rho)) -0.2781626E-01 Diamond 0.1685559E-01 Metallicity 0.1674210E+01 Ellipticity -0.3790312E+01 Gb(Abramov) 0.2630588E-01 Vb(Abramov) -0.2479551E-01 Hb(Abramov) 0.1510377E-02 Ex_ueg -0.6514725E-02 Ec_ueg -0.1280996E-02 Delta_ex -0.7113470E-02 Delta_ec 0.1757344E-02 Delta_et -0.1606603E-01 Pxc 0.5085672E+01 Qxc -0.4047853E+01 3,+1 143 3 -1 -0.846998 2.000594 2.984003 Rho 0.1233174E+00 |GRAD(Rho)| 0.3852619E-15 GRAD(Rho)x -0.3242849E-15 GRAD(Rho)y -0.1871062E-15 GRAD(Rho)z 0.9086969E-16 Laplacian 0.4867242E+00 (-1/4)Del**2(Rho)) -0.1216811E+00 Diamond 0.7835297E+00 Metallicity 0.4325513E+01 Ellipticity 0.2709452E-01 Gb(Abramov) 0.1688429E+00 Vb(Abramov) -0.2160047E+00 Hb(Abramov) -0.4716181E-01 Ex_ueg -0.4533333E-01 Ec_ueg -0.6758026E-02 Delta_ex -0.4989590E-01 Delta_ec 0.1304085E-01 Delta_et -0.1685644E+00 Pxc 0.6708073E+01 Qxc -0.3826122E+01 3,-1 144 3 -1 -0.858833 2.993435 1.970133 Rho 0.1554503E+00 |GRAD(Rho)| 0.9100882E-16 GRAD(Rho)x -0.5830297E-16 GRAD(Rho)y -0.4130810E-16 GRAD(Rho)z -0.5636496E-16 Laplacian 0.6071573E+00 (-1/4)Del**2(Rho)) -0.1517893E+00 Diamond 0.1287597E+01 Metallicity 0.5100719E+01 Ellipticity 0.4874022E-01 Gb(Abramov) 0.2302320E+00 Vb(Abramov) -0.3086747E+00 Hb(Abramov) -0.7844268E-01 Ex_ueg -0.6173157E-01 Ec_ueg -0.8793322E-02 Delta_ex -0.6581027E-01 Delta_ec 0.1532430E-01 Delta_et -0.2051254E+00 Pxc 0.7020278E+01 Qxc -0.4294505E+01 3,-1 145 3 +3 1.887978 -1.954474 1.954429 Rho 0.1234392E-01 |GRAD(Rho)| 0.2257285E-16 GRAD(Rho)x 0.1134777E-16 GRAD(Rho)y 0.1907399E-16 GRAD(Rho)z -0.4116361E-17 Laplacian 0.5584128E-01 (-1/4)Del**2(Rho)) -0.1396032E-01 Diamond 0.1460864E-02 Metallicity 0.8136035E+00 Ellipticity -0.8861453E+00 Gb(Abramov) 0.1119991E-01 Vb(Abramov) -0.8439495E-02 Hb(Abramov) 0.2760412E-02 Ex_ueg -0.2106957E-02 Ec_ueg -0.4754686E-03 Delta_ex -0.2524642E-02 Delta_ec 0.2949629E-03 Delta_et -0.2552327E-02 Pxc 0.4431328E+01 Qxc -0.8559188E+01 3,+3 146 3 +1 1.325329 2.125616 -1.119032 Rho 0.2670894E-01 |GRAD(Rho)| 0.2072506E-11 GRAD(Rho)x -0.1610452E-11 GRAD(Rho)y -0.5202086E-12 GRAD(Rho)z -0.1196289E-11 Laplacian 0.9900812E-01 (-1/4)Del**2(Rho)) -0.2475203E-01 Diamond 0.1286818E-01 Metallicity 0.1661002E+01 Ellipticity -0.3124818E+01 Gb(Abramov) 0.2335355E-01 Vb(Abramov) -0.2195506E-01 Hb(Abramov) 0.1398483E-02 Ex_ueg -0.5896495E-02 Ec_ueg -0.1175136E-02 Delta_ex -0.6136924E-02 Delta_ec 0.1446562E-02 Delta_et -0.1301899E-01 Pxc 0.5017714E+01 Qxc -0.4242421E+01 3,+1 147 3 -1 1.940888 -0.871683 3.007372 Rho 0.1436307E+00 |GRAD(Rho)| 0.4138587E-12 GRAD(Rho)x 0.2988465E-12 GRAD(Rho)y 0.2245378E-12 GRAD(Rho)z -0.1776304E-12 Laplacian 0.5647082E+00 (-1/4)Del**2(Rho)) -0.1411770E+00 Diamond 0.1095000E+01 Metallicity 0.4806931E+01 Ellipticity 0.3986986E-01 Gb(Abramov) 0.2072227E+00 Vb(Abramov) -0.2732684E+00 Hb(Abramov) -0.6604570E-01 Ex_ueg -0.5555393E-01 Ec_ueg -0.8037042E-02 Delta_ex -0.6009497E-01 Delta_ec 0.1464682E-01 Delta_et -0.1941300E+00 Pxc 0.6912236E+01 Qxc -0.4102936E+01 3,-1 148 3 -1 2.910662 -0.010819 0.020320 Rho 0.5223472E-02 |GRAD(Rho)| 0.2273785E-16 GRAD(Rho)x 0.1265745E-16 GRAD(Rho)y 0.1585675E-16 GRAD(Rho)z 0.1026461E-16 Laplacian 0.2110330E-01 (-1/4)Del**2(Rho)) -0.5275826E-02 Diamond 0.5972418E-03 Metallicity 0.5134855E+00 Ellipticity 0.5132694E+01 Gb(Abramov) 0.3968727E-02 Vb(Abramov) -0.2661629E-02 Hb(Abramov) 0.1307099E-02 Ex_ueg -0.6693667E-03 Ec_ueg -0.1565424E-03 Delta_ex -0.1124126E-02 Delta_ec 0.7823156E-03 Delta_et -0.4257380E-02 Pxc 0.4275946E+01 Qxc -0.1436921E+01 3,-1 149 3 -1 3.145261 0.030110 3.189521 Rho 0.2359973E+00 |GRAD(Rho)| 0.1075087E-14 GRAD(Rho)x -0.7688078E-15 GRAD(Rho)y -0.1684308E-15 GRAD(Rho)z -0.7323786E-15 Laplacian 0.8716962E+00 (-1/4)Del**2(Rho)) -0.2179241E+00 Diamond 0.3015732E+01 Metallicity 0.7124587E+01 Ellipticity 0.5126233E-02 Gb(Abramov) 0.4040525E+00 Vb(Abramov) -0.5901810E+00 Hb(Abramov) -0.1861285E+00 Ex_ueg -0.1077113E+00 Ec_ueg -0.1416286E-01 Delta_ex -0.1048279E+00 Delta_ec 0.1929960E-01 Delta_et -0.2669418E+00 Pxc 0.7605193E+01 Qxc -0.5431610E+01 3,-1 150 3 -1 -1.689360 0.539557 1.742365 Rho 0.5027217E-01 |GRAD(Rho)| 0.8236090E-16 GRAD(Rho)x -0.8030169E-16 GRAD(Rho)y 0.1511975E-16 GRAD(Rho)z 0.1031263E-16 Laplacian 0.1909088E+00 (-1/4)Del**2(Rho)) -0.4772721E-01 Diamond 0.9457967E-01 Metallicity 0.2471723E+01 Ellipticity 0.9328420E-02 Gb(Abramov) 0.5147954E-01 Vb(Abramov) -0.5523188E-01 Hb(Abramov) -0.3752339E-02 Ex_ueg -0.1370320E-01 Ec_ueg -0.2429924E-02 Delta_ex -0.1561098E-01 Delta_ec 0.5465469E-02 Delta_et -0.5764960E-01 Pxc 0.5639352E+01 Qxc -0.2856294E+01 3,-1 151 3 -1 -1.729035 0.459959 -2.816365 Rho 0.1356836E+00 |GRAD(Rho)| 0.2781706E-13 GRAD(Rho)x -0.1802635E-13 GRAD(Rho)y -0.2087524E-13 GRAD(Rho)z 0.3614415E-14 Laplacian 0.5687434E+00 (-1/4)Del**2(Rho)) -0.1421859E+00 Diamond 0.1035664E+01 Metallicity 0.4340862E+01 Ellipticity 0.1215288E-01 Gb(Abramov) 0.1976588E+00 Vb(Abramov) -0.2531317E+00 Hb(Abramov) -0.5547290E-01 Ex_ueg -0.5149381E-01 Ec_ueg -0.7533459E-02 Delta_ex -0.5975867E-01 Delta_ec 0.1507266E-01 Delta_et -0.1982635E+00 Pxc 0.6835348E+01 Qxc -0.3964706E+01 3,-1 152 3 -1 1.821219 -0.631443 -3.008849 Rho 0.2368578E+00 |GRAD(Rho)| 0.8377396E-13 GRAD(Rho)x -0.7569867E-13 GRAD(Rho)y -0.1238869E-13 GRAD(Rho)z 0.3367949E-13 Laplacian 0.9067270E+00 (-1/4)Del**2(Rho)) -0.2266818E+00 Diamond 0.3128345E+01 Metallicity 0.6891008E+01 Ellipticity 0.1203953E-01 Gb(Abramov) 0.4114655E+00 Vb(Abramov) -0.5962492E+00 Hb(Abramov) -0.1847837E+00 Ex_ueg -0.1082352E+00 Ec_ueg -0.1422217E-01 Delta_ex -0.1090231E+00 Delta_ec 0.1983748E-01 Delta_et -0.2734770E+00 Pxc 0.7610316E+01 Qxc -0.5495813E+01 3,-1 153 3 -1 1.677168 -0.578152 1.674186 Rho 0.4452337E-01 |GRAD(Rho)| 0.8955870E-16 GRAD(Rho)x -0.5509822E-16 GRAD(Rho)y -0.4817712E-16 GRAD(Rho)z -0.5161311E-16 Laplacian 0.1670061E+00 (-1/4)Del**2(Rho)) -0.4175152E-01 Diamond 0.6972470E-01 Metallicity 0.2307779E+01 Ellipticity 0.3168656E-01 Gb(Abramov) 0.4389323E-01 Vb(Abramov) -0.4603493E-01 Hb(Abramov) -0.2141707E-02 Ex_ueg -0.1165473E-01 Ec_ueg -0.2114460E-02 Delta_ex -0.1322265E-01 Delta_ec 0.4748321E-02 Delta_et -0.4851868E-01 Pxc 0.5511919E+01 Qxc -0.2784701E+01 3,-1 154 3 -1 3.225249 3.164605 0.053324 Rho 0.2362409E+00 |GRAD(Rho)| 0.1953188E-14 GRAD(Rho)x 0.1595620E-14 GRAD(Rho)y -0.1234906E-15 GRAD(Rho)z -0.1119683E-14 Laplacian 0.8675011E+00 (-1/4)Del**2(Rho)) -0.2168753E+00 Diamond 0.3007365E+01 Metallicity 0.7171361E+01 Ellipticity 0.5373023E-02 Gb(Abramov) 0.4037986E+00 Vb(Abramov) -0.5907220E+00 Hb(Abramov) -0.1869234E+00 Ex_ueg -0.1078595E+00 Ec_ueg -0.1417964E-01 Delta_ex -0.1043646E+00 Delta_ec 0.1922435E-01 Delta_et -0.2660130E+00 Pxc 0.7606645E+01 Qxc -0.5428772E+01 3,-1 155 3 -1 1.822392 2.749899 0.529945 Rho 0.1175702E+00 |GRAD(Rho)| 0.4453147E-13 GRAD(Rho)x 0.3380771E-13 GRAD(Rho)y -0.6500490E-14 GRAD(Rho)z -0.2824595E-13 Laplacian 0.4977323E+00 (-1/4)Del**2(Rho)) -0.1244331E+00 Diamond 0.7565633E+00 Metallicity 0.3906425E+01 Ellipticity 0.1154135E-01 Gb(Abramov) 0.1639701E+00 Vb(Abramov) -0.2035072E+00 Hb(Abramov) -0.3953706E-01 Ex_ueg -0.4253843E-01 Ec_ueg -0.6401172E-02 Delta_ex -0.5044758E-01 Delta_ec 0.1348491E-01 Delta_et -0.1728538E+00 Pxc 0.6645414E+01 Qxc -0.3741041E+01 3,-1 156 3 -1 -2.978560 0.871827 2.039160 Rho 0.1405113E+00 |GRAD(Rho)| 0.1368864E-15 GRAD(Rho)x 0.6640738E-17 GRAD(Rho)y 0.1200889E-15 GRAD(Rho)z -0.6536384E-16 Laplacian 0.5569530E+00 (-1/4)Del**2(Rho)) -0.1392383E+00 Diamond 0.1045528E+01 Metallicity 0.4698727E+01 Ellipticity 0.4647832E-01 Gb(Abramov) 0.2018659E+00 Vb(Abramov) -0.2644936E+00 Hb(Abramov) -0.6262768E-01 Ex_ueg -0.5395109E-01 Ec_ueg -0.7838898E-02 Delta_ex -0.5888499E-01 Delta_ec 0.1440038E-01 Delta_et -0.1899782E+00 Pxc 0.6882484E+01 Qxc -0.4089127E+01 3,-1 157 3 -1 -0.544812 2.746014 -1.747435 Rho 0.1424806E+00 |GRAD(Rho)| 0.4155901E-15 GRAD(Rho)x -0.8653289E-16 GRAD(Rho)y 0.2527546E-16 GRAD(Rho)z 0.4056949E-15 Laplacian 0.5985065E+00 (-1/4)Del**2(Rho)) -0.1496266E+00 Diamond 0.1138890E+01 Metallicity 0.4475114E+01 Ellipticity 0.1187513E-01 Gb(Abramov) 0.2113504E+00 Vb(Abramov) -0.2730743E+00 Hb(Abramov) -0.6172382E-01 Ex_ueg -0.5496162E-01 Ec_ueg -0.7963918E-02 Delta_ex -0.6345511E-01 Delta_ec 0.1535402E-01 Delta_et -0.2028357E+00 Pxc 0.6901330E+01 Qxc -0.4132801E+01 3,-1 158 3 -1 0.516729 1.657747 -1.711236 Rho 0.5735229E-01 |GRAD(Rho)| 0.1624356E-15 GRAD(Rho)x 0.5418809E-16 GRAD(Rho)y -0.1076596E-15 GRAD(Rho)z 0.1088962E-15 Laplacian 0.2207415E+00 (-1/4)Del**2(Rho)) -0.5518538E-01 Diamond 0.1316325E+00 Metallicity 0.2662648E+01 Ellipticity 0.8140798E-02 Gb(Abramov) 0.6128012E-01 Vb(Abramov) -0.6737487E-01 Hb(Abramov) -0.6094746E-02 Ex_ueg -0.1633501E-01 Ec_ueg -0.2825139E-02 Delta_ex -0.1869639E-01 Delta_ec 0.6364616E-02 Delta_et -0.6944869E-01 Pxc 0.5782020E+01 Qxc -0.2937552E+01 3,-1 159 3 -1 -0.058046 3.157096 -3.133035 Rho 0.2360849E+00 |GRAD(Rho)| 0.1068934E-14 GRAD(Rho)x -0.1595675E-15 GRAD(Rho)y 0.6727474E-15 GRAD(Rho)z -0.8152116E-15 Laplacian 0.8901488E+00 (-1/4)Del**2(Rho)) -0.2225372E+00 Diamond 0.3064069E+01 Metallicity 0.6981214E+01 Ellipticity 0.1367330E-02 Gb(Abramov) 0.4072881E+00 Vb(Abramov) -0.5920390E+00 Hb(Abramov) -0.1847509E+00 Ex_ueg -0.1077646E+00 Ec_ueg -0.1416889E-01 Delta_ex -0.1069655E+00 Delta_ec 0.1954203E-01 Delta_et -0.2695877E+00 Pxc 0.7605715E+01 Qxc -0.5473612E+01 3,-1 160 3 -1 0.088269 3.191657 3.145583 Rho 0.2342340E+00 |GRAD(Rho)| 0.2057527E-10 GRAD(Rho)x 0.4032924E-11 GRAD(Rho)y 0.1398618E-10 GRAD(Rho)z 0.1454181E-10 Laplacian 0.8758780E+00 (-1/4)Del**2(Rho)) -0.2189695E+00 Diamond 0.2992614E+01 Metallicity 0.7002496E+01 Ellipticity 0.2303075E-02 Gb(Abramov) 0.4015352E+00 Vb(Abramov) -0.5841009E+00 Hb(Abramov) -0.1825657E+00 Ex_ueg -0.1066396E+00 Ec_ueg -0.1404144E-01 Delta_ex -0.1050681E+00 Delta_ec 0.1933328E-01 Delta_et -0.2668943E+00 Pxc 0.7594632E+01 Qxc -0.5434570E+01 3,-1 161 3 -1 2.696743 -0.625172 -1.840818 Rho 0.1385510E+00 |GRAD(Rho)| 0.8594682E-13 GRAD(Rho)x -0.1574331E-13 GRAD(Rho)y 0.5074969E-13 GRAD(Rho)z -0.6755348E-13 Laplacian 0.5710123E+00 (-1/4)Del**2(Rho)) -0.1427531E+00 Diamond 0.1063293E+01 Metallicity 0.4476964E+01 Ellipticity 0.5590965E-02 Gb(Abramov) 0.2016855E+00 Vb(Abramov) -0.2606178E+00 Hb(Abramov) -0.5893238E-01 Ex_ueg -0.5294982E-01 Ec_ueg -0.7714689E-02 Delta_ex -0.6026856E-01 Delta_ec 0.1499854E-01 Delta_et -0.1978246E+00 Pxc 0.6863507E+01 Qxc -0.4018296E+01 3,-1 162 3 -1 -2.066940 -0.932120 -3.255850 Rho 0.2327183E+00 |GRAD(Rho)| 0.1249487E-13 GRAD(Rho)x 0.6567500E-14 GRAD(Rho)y 0.1060979E-13 GRAD(Rho)z 0.6496539E-15 Laplacian 0.8943696E+00 (-1/4)Del**2(Rho)) -0.2235924E+00 Diamond 0.3011715E+01 Metallicity 0.6783912E+01 Ellipticity 0.1503377E-01 Gb(Abramov) 0.4018668E+00 Vb(Abramov) -0.5801412E+00 Hb(Abramov) -0.1782744E+00 Ex_ueg -0.1057204E+00 Ec_ueg -0.1393720E-01 Delta_ex -0.1069923E+00 Delta_ec 0.1957816E-01 Delta_et -0.2693480E+00 Pxc 0.7585487E+01 Qxc -0.5464880E+01 3,-1 163 3 -1 1.726483 1.662482 -0.572579 Rho 0.4115663E-01 |GRAD(Rho)| 0.2384691E-15 GRAD(Rho)x -0.1164124E-15 GRAD(Rho)y -0.1933717E-15 GRAD(Rho)z -0.7696152E-16 Laplacian 0.1530587E+00 (-1/4)Del**2(Rho)) -0.3826468E-01 Diamond 0.5713775E-01 Metallicity 0.2208792E+01 Ellipticity 0.1724940E-01 Gb(Abramov) 0.3959624E-01 Vb(Abramov) -0.4092780E-01 Hb(Abramov) -0.1331560E-02 Ex_ueg -0.1049474E-01 Ec_ueg -0.1932218E-02 Delta_ex -0.1186549E-01 Delta_ec 0.4326228E-02 Delta_et -0.4329401E-01 Pxc 0.5431446E+01 Qxc -0.2742687E+01 3,-1 164 3 -1 0.566884 2.777461 1.757703 Rho 0.1621213E+00 |GRAD(Rho)| 0.6614385E-15 GRAD(Rho)x 0.1133804E-15 GRAD(Rho)y 0.2001912E-15 GRAD(Rho)z -0.6201365E-15 Laplacian 0.6761553E+00 (-1/4)Del**2(Rho)) -0.1690388E+00 Diamond 0.1504111E+01 Metallicity 0.4912473E+01 Ellipticity 0.2074538E-01 Gb(Abramov) 0.2510923E+00 Vb(Abramov) -0.3331458E+00 Hb(Abramov) -0.8205349E-01 Ex_ueg -0.6528877E-01 Ec_ueg -0.9223913E-02 Delta_ex -0.7401894E-01 Delta_ec 0.1682127E-01 Delta_et -0.2262314E+00 Pxc 0.7078207E+01 Qxc -0.4400317E+01 3,-1 165 3 -1 0.537898 1.782678 2.728570 Rho 0.1451495E+00 |GRAD(Rho)| 0.1753851E-15 GRAD(Rho)x 0.2241588E-16 GRAD(Rho)y 0.9600610E-16 GRAD(Rho)z -0.1450527E-15 Laplacian 0.6066740E+00 (-1/4)Del**2(Rho)) -0.1516685E+00 Diamond 0.1184809E+01 Metallicity 0.4553555E+01 Ellipticity 0.1100170E-01 Gb(Abramov) 0.2162175E+00 Vb(Abramov) -0.2807664E+00 Hb(Abramov) -0.6454896E-01 Ex_ueg -0.5633858E-01 Ec_ueg -0.8133741E-02 Delta_ex -0.6465890E-01 Delta_ec 0.1557366E-01 Delta_et -0.2064730E+00 Pxc 0.6926528E+01 Qxc -0.4151811E+01 3,-1 166 3 -1 0.881231 1.989813 -2.965321 Rho 0.1463013E+00 |GRAD(Rho)| 0.7606226E-15 GRAD(Rho)x -0.7323379E-15 GRAD(Rho)y 0.2053479E-15 GRAD(Rho)z 0.7752046E-17 Laplacian 0.5795685E+00 (-1/4)Del**2(Rho)) -0.1448921E+00 Diamond 0.1140629E+01 Metallicity 0.4829720E+01 Ellipticity 0.6192630E-01 Gb(Abramov) 0.2132262E+00 Vb(Abramov) -0.2815602E+00 Hb(Abramov) -0.6833403E-01 Ex_ueg -0.5693543E-01 Ec_ueg -0.8207165E-02 Delta_ex -0.6186857E-01 Delta_ec 0.1481143E-01 Delta_et -0.1965093E+00 Pxc 0.6937283E+01 Qxc -0.4177083E+01 3,-1 167 3 -1 3.104668 -3.195973 -0.088454 Rho 0.2297944E+00 |GRAD(Rho)| 0.4168673E-15 GRAD(Rho)x 0.4007753E-15 GRAD(Rho)y -0.1111849E-15 GRAD(Rho)z -0.2820281E-16 Laplacian 0.8620126E+00 (-1/4)Del**2(Rho)) -0.2155032E+00 Diamond 0.2881932E+01 Metallicity 0.6891790E+01 Ellipticity 0.1626053E-01 Gb(Abramov) 0.3912025E+00 Vb(Abramov) -0.5669019E+00 Hb(Abramov) -0.1756994E+00 Ex_ueg -0.1039532E+00 Ec_ueg -0.1373649E-01 Delta_ex -0.1029117E+00 Delta_ec 0.1917185E-01 Delta_et -0.2646237E+00 Pxc 0.7567669E+01 Qxc -0.5367855E+01 3,-1 168 3 -1 -0.539130 1.759741 -2.737660 Rho 0.1463753E+00 |GRAD(Rho)| 0.4053303E-14 GRAD(Rho)x 0.2188774E-14 GRAD(Rho)y 0.3320315E-14 GRAD(Rho)z 0.7836071E-15 Laplacian 0.6229917E+00 (-1/4)Del**2(Rho)) -0.1557479E+00 Diamond 0.1225608E+01 Metallicity 0.4496874E+01 Ellipticity 0.1733063E-01 Gb(Abramov) 0.2205617E+00 Vb(Abramov) -0.2853755E+00 Hb(Abramov) -0.6481381E-01 Ex_ueg -0.5697384E-01 Ec_ueg -0.8211887E-02 Delta_ex -0.6649959E-01 Delta_ec 0.1589665E-01 Delta_et -0.2108726E+00 Pxc 0.6937972E+01 Qxc -0.4183245E+01 3,-1 169 3 -1 -0.502628 -0.403972 -0.413179 Rho 0.1426801E+00 |GRAD(Rho)| 0.5881205E-11 GRAD(Rho)x 0.3893211E-11 GRAD(Rho)y 0.3079521E-11 GRAD(Rho)z 0.3154050E-11 Laplacian 0.7678632E+00 (-1/4)Del**2(Rho)) -0.1919658E+00 Diamond 0.1764756E+01 Metallicity 0.3496243E+01 Ellipticity 0.3297260E-01 Gb(Abramov) 0.2398371E+00 Vb(Abramov) -0.2877083E+00 Hb(Abramov) -0.4787125E-01 Ex_ueg -0.5506423E-01 Ec_ueg -0.7976594E-02 Delta_ex -0.8464524E-01 Delta_ec 0.2541722E-01 Delta_et -0.3481378E+00 Pxc 0.6903226E+01 Qxc -0.3330233E+01 3,-1 170 3 -1 0.336559 -0.441790 0.342958 Rho 0.1377840E+00 |GRAD(Rho)| 0.4828478E-14 GRAD(Rho)x -0.2798422E-14 GRAD(Rho)y 0.2769243E-14 GRAD(Rho)z -0.2795412E-14 Laplacian 0.7189114E+00 (-1/4)Del**2(Rho)) -0.1797278E+00 Diamond 0.1586946E+01 Metallicity 0.3523188E+01 Ellipticity 0.7157722E-02 Gb(Abramov) 0.2253544E+00 Vb(Abramov) -0.2709809E+00 Hb(Abramov) -0.4562655E-01 Ex_ueg -0.5255937E-01 Ec_ueg -0.7666161E-02 Delta_ex -0.7864553E-01 Delta_ec 0.2403042E-01 Delta_et -0.3269430E+00 Pxc 0.6856022E+01 Qxc -0.3272749E+01 3,-1 171 3 -1 2.673686 -1.823709 -0.610534 Rho 0.1455709E+00 |GRAD(Rho)| 0.1245703E-14 GRAD(Rho)x -0.3487540E-15 GRAD(Rho)y -0.9657531E-15 GRAD(Rho)z 0.7053142E-15 Laplacian 0.6022544E+00 (-1/4)Del**2(Rho)) -0.1505636E+00 Diamond 0.1185140E+01 Metallicity 0.4609188E+01 Ellipticity 0.9250095E-02 Gb(Abramov) 0.2160384E+00 Vb(Abramov) -0.2815131E+00 Hb(Abramov) -0.6547477E-01 Ex_ueg -0.5655678E-01 Ec_ueg -0.8160596E-02 Delta_ex -0.6428377E-01 Delta_ec 0.1553915E-01 Delta_et -0.2063001E+00 Pxc 0.6930471E+01 Qxc -0.4136892E+01 3,-1 172 3 -1 -1.961157 0.884651 3.037833 Rho 0.1538515E+00 |GRAD(Rho)| 0.4353013E-13 GRAD(Rho)x -0.2596544E-13 GRAD(Rho)y -0.3155191E-13 GRAD(Rho)z -0.1500486E-13 Laplacian 0.6028167E+00 (-1/4)Del**2(Rho)) -0.1507042E+00 Diamond 0.1262323E+01 Metallicity 0.5049684E+01 Ellipticity 0.5311444E-01 Gb(Abramov) 0.2273042E+00 Vb(Abramov) -0.3039042E+00 Hb(Abramov) -0.7660003E-01 Ex_ueg -0.6088647E-01 Ec_ueg -0.8690521E-02 Delta_ex -0.6517058E-01 Delta_ec 0.1524910E-01 Delta_et -0.2038226E+00 Pxc 0.7006078E+01 Qxc -0.4273733E+01 3,-1 173 3 -1 -3.206072 3.129041 -0.064966 Rho 0.2322653E+00 |GRAD(Rho)| 0.1608871E-11 GRAD(Rho)x 0.1092435E-11 GRAD(Rho)y -0.1150114E-11 GRAD(Rho)z 0.2688682E-12 Laplacian 0.8664772E+00 (-1/4)Del**2(Rho)) -0.2166193E+00 Diamond 0.2930350E+01 Metallicity 0.6979589E+01 Ellipticity 0.9056927E-02 Gb(Abramov) 0.3963985E+00 Vb(Abramov) -0.5761777E+00 Hb(Abramov) -0.1797792E+00 Ex_ueg -0.1054462E+00 Ec_ueg -0.1390607E-01 Delta_ex -0.1037107E+00 Delta_ec 0.1917102E-01 Delta_et -0.2645594E+00 Pxc 0.7582742E+01 Qxc -0.5409764E+01 3,-1 174 3 -1 0.860841 2.974485 -1.936932 Rho 0.1398025E+00 |GRAD(Rho)| 0.7135996E-13 GRAD(Rho)x 0.3337852E-13 GRAD(Rho)y -0.2766826E-13 GRAD(Rho)z 0.5667968E-13 Laplacian 0.5506211E+00 (-1/4)Del**2(Rho)) -0.1376553E+00 Diamond 0.1029292E+01 Metallicity 0.4712866E+01 Ellipticity 0.4442790E-01 Gb(Abramov) 0.1998953E+00 Vb(Abramov) -0.2621354E+00 Hb(Abramov) -0.6224006E-01 Ex_ueg -0.5358849E-01 Ec_ueg -0.7793956E-02 Delta_ex -0.5816482E-01 Delta_ec 0.1429154E-01 Delta_et -0.1884758E+00 Pxc 0.6875647E+01 Qxc -0.4069877E+01 3,-1 175 3 -1 -1.988135 -3.070386 -0.737019 Rho 0.1491608E+00 |GRAD(Rho)| 0.7253541E-15 GRAD(Rho)x -0.2786535E-15 GRAD(Rho)y 0.4574656E-15 GRAD(Rho)z 0.4890972E-15 Laplacian 0.5573948E+00 (-1/4)Del**2(Rho)) -0.1393487E+00 Diamond 0.1149391E+01 Metallicity 0.5186505E+01 Ellipticity 0.1141221E+00 Gb(Abramov) 0.2133546E+00 Vb(Abramov) -0.2873605E+00 Hb(Abramov) -0.7400589E-01 Ex_ueg -0.5842401E-01 Ec_ueg -0.8389815E-02 Delta_ex -0.6005164E-01 Delta_ec 0.1465336E-01 Delta_et -0.1960364E+00 Pxc 0.6963682E+01 Qxc -0.4098148E+01 3,-1 176 3 -1 2.004990 2.974547 -0.852179 Rho 0.1401117E+00 |GRAD(Rho)| 0.1686557E-15 GRAD(Rho)x -0.1470449E-16 GRAD(Rho)y -0.1607736E-15 GRAD(Rho)z 0.4878910E-16 Laplacian 0.5475762E+00 (-1/4)Del**2(Rho)) -0.1368940E+00 Diamond 0.1030347E+01 Metallicity 0.4756558E+01 Ellipticity 0.3221063E-01 Gb(Abramov) 0.1997868E+00 Vb(Abramov) -0.2626795E+00 Hb(Abramov) -0.6289273E-01 Ex_ueg -0.5374661E-01 Ec_ueg -0.7813559E-02 Delta_ex -0.5791819E-01 Delta_ec 0.1428330E-01 Delta_et -0.1885931E+00 Pxc 0.6878634E+01 Qxc -0.4054957E+01 3,-1 177 3 -1 -0.764222 -3.443973 -1.283197 Rho 0.3083268E+00 |GRAD(Rho)| 0.9615265E-15 GRAD(Rho)x 0.8483725E-15 GRAD(Rho)y 0.3774286E-15 GRAD(Rho)z 0.2496896E-15 Laplacian -0.1578321E+01 (-1/4)Del**2(Rho)) 0.3945802E+00 Diamond 0.5330487E+01 Metallicity -0.6143795E+01 Ellipticity 0.2327474E-02 Gb(Abramov) 0.1409831E+00 Vb(Abramov) -0.6765465E+00 Hb(Abramov) -0.5355633E+00 Ex_ueg -0.1538391E+00 Ec_ueg -0.1929038E-01 Delta_ex 0.1546832E+00 Delta_ec 0.5544685E-01 Delta_et -0.1294868E+01 Pxc 0.7974912E+01 Qxc 0.2789757E+01 3,-1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 76 117 113 137 136 135 170 169 119 75 158 168 157 166 174 159 85 165 164 143 144 160 127 171 121 138 122 167 163 99 155 98 176 154 108 130 109 131 111 173 70 54 132 53 175 141 64 57 151 102 162 105 150 103 67 156 172 106 153 94 92 140 147 149 88 161 152 95 129 97 104 148 125 133 77 84 134 177 1 1 1 1 1 1 2 2 2 2 3 3 3 3 3 3 4 4 4 4 4 4 5 5 5 5 5 5 6 6 6 6 6 6 7 7 7 7 7 7 8 8 8 8 8 8 9 9 9 9 9 9 10 10 10 10 10 10 11 11 11 11 11 11 12 12 12 12 12 12 17 18 21 21 22 25 28 37 13 24 26 33 39 41 13 14 15 16 15 23 25 34 40 43 16 22 27 35 38 44 13 18 28 29 39 45 15 20 27 31 40 46 16 19 25 32 38 47 14 17 26 30 37 48 14 19 23 30 36 49 16 17 24 32 35 50 13 20 22 29 33 51 15 18 21 31 34 42 19 20 28 36 24 27 52 52 2.423923 1.983710 1.893208 1.965476 1.909082 1.738982 1.656904 1.640440 1.662702 1.665630 2.326281 1.920631 1.933573 1.934188 1.952082 1.749170 2.357413 1.927478 1.883448 2.002496 1.912395 1.752328 2.333021 1.924685 1.775077 2.128028 2.011822 1.759809 2.469239 1.925874 2.009520 1.835343 1.951418 1.749382 2.373045 1.814650 1.946001 1.961816 2.030866 1.755732 2.268170 1.931879 1.996862 1.910007 1.934454 1.750047 2.248933 2.213251 1.949767 1.993205 1.754201 1.765377 2.382723 1.958412 1.901944 1.950338 1.915192 1.748725 2.434278 1.945754 1.961907 1.865642 1.941417 1.749667 2.398340 1.944025 1.748520 2.200116 1.979256 1.761531 3.201943 3.288014 3.076794 3.114282 3.186734 3.193637 1.706809 1.007181 2.424503 1.984233 1.893853 1.966237 1.909751 1.739001 1.656910 1.640515 1.662712 1.665640 2.326965 1.920982 1.934054 1.934711 1.952609 1.749181 2.358061 1.927831 1.883804 2.003002 1.912857 1.752339 2.333629 1.925064 1.775179 2.128499 2.012346 1.759824 2.469838 1.926269 2.009889 1.835671 1.951925 1.749394 2.373599 1.814996 1.946332 1.962306 2.031338 1.755745 2.269005 1.932340 1.997313 1.910513 1.935526 1.750069 2.249768 2.213601 1.950168 1.993753 1.754208 1.765409 2.383419 1.958829 1.902455 1.950903 1.915665 1.748734 2.434939 1.946166 1.962345 1.866058 1.941928 1.749681 2.399043 1.944407 1.748539 2.200601 1.979782 1.761553 3.216238 3.291619 3.092732 3.116774 3.193367 3.197842 1.708800 1.007289 27 23 24 25 23 21 21 20 21 25 27 23 25 23 23 22 32 23 23 23 23 25 29 23 22 25 26 23 29 23 25 23 23 24 27 22 25 23 25 22 27 23 27 23 23 22 26 26 25 23 23 24 27 27 26 25 23 23 27 25 24 23 28 25 27 25 23 25 23 23 35 35 33 33 35 35 25 17 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 Mo Si W W W W W W W W 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 O O O O O O O O O O O O H 2.3096 2.3919 2.4482 2.4657 2.3704 2.4277 2.4305 2.4583 2.3908 2.4478 2.4302 2.3392 -1.1596 -1.1219 -1.1637 -1.1656 -0.9605 -0.9919 -0.9183 -0.9739 -0.7739 -0.9669 -0.9818 -0.9312 -0.9686 -0.9252 -0.9635 -0.8368 -0.9660 -0.9945 -0.9494 -0.9858 -0.9463 -0.9909 -0.9792 -0.8085 -0.8100 -0.9877 -0.9398 -0.9809 -0.7445 -0.8558 -0.8186 -0.8325 -0.8471 -0.8280 -0.8416 -0.8143 -0.8553 -0.8211 -0.8260 0.3168 1.9549 2.3129 2.1069 2.0960 2.1326 2.1086 2.1067 2.1205 2.1362 2.0988 2.1056 2.1379 1.8976 1.8973 1.8974 1.8952 1.9321 1.9306 1.9432 1.9300 1.9674 1.9312 1.9295 1.9344 1.9308 1.9363 1.9325 1.9601 1.9442 1.9405 1.9458 1.9402 1.9413 1.9397 1.9405 1.9563 1.8760 1.9406 1.9440 1.9393 1.9708 1.9552 1.9608 1.9579 1.9563 1.9596 1.9576 1.9598 1.9533 1.9602 1.9595 0.5268 6.0886 6.7090 6.1027 6.0903 6.1150 6.1009 6.0983 6.0982 6.0943 6.0972 6.1041 6.1180 5.2339 5.1969 5.2381 5.2413 4.9990 5.0313 4.9440 5.0140 4.7708 5.0067 5.0226 4.9686 5.0080 4.9604 5.0012 4.8438 4.9916 5.0209 4.9728 5.0140 4.9753 5.0193 5.0070 4.8191 4.9038 5.0168 4.9659 5.0097 4.7421 4.8688 4.8241 4.8414 4.8587 4.8347 4.8514 4.8210 4.8707 4.8271 4.8327 0.1564 3.6470 0.5861 3.3119 3.3178 3.3528 3.3331 3.3346 3.2931 3.3498 3.3262 3.3303 3.3763 0.0281 0.0277 0.0282 0.0290 0.0293 0.0300 0.0311 0.0298 0.0357 0.0290 0.0297 0.0281 0.0298 0.0284 0.0298 0.0329 0.0302 0.0330 0.0308 0.0316 0.0297 0.0318 0.0317 0.0331 0.0302 0.0302 0.0299 0.0319 0.0316 0.0318 0.0337 0.0331 0.0321 0.0337 0.0326 0.0334 0.0313 0.0338 0.0337 0.0000 0.0000 0.0000 14.0302 14.0302 14.0293 14.0296 14.0299 14.0300 14.0290 14.0300 14.0298 14.0286 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 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 Mo Si W W W W W W W W 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 O O O O O O O O O O O O H 3.179669 1.773717 2.518462 2.510798 2.484509 2.501284 2.496081 2.535311 2.499239 2.509523 2.507190 2.467098 -1.102219 -1.021239 -1.062678 -1.067847 -0.967407 -0.984462 -0.947208 -0.975706 -0.836199 -0.979315 -0.972423 -1.072424 -0.976331 -1.089145 -0.972686 -0.802593 -0.967536 -0.963542 -0.960860 -0.973276 -1.076792 -0.973494 -0.969851 -0.858076 -0.635567 -0.980108 -1.087084 -0.969954 -1.017940 -0.905207 -0.857877 -0.876877 -0.895603 -0.869346 -0.887624 -0.852977 -0.903202 -0.861272 -0.867246 0.058310 2.356927 1.371013 1.933887 1.928808 1.917493 1.929677 1.919717 1.963711 1.946358 1.934768 1.931544 1.927849 -0.788601 -0.717015 -0.733906 -0.737784 -0.718767 -0.726436 -0.739724 -0.725338 -0.725003 -0.727842 -0.714276 -0.825718 -0.726904 -0.825363 -0.737112 -0.670494 -0.818534 -0.788374 -0.818654 -0.804590 -0.883306 -0.803533 -0.807341 -0.765957 -0.811816 -0.823706 -0.886033 -0.800324 -0.807877 -0.825124 -0.771176 -0.789316 -0.808124 -0.779387 -0.800012 -0.752715 -0.830145 -0.769802 -0.775122 0.299499 2.449730 1.319521 2.040263 2.032438 2.005802 2.030773 2.020093 2.069595 2.035567 2.038992 2.035417 2.012024 -0.832248 -0.786466 -0.795430 -0.799348 -0.808751 -0.807815 -0.793597 -0.814074 -0.735078 -0.808197 -0.808888 -0.895235 -0.802605 -0.928612 -0.812543 -0.738961 -0.851199 -0.816859 -0.837524 -0.844858 -0.917031 -0.849223 -0.833782 -0.753348 -0.818481 -0.857203 -0.926260 -0.830646 -0.768497 -0.797642 -0.736077 -0.756757 -0.771128 -0.748209 -0.766271 -0.731776 -0.813356 -0.735517 -0.739466 0.378743 0.21361274 -2.85339569 2.16807398 3.58999195 -20.38114374 4.99179474 -3.54549245 16.49941091 5.52000858 3.88173283 -379.4674 406.7992 -26.8873 -404.9318 -58.5227 -463.0101 Apr20-2024 10:16:34 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 0 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 Apr20-2024 10:16:35 Nodes: 1 Procs: 1 Silicon (TZP, 1s frozen) 0 Apr20-2024 10:16:36 Nodes: 1 Procs: 1 Apr20-2024 10:16:36 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Apr20-2024 10:16:37 Nodes: 1 Procs: 1 Apr20-2024 10:16:37 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Apr20-2024 10:16:38 Nodes: 1 Procs: 1 Apr20-2024 10:16:39 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Apr20-2024 10:16:41 Nodes: 1 Procs: 28 *** (NO TITLE) *** -7 -16.42772336 -16.83249946 -16.76496007 -16.70029645 -16.86880549 -16.95545199 -16.97946493 -16.98327758 -16.98800907 -16.98822349 -16.99053217 -16.99577292 -17.00057479 -17.00327886 -17.00296801 -17.00931386 -17.01131704 -17.01326156 -17.01445066 -17.01469259 -17.01498404 -17.01506296 -17.01513605 -17.01519813 -17.01524600 -17.01527065 -17.01529042 -17.01529772 -17.01530345 -17.01530802 GEOMETRY CONVERGED