ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun12-2024 20:34:10 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.50 0.05 3.14 1 2 3 1 2 3 1 2 3 4 2.000 0.000 0.000 3.000 0.000 0.000 10.000 0.000 0.000 0.000 -14.453 3.868 46.848 -5.206 2.716 28.135 -40.711 6.242 57.060 417.392 S S S P P P D D D D D S P P S D P S D D 1 1 1 2 2 2 3 3 3 4 10.00 2.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -40.7110 -14.4532 -5.2063 2.7160 3.8682 6.2422 28.1350 46.8475 57.0600 417.3918 1 As 0.0000 2.0000 3.0000 10.0000 0.0000 Jun12-2024 20:34:10 Nodes: 1 Procs: 1 Jun12-2024 20:34:13 Nodes: 1 Procs: 1 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun12-2024 20:34:17 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.60 0.05 2.46 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 Jun12-2024 20:34:10 Nodes: 1 Procs: 1 Jun12-2024 20:34:13 Nodes: 1 Procs: 1 0 Jun12-2024 20:34:17 Nodes: 1 Procs: 1 Jun12-2024 20:34:19 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun12-2024 20:34:22 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.98 0.06 1.86 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 Jun12-2024 20:34:10 Nodes: 1 Procs: 1 Jun12-2024 20:34:13 Nodes: 1 Procs: 1 0 Jun12-2024 20:34:17 Nodes: 1 Procs: 1 Jun12-2024 20:34:19 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Jun12-2024 20:34:22 Nodes: 1 Procs: 1 Jun12-2024 20:34:24 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun12-2024 20:34:27 Arsenic (TZP, 3p frozen) c5-1 c5-1 c5-1 c5-1 c5-1 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.69 0.07 3.33 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 Jun12-2024 20:34:10 Nodes: 1 Procs: 1 Jun12-2024 20:34:13 Nodes: 1 Procs: 1 0 Jun12-2024 20:34:17 Nodes: 1 Procs: 1 Jun12-2024 20:34:19 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Jun12-2024 20:34:22 Nodes: 1 Procs: 1 Jun12-2024 20:34:24 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun12-2024 20:34:27 Nodes: 1 Procs: 1 Jun12-2024 20:34:29 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun12-2024 20:34:35 Arsenic (TZP, 3p frozen) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP 2129.8775999999975 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225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 -7.477 -7.449 -7.333 -7.327 -7.289 -7.178 -7.174 -7.169 -6.920 -6.919 -4.750 -4.707 -4.403 -4.348 -4.267 -3.933 -3.834 -3.801 -3.763 -3.739 A A A A A A A A A A A A A A A A A A A A 0.00000000087366 0.00055227007584 0.00023107178300 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 42 42 42 42 42 42 42 42 42 74 74 74 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 33 0.138381 -2.480378 2.662638 0.085772 2.450356 -2.672033 -0.101043 2.466141 2.653637 2.458723 2.677829 -0.136356 -2.458869 2.649234 0.106213 -2.469812 -2.658675 -0.082821 -2.681914 -0.138788 -2.469160 2.659983 -0.087627 2.463766 2.641992 0.113512 -2.468662 -0.120139 -2.458208 -2.617800 2.468399 -2.619708 0.116375 -2.622805 0.105044 2.455654 0.993830 -0.981380 0.968609 -0.977080 -0.985958 -0.981746 0.972644 0.991865 -0.983380 -0.976799 0.960344 0.985708 -3.021340 -1.175013 1.115209 3.013751 -1.184126 -1.116967 -2.995922 1.177217 -1.152362 3.017892 1.171831 1.144698 1.170916 -1.115978 -2.992755 1.177343 1.124263 3.029017 -1.181132 1.145144 -3.036847 -1.183272 -1.140704 2.986216 -1.117896 3.014521 -1.174480 -1.146354 -3.028688 1.177122 1.146551 3.002307 1.189310 1.117696 -2.993162 -1.168605 3.415537 -1.571885 1.507869 -3.443945 -1.556936 -1.506757 3.426989 1.539524 -1.476101 -3.412727 1.539219 1.479567 1.542255 -1.499650 3.434629 1.567552 1.513394 -3.420103 -1.551511 1.482317 3.418257 -1.541084 -1.475264 -3.427600 -1.503867 -3.411933 -1.561926 -1.481972 3.417538 1.549101 1.476259 -3.429865 1.541722 1.505842 3.443537 -1.550731 -0.201480 -3.669277 3.851890 0.205050 -3.649017 -3.825805 -0.214966 3.664602 -3.848752 0.209687 3.659148 3.846536 3.652741 -3.834310 -0.204058 3.666518 3.850862 0.199824 -3.651486 3.841628 -0.212253 -3.670363 -3.847500 0.218488 -3.864717 0.196929 -3.667273 -3.828661 -0.208083 3.651685 3.846111 0.214171 3.666890 3.836118 -0.209442 -3.657495 0.006525 -0.001522 -0.007700 1 3 -3 0.138381 -2.480378 2.662638 Rho 0.1240648E+06 3,-3 2 3 -3 0.085772 2.450356 -2.672033 Rho 0.1240647E+06 3,-3 3 3 -3 -0.101043 2.466141 2.653637 Rho 0.1240648E+06 3,-3 4 3 -3 2.458723 2.677829 -0.136356 Rho 0.1240648E+06 3,-3 5 3 -3 -2.458869 2.649234 0.106213 Rho 0.1240648E+06 3,-3 6 3 -3 -2.469812 -2.658675 -0.082821 Rho 0.1240648E+06 3,-3 7 3 -3 -2.681914 -0.138788 -2.469160 Rho 0.1240648E+06 3,-3 8 3 -3 2.659983 -0.087627 2.463766 Rho 0.1240647E+06 3,-3 9 3 -3 2.641992 0.113512 -2.468662 Rho 0.1240648E+06 3,-3 10 3 -3 -0.120139 -2.458208 -2.617800 Rho 0.4361414E+07 3,-3 11 3 -3 2.468399 -2.619708 0.116375 Rho 0.4361414E+07 3,-3 12 3 -3 -2.622805 0.105044 2.455654 Rho 0.4361414E+07 3,-3 13 3 -3 0.993830 -0.981380 0.968609 Rho 0.3190202E+03 3,-3 14 3 -3 -0.977080 -0.985958 -0.981746 Rho 0.3190228E+03 3,-3 15 3 -3 0.972644 0.991865 -0.983380 Rho 0.3190365E+03 3,-3 16 3 -3 -0.976799 0.960344 0.985708 Rho 0.3190223E+03 3,-3 17 3 -3 -3.021340 -1.175013 1.115209 Rho 0.3189418E+03 3,-3 18 3 -3 3.013751 -1.184126 -1.116967 Rho 0.3189578E+03 3,-3 19 3 -3 -2.995922 1.177217 -1.152362 Rho 0.3190266E+03 3,-3 20 3 -3 3.017892 1.171831 1.144698 Rho 0.3190651E+03 3,-3 21 3 -3 1.170916 -1.115978 -2.992755 Rho 0.3189403E+03 3,-3 22 3 -3 1.177343 1.124263 3.029017 Rho 0.3190313E+03 3,-3 23 3 -3 -1.181132 1.145144 -3.036847 Rho 0.3190651E+03 3,-3 24 3 -3 -1.183272 -1.140704 2.986216 Rho 0.3189558E+03 3,-3 25 3 -3 -1.117896 3.014521 -1.174480 Rho 0.3190302E+03 3,-3 26 3 -3 -1.146354 -3.028688 1.177122 Rho 0.3190524E+03 3,-3 27 3 -3 1.146551 3.002307 1.189310 Rho 0.3190233E+03 3,-3 28 3 -3 1.117696 -2.993162 -1.168605 Rho 0.3188838E+03 3,-3 29 3 -3 3.415537 -1.571885 1.507869 Rho 0.3190622E+03 3,-3 30 3 -3 -3.443945 -1.556936 -1.506757 Rho 0.3191398E+03 3,-3 31 3 -3 3.426989 1.539524 -1.476101 Rho 0.3191291E+03 3,-3 32 3 -3 -3.412727 1.539219 1.479567 Rho 0.3190504E+03 3,-3 33 3 -3 1.542255 -1.499650 3.434629 Rho 0.3191432E+03 3,-3 34 3 -3 1.567552 1.513394 -3.420103 Rho 0.3191248E+03 3,-3 35 3 -3 -1.551511 1.482317 3.418257 Rho 0.3190703E+03 3,-3 36 3 -3 -1.541084 -1.475264 -3.427600 Rho 0.3190456E+03 3,-3 37 3 -3 -1.503867 -3.411933 -1.561926 Rho 0.3190609E+03 3,-3 38 3 -3 -1.481972 3.417538 1.549101 Rho 0.3191261E+03 3,-3 39 3 -3 1.476259 -3.429865 1.541722 Rho 0.3190465E+03 3,-3 40 3 -3 1.505842 3.443537 -1.550731 Rho 0.3191544E+03 3,-3 41 3 -3 -0.201480 -3.669277 3.851890 Rho 0.3195438E+03 3,-3 42 3 -3 0.205050 -3.649017 -3.825805 Rho 0.3193940E+03 3,-3 43 3 -3 -0.214966 3.664602 -3.848752 Rho 0.3195377E+03 3,-3 44 3 -3 0.209687 3.659148 3.846536 Rho 0.3195458E+03 3,-3 45 3 -3 3.652741 -3.834310 -0.204058 Rho 0.3193987E+03 3,-3 46 3 -3 3.666518 3.850862 0.199824 Rho 0.3195406E+03 3,-3 47 3 -3 -3.651486 3.841628 -0.212253 Rho 0.3195409E+03 3,-3 48 3 -3 -3.670363 -3.847500 0.218488 Rho 0.3195399E+03 3,-3 49 3 -3 -3.864717 0.196929 -3.667273 Rho 0.3195377E+03 3,-3 50 3 -3 -3.828661 -0.208083 3.651685 Rho 0.3193954E+03 3,-3 51 3 -3 3.846111 0.214171 3.666890 Rho 0.3195419E+03 3,-3 52 3 -3 3.836118 -0.209442 -3.657495 Rho 0.3195456E+03 3,-3 53 3 -3 0.006525 -0.001522 -0.007700 Rho 0.4276078E+05 3,-3 54 3 +1 -1.666067 0.534157 -0.534862 Rho 0.8583630E-02 |GRAD(Rho)| 0.1240815E-11 GRAD(Rho)x 0.2887632E-12 GRAD(Rho)y 0.4773390E-12 GRAD(Rho)z 0.1108325E-11 Laplacian 0.3331476E-01 (-1/4)Del**2(Rho)) -0.8328690E-02 Diamond 0.9110864E-03 Metallicity 0.7443231E+00 Ellipticity -0.1478793E+01 Gb(Abramov) 0.6585666E-02 Vb(Abramov) -0.4842642E-02 Hb(Abramov) 0.1743024E-02 Ex_ueg -0.1298015E-02 Ec_ueg -0.3042478E-03 Delta_ex -0.1531086E-02 Delta_ec 0.4864174E-03 Delta_et -0.3308687E-02 Pxc 0.4266309E+01 Qxc -0.3147678E+01 3,+1 55 3 +3 -2.322423 -0.005578 -0.020608 Rho 0.4641887E-02 |GRAD(Rho)| 0.1161122E-12 GRAD(Rho)x -0.2865193E-13 GRAD(Rho)y -0.2927869E-13 GRAD(Rho)z -0.1086457E-12 Laplacian 0.1891855E-01 (-1/4)Del**2(Rho)) -0.4729637E-02 Diamond 0.1698996E-03 Metallicity 0.4704892E+00 Ellipticity -0.3100332E+00 Gb(Abramov) 0.3523965E-02 Vb(Abramov) -0.2318293E-02 Hb(Abramov) 0.1205672E-02 Ex_ueg -0.5718882E-03 Ec_ueg -0.1315344E-03 Delta_ex -0.6921506E-03 Delta_ec 0.1758980E-03 Delta_et -0.1105187E-02 Pxc 0.4347821E+01 Qxc -0.3934954E+01 3,+3 56 3 +1 -1.672223 -0.549639 0.510600 Rho 0.8753421E-02 |GRAD(Rho)| 0.1965147E-13 GRAD(Rho)x 0.1386531E-13 GRAD(Rho)y 0.1295929E-13 GRAD(Rho)z -0.5098066E-14 Laplacian 0.3415577E-01 (-1/4)Del**2(Rho)) -0.8538944E-02 Diamond 0.9333977E-03 Metallicity 0.7500877E+00 Ellipticity -0.1449202E+01 Gb(Abramov) 0.6760122E-02 Vb(Abramov) -0.4981300E-02 Hb(Abramov) 0.1778822E-02 Ex_ueg -0.1332362E-02 Ec_ueg -0.3118498E-03 Delta_ex -0.1566075E-02 Delta_ec 0.4783073E-03 Delta_et -0.3285973E-02 Pxc 0.4272447E+01 Qxc -0.3274204E+01 3,+1 57 3 -1 -1.759946 0.521779 1.684165 Rho 0.5007999E-01 |GRAD(Rho)| 0.1166682E-12 GRAD(Rho)x 0.8696714E-13 GRAD(Rho)y 0.3819649E-13 GRAD(Rho)z -0.6774367E-13 Laplacian 0.2041413E+00 (-1/4)Del**2(Rho)) -0.5103533E-01 Diamond 0.1029332E+00 Metallicity 0.2296798E+01 Ellipticity 0.1639728E-01 Gb(Abramov) 0.5355985E-01 Vb(Abramov) -0.5608438E-01 Hb(Abramov) -0.2524528E-02 Ex_ueg -0.1363340E-01 Ec_ueg -0.2419296E-02 Delta_ex -0.1677673E-01 Delta_ec 0.6022882E-02 Delta_et -0.6351955E-01 Pxc 0.5635274E+01 Qxc -0.2785499E+01 3,-1 58 3 +1 1.672326 -0.518558 -0.551804 Rho 0.8874542E-02 |GRAD(Rho)| 0.1755274E-16 GRAD(Rho)x 0.1322215E-16 GRAD(Rho)y 0.1154163E-16 GRAD(Rho)z 0.2535706E-18 Laplacian 0.3426835E-01 (-1/4)Del**2(Rho)) -0.8567087E-02 Diamond 0.9563544E-03 Metallicity 0.7649444E+00 Ellipticity -0.1469713E+01 Gb(Abramov) 0.6803616E-02 Vb(Abramov) -0.5040144E-02 Hb(Abramov) 0.1763472E-02 Ex_ueg -0.1356999E-02 Ec_ueg -0.3172805E-03 Delta_ex -0.1577666E-02 Delta_ec 0.4815567E-03 Delta_et -0.3318620E-02 Pxc 0.4276970E+01 Qxc -0.3276180E+01 3,+1 59 3 +3 -1.111204 1.105611 -1.136201 Rho 0.5002573E-02 |GRAD(Rho)| 0.3255060E-14 GRAD(Rho)x 0.2015866E-14 GRAD(Rho)y -0.1900317E-14 GRAD(Rho)z 0.1708946E-14 Laplacian 0.1935704E-01 (-1/4)Del**2(Rho)) -0.4839261E-02 Diamond 0.1366174E-03 Metallicity 0.5209106E+00 Ellipticity -0.1093565E+00 Gb(Abramov) 0.3646311E-02 Vb(Abramov) -0.2453361E-02 Hb(Abramov) 0.1192950E-02 Ex_ueg -0.6318922E-03 Ec_ueg -0.1470235E-03 Delta_ex -0.6701164E-03 Delta_ec 0.8749855E-04 Delta_et -0.6863135E-03 Pxc 0.4297898E+01 Qxc -0.7658600E+01 3,+3 60 3 +1 0.527559 1.669572 0.548695 Rho 0.8558137E-02 |GRAD(Rho)| 0.3669770E-13 GRAD(Rho)x 0.1035137E-13 GRAD(Rho)y -0.8764647E-14 GRAD(Rho)z -0.3409914E-13 Laplacian 0.3311901E-01 (-1/4)Del**2(Rho)) -0.8279754E-02 Diamond 0.8998681E-03 Metallicity 0.7450198E+00 Ellipticity -0.1478480E+01 Gb(Abramov) 0.6547933E-02 Vb(Abramov) -0.4816111E-02 Hb(Abramov) 0.1731821E-02 Ex_ueg -0.1292877E-02 Ec_ueg -0.3031074E-03 Delta_ex -0.1519953E-02 Delta_ec 0.4817756E-03 Delta_et -0.3275981E-02 Pxc 0.4265410E+01 Qxc -0.3154898E+01 3,+1 61 3 -1 -2.041502 0.832562 2.948609 Rho 0.1262907E+00 |GRAD(Rho)| 0.1456700E-15 GRAD(Rho)x -0.5048994E-16 GRAD(Rho)y -0.3176712E-16 GRAD(Rho)z -0.1328961E-15 Laplacian 0.4955864E+00 (-1/4)Del**2(Rho)) -0.1238966E+00 Diamond 0.8229043E+00 Metallicity 0.4420241E+01 Ellipticity 0.2176154E-01 Gb(Abramov) 0.1738732E+00 Vb(Abramov) -0.2238498E+00 Hb(Abramov) -0.4997662E-01 Ex_ueg -0.4679651E-01 Ec_ueg -0.6943534E-02 Delta_ex -0.5111915E-01 Delta_ec 0.1324726E-01 Delta_et -0.1720034E+00 Pxc 0.6739581E+01 Qxc -0.3858848E+01 3,-1 62 3 -1 -3.065442 -0.892192 -1.949427 Rho 0.1593714E+00 |GRAD(Rho)| 0.2040678E-15 GRAD(Rho)x -0.1884614E-15 GRAD(Rho)y 0.7524363E-16 GRAD(Rho)z -0.2154852E-16 Laplacian 0.6183358E+00 (-1/4)Del**2(Rho)) -0.1545840E+00 Diamond 0.1336230E+01 Metallicity 0.5220827E+01 Ellipticity 0.7269303E-01 Gb(Abramov) 0.2375653E+00 Vb(Abramov) -0.3205467E+00 Hb(Abramov) -0.8298136E-01 Ex_ueg -0.6381638E-01 Ec_ueg -0.9046091E-02 Delta_ex -0.6729904E-01 Delta_ec 0.1526457E-01 Delta_et -0.2043840E+00 Pxc 0.7054581E+01 Qxc -0.4408841E+01 3,-1 63 3 +1 -2.907912 -0.180091 -0.190898 Rho 0.5324826E-02 |GRAD(Rho)| 0.1097185E-17 GRAD(Rho)x 0.1387304E-19 GRAD(Rho)y 0.8110066E-18 GRAD(Rho)z -0.7388435E-18 Laplacian 0.2195849E-01 (-1/4)Del**2(Rho)) -0.5489622E-02 Diamond 0.5328204E-03 Metallicity 0.5095496E+00 Ellipticity -0.2595253E+01 Gb(Abramov) 0.4125954E-02 Vb(Abramov) -0.2762286E-02 Hb(Abramov) 0.1363668E-02 Ex_ueg -0.6867399E-03 Ec_ueg -0.1609181E-03 Delta_ex -0.1084258E-02 Delta_ec 0.6541445E-03 Delta_et -0.3635272E-02 Pxc 0.4267637E+01 Qxc -0.1657521E+01 3,+1 64 3 -1 -2.908517 0.014673 -0.004914 Rho 0.5373306E-02 |GRAD(Rho)| 0.2669413E-15 GRAD(Rho)x 0.9254791E-16 GRAD(Rho)y 0.1490819E-15 GRAD(Rho)z 0.2011644E-15 Laplacian 0.2151430E-01 (-1/4)Del**2(Rho)) -0.5378575E-02 Diamond 0.6360449E-03 Metallicity 0.5279855E+00 Ellipticity 0.3254665E+01 Gb(Abramov) 0.4059018E-02 Vb(Abramov) -0.2739461E-02 Hb(Abramov) 0.1319557E-02 Ex_ueg -0.6950892E-03 Ec_ueg -0.1630129E-03 Delta_ex -0.1155005E-02 Delta_ec 0.8029656E-03 Delta_et -0.4405728E-02 Pxc 0.4264013E+01 Qxc -0.1438424E+01 3,-1 65 3 -1 -3.275416 -0.063701 3.103280 Rho 0.2508122E+00 |GRAD(Rho)| 0.1113530E-14 GRAD(Rho)x 0.8460030E-15 GRAD(Rho)y 0.2657380E-15 GRAD(Rho)z -0.6735064E-15 Laplacian 0.9185551E+00 (-1/4)Del**2(Rho)) -0.2296388E+00 Diamond 0.3409068E+01 Metallicity 0.7483230E+01 Ellipticity 0.1799691E-02 Gb(Abramov) 0.4394991E+00 Vb(Abramov) -0.6493595E+00 Hb(Abramov) -0.2098604E+00 Ex_ueg -0.1168198E+00 Ec_ueg -0.1518973E-01 Delta_ex -0.1121848E+00 Delta_ec 0.1987675E-01 Delta_et -0.2749732E+00 Pxc 0.7690712E+01 Qxc -0.5644020E+01 3,-1 66 3 -1 -3.314335 0.040270 -3.110580 Rho 0.2400147E+00 |GRAD(Rho)| 0.1286905E-12 GRAD(Rho)x 0.8867440E-13 GRAD(Rho)y -0.2729994E-13 GRAD(Rho)z 0.8917856E-13 Laplacian 0.8589915E+00 (-1/4)Del**2(Rho)) -0.2147479E+00 Diamond 0.3051080E+01 Metallicity 0.7436251E+01 Ellipticity 0.2428173E-02 Gb(Abramov) 0.4093184E+00 Vb(Abramov) -0.6038890E+00 Hb(Abramov) -0.1945706E+00 Ex_ueg -0.1101629E+00 Ec_ueg -0.1444013E-01 Delta_ex -0.1038537E+00 Delta_ec 0.1909760E-01 Delta_et -0.2650748E+00 Pxc 0.7628944E+01 Qxc -0.5438049E+01 3,-1 67 3 -1 -2.961623 -2.065142 -0.827735 Rho 0.1044632E+00 |GRAD(Rho)| 0.2164319E-15 GRAD(Rho)x -0.1330655E-15 GRAD(Rho)y 0.1509379E-15 GRAD(Rho)z -0.7971258E-16 Laplacian 0.4061908E+00 (-1/4)Del**2(Rho)) -0.1015477E+00 Diamond 0.5307209E+00 Metallicity 0.3930870E+01 Ellipticity 0.1796197E-01 Gb(Abramov) 0.1342269E+00 Vb(Abramov) -0.1669062E+00 Hb(Abramov) -0.3267924E-01 Ex_ueg -0.3633592E-01 Ec_ueg -0.5596201E-02 Delta_ex -0.3996136E-01 Delta_ec 0.1116603E-01 Delta_et -0.1398283E+00 Pxc 0.6492962E+01 Qxc -0.3578833E+01 3,-1 68 3 +1 0.170868 2.903562 -0.158015 Rho 0.5246557E-02 |GRAD(Rho)| 0.1542497E-13 GRAD(Rho)x 0.1066918E-14 GRAD(Rho)y 0.1905630E-14 GRAD(Rho)z 0.1526957E-13 Laplacian 0.2149706E-01 (-1/4)Del**2(Rho)) -0.5374266E-02 Diamond 0.5261260E-03 Metallicity 0.5077984E+00 Ellipticity -0.3098953E+01 Gb(Abramov) 0.4037684E-02 Vb(Abramov) -0.2701103E-02 Hb(Abramov) 0.1336581E-02 Ex_ueg -0.6733139E-03 Ec_ueg -0.1575385E-03 Delta_ex -0.1071242E-02 Delta_ec 0.6633951E-03 Delta_et -0.3660663E-02 Pxc 0.4273963E+01 Qxc -0.1614787E+01 3,+1 69 3 +1 -1.753790 -1.762030 1.730407 Rho 0.1191145E-01 |GRAD(Rho)| 0.1724675E-16 GRAD(Rho)x 0.2827699E-17 GRAD(Rho)y 0.1315766E-16 GRAD(Rho)z 0.1078567E-16 Laplacian 0.5946895E-01 (-1/4)Del**2(Rho)) -0.1486724E-01 Diamond 0.2359568E-02 Metallicity 0.7198864E+00 Ellipticity -0.1253137E+01 Gb(Abramov) 0.1169528E-01 Vb(Abramov) -0.8523320E-02 Hb(Abramov) 0.3171959E-02 Ex_ueg -0.2009114E-02 Ec_ueg -0.4554828E-03 Delta_ex -0.2917667E-02 Delta_ec 0.7722802E-03 Delta_et -0.5780042E-02 Pxc 0.4410955E+01 Qxc -0.3777990E+01 3,+1 70 3 -1 -3.097386 3.286923 -0.063411 Rho 0.2403587E+00 |GRAD(Rho)| 0.1972686E-13 GRAD(Rho)x 0.1492692E-13 GRAD(Rho)y -0.1172012E-13 GRAD(Rho)z 0.5382860E-14 Laplacian 0.8598201E+00 (-1/4)Del**2(Rho)) -0.2149550E+00 Diamond 0.3059843E+01 Metallicity 0.7446838E+01 Ellipticity 0.1624086E-02 Gb(Abramov) 0.4100925E+00 Vb(Abramov) -0.6052301E+00 Hb(Abramov) -0.1951375E+00 Ex_ueg -0.1103735E+00 Ec_ueg -0.1446391E-01 Delta_ex -0.1039956E+00 Delta_ec 0.1911316E-01 Delta_et -0.2653277E+00 Pxc 0.7630958E+01 Qxc -0.5441048E+01 3,-1 71 3 -1 -2.744798 -1.872150 0.545132 Rho 0.1178767E+00 |GRAD(Rho)| 0.1309521E-14 GRAD(Rho)x 0.2620246E-15 GRAD(Rho)y -0.9908998E-15 GRAD(Rho)z -0.8150490E-15 Laplacian 0.4895710E+00 (-1/4)Del**2(Rho)) -0.1223927E+00 Diamond 0.7374309E+00 Metallicity 0.3988816E+01 Ellipticity 0.7044434E-02 Gb(Abramov) 0.1629622E+00 Vb(Abramov) -0.2035316E+00 Hb(Abramov) -0.4056944E-01 Ex_ueg -0.4268634E-01 Ec_ueg -0.6420142E-02 Delta_ex -0.4952661E-01 Delta_ec 0.1303359E-01 Delta_et -0.1667932E+00 Pxc 0.6648815E+01 Qxc -0.3799920E+01 3,-1 72 3 +1 0.527704 -1.657489 -0.535158 Rho 0.9264935E-02 |GRAD(Rho)| 0.2009229E-14 GRAD(Rho)x 0.1255768E-14 GRAD(Rho)y -0.1556226E-14 GRAD(Rho)z 0.1954664E-15 Laplacian 0.3616406E-01 (-1/4)Del**2(Rho)) -0.9041016E-02 Diamond 0.1053407E-02 Metallicity 0.7787653E+00 Ellipticity -0.1456969E+01 Gb(Abramov) 0.7200816E-02 Vb(Abramov) -0.5360615E-02 Hb(Abramov) 0.1840200E-02 Ex_ueg -0.1437170E-02 Ec_ueg -0.3348285E-03 Delta_ex -0.1676388E-02 Delta_ec 0.4958944E-03 Delta_et -0.3465083E-02 Pxc 0.4292259E+01 Qxc -0.3380535E+01 3,+1 73 3 +1 -2.179053 -1.419773 -1.067161 Rho 0.2591760E-01 |GRAD(Rho)| 0.4257613E-14 GRAD(Rho)x -0.1553153E-14 GRAD(Rho)y -0.3309387E-14 GRAD(Rho)z 0.2182417E-14 Laplacian 0.1024529E+00 (-1/4)Del**2(Rho)) -0.2561324E-01 Diamond 0.1391458E-01 Metallicity 0.1526675E+01 Ellipticity -0.3408324E+01 Gb(Abramov) 0.2359267E-01 Vb(Abramov) -0.2157211E-01 Hb(Abramov) 0.2020564E-02 Ex_ueg -0.5664715E-02 Ec_ueg -0.1135024E-02 Delta_ex -0.6416456E-02 Delta_ec 0.1707699E-02 Delta_et -0.1521363E-01 Pxc 0.4990833E+01 Qxc -0.3757371E+01 3,+1 74 3 +1 -2.903740 0.158373 0.132449 Rho 0.5351654E-02 |GRAD(Rho)| 0.3605699E-17 GRAD(Rho)x 0.1166949E-17 GRAD(Rho)y -0.2499469E-17 GRAD(Rho)z 0.2322058E-17 Laplacian 0.2187644E-01 (-1/4)Del**2(Rho)) -0.5469111E-02 Diamond 0.5500609E-03 Metallicity 0.5157626E+00 Ellipticity -0.3204878E+01 Gb(Abramov) 0.4116201E-02 Vb(Abramov) -0.2763291E-02 Hb(Abramov) 0.1352910E-02 Ex_ueg -0.6913572E-03 Ec_ueg -0.1620772E-03 Delta_ex -0.1094542E-02 Delta_ec 0.6753678E-03 Delta_et -0.3748811E-02 Pxc 0.4265605E+01 Qxc -0.1620660E+01 3,+1 75 3 +1 -1.737960 1.753698 -1.762884 Rho 0.1168927E-01 |GRAD(Rho)| 0.4922867E-12 GRAD(Rho)x -0.3591136E-12 GRAD(Rho)y 0.1206554E-12 GRAD(Rho)z 0.3143659E-12 Laplacian 0.5802440E-01 (-1/4)Del**2(Rho)) -0.1450610E-01 Diamond 0.2247241E-02 Metallicity 0.7150148E+00 Ellipticity -0.1250473E+01 Gb(Abramov) 0.1139941E-01 Vb(Abramov) -0.8292726E-02 Hb(Abramov) 0.3106688E-02 Ex_ueg -0.1959304E-02 Ec_ueg -0.4452438E-03 Delta_ex -0.2833806E-02 Delta_ec 0.7554765E-03 Delta_et -0.5626729E-02 Pxc 0.4400518E+01 Qxc -0.3751017E+01 3,+1 76 3 -1 -2.817097 -0.580692 1.737607 Rho 0.1562913E+00 |GRAD(Rho)| 0.6905119E-12 GRAD(Rho)x 0.7469700E-13 GRAD(Rho)y 0.4759389E-12 GRAD(Rho)z 0.4946809E-12 Laplacian 0.6551277E+00 (-1/4)Del**2(Rho)) -0.1637819E+00 Diamond 0.1388043E+01 Metallicity 0.4769927E+01 Ellipticity 0.1856068E-01 Gb(Abramov) 0.2393926E+00 Vb(Abramov) -0.3150033E+00 Hb(Abramov) -0.7561067E-01 Ex_ueg -0.6217723E-01 Ec_ueg -0.8847455E-02 Delta_ex -0.7100719E-01 Delta_ec 0.1633898E-01 Delta_et -0.2184413E+00 Pxc 0.7027697E+01 Qxc -0.4345876E+01 3,-1 77 3 +1 -0.510441 -0.556532 1.659098 Rho 0.8812059E-02 |GRAD(Rho)| 0.1203482E-16 GRAD(Rho)x 0.4240578E-17 GRAD(Rho)y 0.2078824E-17 GRAD(Rho)z -0.1106946E-16 Laplacian 0.3445024E-01 (-1/4)Del**2(Rho)) -0.8612559E-02 Diamond 0.9607267E-03 Metallicity 0.7519979E+00 Ellipticity -0.1462616E+01 Gb(Abramov) 0.6821143E-02 Vb(Abramov) -0.5029728E-02 Hb(Abramov) 0.1791415E-02 Ex_ueg -0.1344275E-02 Ec_ueg -0.3144782E-03 Delta_ex -0.1586912E-02 Delta_ec 0.4907429E-03 Delta_et -0.3370449E-02 Pxc 0.4274622E+01 Qxc -0.3233692E+01 3,+1 78 3 -1 -2.941094 2.049633 0.825741 Rho 0.1153018E+00 |GRAD(Rho)| 0.1691391E-15 GRAD(Rho)x 0.1681259E-15 GRAD(Rho)y 0.1103176E-16 GRAD(Rho)z 0.1483324E-16 Laplacian 0.4478382E+00 (-1/4)Del**2(Rho)) -0.1119595E+00 Diamond 0.6576716E+00 Metallicity 0.4202928E+01 Ellipticity 0.2787900E-01 Gb(Abramov) 0.1530660E+00 Vb(Abramov) -0.1941725E+00 Hb(Abramov) -0.4110648E-01 Ex_ueg -0.4144763E-01 Ec_ueg -0.6260958E-02 Delta_ex -0.4507832E-01 Delta_ec 0.1200384E-01 Delta_et -0.1530487E+00 Pxc 0.6620014E+01 Qxc -0.3755324E+01 3,-1 79 3 -1 -1.685998 1.769095 0.536250 Rho 0.4281985E-01 |GRAD(Rho)| 0.2007493E-12 GRAD(Rho)x 0.1904413E-12 GRAD(Rho)y -0.3772513E-13 GRAD(Rho)z -0.5108030E-13 Laplacian 0.1795472E+00 (-1/4)Del**2(Rho)) -0.4488680E-01 Diamond 0.7527298E-01 Metallicity 0.2011452E+01 Ellipticity 0.1041700E-01 Gb(Abramov) 0.4497247E-01 Vb(Abramov) -0.4505815E-01 Hb(Abramov) -0.8567641E-04 Ex_ueg -0.1106399E-01 Ec_ueg -0.2022005E-02 Delta_ex -0.1429857E-01 Delta_ec 0.5502556E-02 Delta_et -0.5571878E-01 Pxc 0.5471793E+01 Qxc -0.2598532E+01 3,-1 80 3 +3 0.028481 -0.023770 2.329600 Rho 0.4587844E-02 |GRAD(Rho)| 0.1065348E-10 GRAD(Rho)x -0.7215516E-11 GRAD(Rho)y -0.6718058E-11 GRAD(Rho)z 0.4037400E-11 Laplacian 0.1877720E-01 (-1/4)Del**2(Rho)) -0.4694299E-02 Diamond 0.1696363E-03 Metallicity 0.4648685E+00 Ellipticity -0.3214474E+00 Gb(Abramov) 0.3493238E-02 Vb(Abramov) -0.2292177E-02 Hb(Abramov) 0.1201061E-02 Ex_ueg -0.5630279E-03 Ec_ueg -0.1292194E-03 Delta_ex -0.6887449E-03 Delta_ec 0.1813995E-03 Delta_et -0.1127138E-02 Pxc 0.4357147E+01 Qxc -0.3796840E+01 3,+3 81 3 +1 0.174322 0.188372 -2.904492 Rho 0.5371616E-02 |GRAD(Rho)| 0.1038204E-16 GRAD(Rho)x 0.1028808E-16 GRAD(Rho)y -0.1380608E-17 GRAD(Rho)z -0.1901439E-18 Laplacian 0.2212974E-01 (-1/4)Del**2(Rho)) -0.5532436E-02 Diamond 0.5462963E-03 Metallicity 0.5130327E+00 Ellipticity -0.2730969E+01 Gb(Abramov) 0.4161344E-02 Vb(Abramov) -0.2790252E-02 Hb(Abramov) 0.1371092E-02 Ex_ueg -0.6947977E-03 Ec_ueg -0.1629398E-03 Delta_ex -0.1097115E-02 Delta_ec 0.6637099E-03 Delta_et -0.3696171E-02 Pxc 0.4264136E+01 Qxc -0.1653004E+01 3,+1 82 3 -1 -2.827332 0.560460 -1.770324 Rho 0.1499033E+00 |GRAD(Rho)| 0.8466995E-14 GRAD(Rho)x 0.5351554E-16 GRAD(Rho)y -0.5898100E-14 GRAD(Rho)z -0.6074500E-14 Laplacian 0.6239078E+00 (-1/4)Del**2(Rho)) -0.1559770E+00 Diamond 0.1238841E+01 Metallicity 0.4672091E+01 Ellipticity 0.2886317E-01 Gb(Abramov) 0.2254411E+00 Vb(Abramov) -0.2949052E+00 Hb(Abramov) -0.6946412E-01 Ex_ueg -0.5881209E-01 Ec_ueg -0.8437324E-02 Delta_ex -0.6674664E-01 Delta_ec 0.1539588E-01 Delta_et -0.2039249E+00 Pxc 0.6970468E+01 Qxc -0.4335358E+01 3,-1 83 3 -1 -3.025184 0.870838 1.924783 Rho 0.1570624E+00 |GRAD(Rho)| 0.6146558E-12 GRAD(Rho)x -0.2457247E-12 GRAD(Rho)y 0.4634449E-12 GRAD(Rho)z -0.3203747E-12 Laplacian 0.6156431E+00 (-1/4)Del**2(Rho)) -0.1539108E+00 Diamond 0.1322287E+01 Metallicity 0.5117655E+01 Ellipticity 0.5374919E-01 Gb(Abramov) 0.2338842E+00 Vb(Abramov) -0.3138577E+00 Hb(Abramov) -0.7997345E-01 Ex_ueg -0.6258658E-01 Ec_ueg -0.8897129E-02 Delta_ex -0.6690420E-01 Delta_ec 0.1550526E-01 Delta_et -0.2078496E+00 Pxc 0.7034469E+01 Qxc -0.4314934E+01 3,-1 84 3 +3 -0.011248 -2.326966 0.024783 Rho 0.4699439E-02 |GRAD(Rho)| 0.1149749E-13 GRAD(Rho)x 0.1978205E-14 GRAD(Rho)y -0.9383485E-14 GRAD(Rho)z 0.6342652E-14 Laplacian 0.1922731E-01 (-1/4)Del**2(Rho)) -0.4806828E-02 Diamond 0.1762678E-03 Metallicity 0.4725394E+00 Ellipticity -0.3006386E+00 Gb(Abramov) 0.3583121E-02 Vb(Abramov) -0.2359414E-02 Hb(Abramov) 0.1223707E-02 Ex_ueg -0.5813617E-03 Ec_ueg -0.1340015E-03 Delta_ex -0.7063548E-03 Delta_ec 0.1799973E-03 Delta_et -0.1132599E-02 Pxc 0.4338473E+01 Qxc -0.3924252E+01 3,+3 85 3 +1 -0.518311 -1.687424 0.546500 Rho 0.8362623E-02 |GRAD(Rho)| 0.2796055E-13 GRAD(Rho)x -0.2028626E-13 GRAD(Rho)y 0.1094057E-13 GRAD(Rho)z -0.1582921E-13 Laplacian 0.3234468E-01 (-1/4)Del**2(Rho)) -0.8086169E-02 Diamond 0.8539430E-03 Metallicity 0.7340313E+00 Ellipticity -0.1472003E+01 Gb(Abramov) 0.6380030E-02 Vb(Abramov) -0.4673890E-02 Hb(Abramov) 0.1706139E-02 Ex_ueg -0.1253647E-02 Ec_ueg -0.2943718E-03 Delta_ex -0.1476916E-02 Delta_ec 0.4724690E-03 Delta_et -0.3191930E-02 Pxc 0.4258718E+01 Qxc -0.3125953E+01 3,+1 86 3 -1 -1.948896 -3.034297 -0.866752 Rho 0.1424705E+00 |GRAD(Rho)| 0.1049674E-15 GRAD(Rho)x -0.2381179E-16 GRAD(Rho)y 0.4981909E-16 GRAD(Rho)z -0.8927050E-16 Laplacian 0.5540857E+00 (-1/4)Del**2(Rho)) -0.1385214E+00 Diamond 0.1047690E+01 Metallicity 0.4833310E+01 Ellipticity 0.6056077E-01 Gb(Abramov) 0.2039338E+00 Vb(Abramov) -0.2693461E+00 Hb(Abramov) -0.6541236E-01 Ex_ueg -0.5495643E-01 Ec_ueg -0.7963276E-02 Delta_ex -0.5867426E-01 Delta_ec 0.1408931E-01 Delta_et -0.1858575E+00 Pxc 0.6901233E+01 Qxc -0.4164453E+01 3,-1 87 3 +1 -2.154356 1.429059 1.032362 Rho 0.2769983E-01 |GRAD(Rho)| 0.6959527E-16 GRAD(Rho)x -0.6832052E-16 GRAD(Rho)y 0.1150950E-16 GRAD(Rho)z 0.6583301E-17 Laplacian 0.1104660E+00 (-1/4)Del**2(Rho)) -0.2761650E-01 Diamond 0.1545986E-01 Metallicity 0.1581902E+01 Ellipticity -0.2821360E+01 Gb(Abramov) 0.2569210E-01 Vb(Abramov) -0.2376770E-01 Hb(Abramov) 0.1924399E-02 Ex_ueg -0.6189960E-02 Ec_ueg -0.1225584E-02 Delta_ex -0.6950083E-02 Delta_ec 0.1675047E-02 Delta_et -0.1518927E-01 Pxc 0.5050621E+01 Qxc -0.4149187E+01 3,+1 88 3 +1 -1.140982 1.296783 2.180829 Rho 0.2829896E-01 |GRAD(Rho)| 0.2051421E-15 GRAD(Rho)x -0.1953287E-15 GRAD(Rho)y -0.5043929E-16 GRAD(Rho)z -0.3722718E-16 Laplacian 0.1156480E+00 (-1/4)Del**2(Rho)) -0.2891201E-01 Diamond 0.1910059E-01 Metallicity 0.1565882E+01 Ellipticity -0.5994105E+01 Gb(Abramov) 0.2682014E-01 Vb(Abramov) -0.2472827E-01 Hb(Abramov) 0.2091869E-02 Ex_ueg -0.6369115E-02 Ec_ueg -0.1256204E-02 Delta_ex -0.7542507E-02 Delta_ec 0.2153035E-02 Delta_et -0.1955775E-01 Pxc 0.5070127E+01 Qxc -0.3503198E+01 3,+1 89 3 -1 -2.725217 1.869302 -0.552581 Rho 0.1109830E+00 |GRAD(Rho)| 0.3059492E-15 GRAD(Rho)x 0.5044251E-16 GRAD(Rho)y 0.1781276E-15 GRAD(Rho)z 0.2435796E-15 Laplacian 0.4596562E+00 (-1/4)Del**2(Rho)) -0.1149141E+00 Diamond 0.6445803E+00 Metallicity 0.3842444E+01 Ellipticity 0.1049067E-01 Gb(Abramov) 0.1502012E+00 Vb(Abramov) -0.1854883E+00 Hb(Abramov) -0.3528713E-01 Ex_ueg -0.3939071E-01 Ec_ueg -0.5995037E-02 Delta_ex -0.4584905E-01 Delta_ec 0.1242576E-01 Delta_et -0.1573316E+00 Pxc 0.6570553E+01 Qxc -0.3689838E+01 3,-1 90 3 -1 2.908141 -0.075432 0.083362 Rho 0.5332185E-02 |GRAD(Rho)| 0.1128811E-12 GRAD(Rho)x 0.2034694E-13 GRAD(Rho)y -0.1094053E-12 GRAD(Rho)z -0.1893772E-13 Laplacian 0.2160734E-01 (-1/4)Del**2(Rho)) -0.5401835E-02 Diamond 0.6179278E-03 Metallicity 0.5190238E+00 Ellipticity 0.7146909E+01 Gb(Abramov) 0.4068504E-02 Vb(Abramov) -0.2735172E-02 Hb(Abramov) 0.1333332E-02 Ex_ueg -0.6880057E-03 Ec_ueg -0.1612360E-03 Delta_ex -0.1146175E-02 Delta_ec 0.7846651E-03 Delta_et -0.4302618E-02 Pxc 0.4267073E+01 Qxc -0.1460719E+01 3,-1 91 3 +3 1.120901 1.111165 1.120389 Rho 0.4993116E-02 |GRAD(Rho)| 0.4223749E-15 GRAD(Rho)x -0.3323765E-15 GRAD(Rho)y -0.2313034E-15 GRAD(Rho)z 0.1201050E-15 Laplacian 0.1933537E-01 (-1/4)Del**2(Rho)) -0.4833844E-02 Diamond 0.1360307E-03 Metallicity 0.5198524E+00 Ellipticity -0.7690785E-01 Gb(Abramov) 0.3641377E-02 Vb(Abramov) -0.2448910E-02 Hb(Abramov) 0.1192467E-02 Ex_ueg -0.6303000E-03 Ec_ueg -0.1466166E-03 Delta_ex -0.6689404E-03 Delta_ec 0.8726673E-04 Delta_et -0.6846469E-03 Pxc 0.4298968E+01 Qxc -0.7665468E+01 3,+3 92 3 -1 -1.690966 -1.787428 -0.523512 Rho 0.4257672E-01 |GRAD(Rho)| 0.6467289E-16 GRAD(Rho)x -0.2852256E-16 GRAD(Rho)y 0.5259545E-16 GRAD(Rho)z 0.2455125E-16 Laplacian 0.1779745E+00 (-1/4)Del**2(Rho)) -0.4449363E-01 Diamond 0.7410783E-01 Metallicity 0.2010060E+01 Ellipticity 0.2414285E-01 Gb(Abramov) 0.4456823E-01 Vb(Abramov) -0.4464283E-01 Hb(Abramov) -0.7460142E-04 Ex_ueg -0.1098031E-01 Ec_ueg -0.2008850E-02 Delta_ex -0.1415707E-01 Delta_ec 0.5461177E-02 Delta_et -0.5521614E-01 Pxc 0.5465969E+01 Qxc -0.2592311E+01 3,-1 93 3 -1 -2.065494 -0.838094 -2.954487 Rho 0.1169360E+00 |GRAD(Rho)| 0.4673913E-13 GRAD(Rho)x -0.3849877E-13 GRAD(Rho)y 0.2140267E-13 GRAD(Rho)z -0.1563064E-13 Laplacian 0.4516503E+00 (-1/4)Del**2(Rho)) -0.1129126E+00 Diamond 0.6751655E+00 Metallicity 0.4266365E+01 Ellipticity 0.2693733E-01 Gb(Abramov) 0.1555628E+00 Vb(Abramov) -0.1982129E+00 Hb(Abramov) -0.4265018E-01 Ex_ueg -0.4223276E-01 Ec_ueg -0.6361934E-02 Delta_ex -0.4562241E-01 Delta_ec 0.1208068E-01 Delta_et -0.1544360E+00 Pxc 0.6638352E+01 Qxc -0.3776476E+01 3,-1 94 3 +3 -0.009951 2.329317 0.027330 Rho 0.4573129E-02 |GRAD(Rho)| 0.3137257E-14 GRAD(Rho)x 0.2237010E-15 GRAD(Rho)y -0.3124071E-14 GRAD(Rho)z -0.1803274E-15 Laplacian 0.1863585E-01 (-1/4)Del**2(Rho)) -0.4658963E-02 Diamond 0.1672753E-03 Metallicity 0.4658932E+00 Ellipticity -0.3292592E+00 Gb(Abramov) 0.3467738E-02 Vb(Abramov) -0.2276514E-02 Hb(Abramov) 0.1191224E-02 Ex_ueg -0.5606214E-03 Ec_ueg -0.1285893E-03 Delta_ex -0.6826352E-03 Delta_ec 0.1793769E-03 Delta_et -0.1114574E-02 Pxc 0.4359782E+01 Qxc -0.3805591E+01 3,+3 95 3 -1 -1.747051 2.821397 -0.575046 Rho 0.1492054E+00 |GRAD(Rho)| 0.3281144E-13 GRAD(Rho)x 0.1741248E-13 GRAD(Rho)y -0.2052914E-13 GRAD(Rho)z -0.1876034E-13 Laplacian 0.6219711E+00 (-1/4)Del**2(Rho)) -0.1554928E+00 Diamond 0.1228646E+01 Metallicity 0.4650332E+01 Ellipticity 0.2662148E-01 Gb(Abramov) 0.2241774E+00 Vb(Abramov) -0.2928619E+00 Hb(Abramov) -0.6868457E-01 Ex_ueg -0.5844731E-01 Ec_ueg -0.8392669E-02 Delta_ex -0.6646832E-01 Delta_ec 0.1537603E-01 Delta_et -0.2035594E+00 Pxc 0.6964091E+01 Qxc -0.4322854E+01 3,-1 96 3 -1 -1.931433 3.034353 0.871135 Rho 0.1484161E+00 |GRAD(Rho)| 0.8930145E-14 GRAD(Rho)x -0.5027364E-14 GRAD(Rho)y 0.7198723E-14 GRAD(Rho)z -0.1628336E-14 Laplacian 0.5767907E+00 (-1/4)Del**2(Rho)) -0.1441977E+00 Diamond 0.1146127E+01 Metallicity 0.4970462E+01 Ellipticity 0.6450468E-01 Gb(Abramov) 0.2155866E+00 Vb(Abramov) -0.2869756E+00 Hb(Abramov) -0.7138894E-01 Ex_ueg -0.5803543E-01 Ec_ueg -0.8342201E-02 Delta_ex -0.6170045E-01 Delta_ec 0.1453002E-01 Delta_et -0.1928111E+00 Pxc 0.6956849E+01 Qxc -0.4246410E+01 3,-1 97 3 -1 -1.888858 0.531459 -2.751919 Rho 0.9915638E-01 |GRAD(Rho)| 0.1286321E-13 GRAD(Rho)x -0.1172618E-13 GRAD(Rho)y -0.2286826E-14 GRAD(Rho)z -0.4767535E-14 Laplacian 0.4100702E+00 (-1/4)Del**2(Rho)) -0.1025176E+00 Diamond 0.5036434E+00 Metallicity 0.3569626E+01 Ellipticity 0.1369000E-01 Gb(Abramov) 0.1293366E+00 Vb(Abramov) -0.1561556E+00 Hb(Abramov) -0.2681904E-01 Ex_ueg -0.3389581E-01 Ec_ueg -0.5273977E-02 Delta_ex -0.3986325E-01 Delta_ec 0.1141958E-01 Delta_et -0.1415713E+00 Pxc 0.6426991E+01 Qxc -0.3490782E+01 3,-1 98 3 +1 -1.075871 2.158399 1.393420 Rho 0.2675686E-01 |GRAD(Rho)| 0.1350651E-15 GRAD(Rho)x 0.7302029E-16 GRAD(Rho)y 0.2425951E-16 GRAD(Rho)z 0.1110049E-15 Laplacian 0.1072073E+00 (-1/4)Del**2(Rho)) -0.2680183E-01 Diamond 0.1589432E-01 Metallicity 0.1538558E+01 Ellipticity -0.4386010E+01 Gb(Abramov) 0.2474058E-01 Vb(Abramov) -0.2267934E-01 Hb(Abramov) 0.2061247E-02 Ex_ueg -0.5910605E-02 Ec_ueg -0.1177570E-02 Delta_ex -0.6839465E-02 Delta_ec 0.1907473E-02 Delta_et -0.1710200E-01 Pxc 0.5019324E+01 Qxc -0.3585617E+01 3,+1 99 3 -1 -1.766093 -2.834694 0.587911 Rho 0.1592182E+00 |GRAD(Rho)| 0.8342018E-15 GRAD(Rho)x 0.3092958E-15 GRAD(Rho)y -0.4040957E-15 GRAD(Rho)z 0.6610110E-15 Laplacian 0.6648580E+00 (-1/4)Del**2(Rho)) -0.1662145E+00 Diamond 0.1416128E+01 Metallicity 0.4847735E+01 Ellipticity 0.3407792E-01 Gb(Abramov) 0.2451036E+00 Vb(Abramov) -0.3239928E+00 Hb(Abramov) -0.7888914E-01 Ex_ueg -0.6373462E-01 Ec_ueg -0.9036201E-02 Delta_ex -0.7217059E-01 Delta_ec 0.1610531E-01 Delta_et -0.2148218E+00 Pxc 0.7053254E+01 Qxc -0.4481169E+01 3,-1 100 3 +1 -0.176850 -2.899583 -0.160211 Rho 0.5396565E-02 |GRAD(Rho)| 0.4757470E-14 GRAD(Rho)x -0.3655422E-14 GRAD(Rho)y -0.1775406E-15 GRAD(Rho)z -0.3039719E-14 Laplacian 0.2231634E-01 (-1/4)Del**2(Rho)) -0.5579085E-02 Diamond 0.5641698E-03 Metallicity 0.5126874E+00 Ellipticity -0.2985339E+01 Gb(Abramov) 0.4196111E-02 Vb(Abramov) -0.2813137E-02 Hb(Abramov) 0.1382974E-02 Ex_ueg -0.6991038E-03 Ec_ueg -0.1640183E-03 Delta_ex -0.1115621E-02 Delta_ec 0.6840140E-03 Delta_et -0.3808327E-02 Pxc 0.4262351E+01 Qxc -0.1630992E+01 3,+1 101 3 +1 -1.336950 -2.179253 -1.118491 Rho 0.2841394E-01 |GRAD(Rho)| 0.2177339E-16 GRAD(Rho)x 0.1131221E-17 GRAD(Rho)y 0.1757984E-16 GRAD(Rho)z 0.1279649E-16 Laplacian 0.1154207E+00 (-1/4)Del**2(Rho)) -0.2885517E-01 Diamond 0.1860955E-01 Metallicity 0.1579605E+01 Ellipticity -0.4769547E+01 Gb(Abramov) 0.2683341E-01 Vb(Abramov) -0.2481165E-01 Hb(Abramov) 0.2021760E-02 Ex_ueg -0.6403642E-02 Ec_ueg -0.1262090E-02 Delta_ex -0.7484501E-02 Delta_ec 0.2057238E-02 Delta_et -0.1871757E-01 Pxc 0.5073838E+01 Qxc -0.3638131E+01 3,+1 102 3 +1 -0.539593 1.671862 -0.521616 Rho 0.8684507E-02 |GRAD(Rho)| 0.6373734E-17 GRAD(Rho)x -0.1935642E-17 GRAD(Rho)y 0.3479750E-17 GRAD(Rho)z 0.4976858E-17 Laplacian 0.3364590E-01 (-1/4)Del**2(Rho)) -0.8411475E-02 Diamond 0.9245546E-03 Metallicity 0.7514895E+00 Ellipticity -0.1473126E+01 Gb(Abramov) 0.6661172E-02 Vb(Abramov) -0.4910870E-02 Hb(Abramov) 0.1750302E-02 Ex_ueg -0.1318394E-02 Ec_ueg -0.3087628E-03 Delta_ex -0.1546254E-02 Delta_ec 0.4830340E-03 Delta_et -0.3302064E-02 Pxc 0.4269926E+01 Qxc -0.3201128E+01 3,+1 103 3 +1 1.754833 1.740508 1.761204 Rho 0.1170133E-01 |GRAD(Rho)| 0.4537878E-14 GRAD(Rho)x 0.3078659E-14 GRAD(Rho)y -0.2462088E-14 GRAD(Rho)z 0.2247736E-14 Laplacian 0.5822985E-01 (-1/4)Del**2(Rho)) -0.1455746E-01 Diamond 0.2262313E-02 Metallicity 0.7137169E+00 Ellipticity -0.1250594E+01 Gb(Abramov) 0.1143663E-01 Vb(Abramov) -0.8315790E-02 Hb(Abramov) 0.3120836E-02 Ex_ueg -0.1961998E-02 Ec_ueg -0.4457988E-03 Delta_ex -0.2845784E-02 Delta_ec 0.7602468E-03 Delta_et -0.5662064E-02 Pxc 0.4401084E+01 Qxc -0.3743237E+01 3,+1 104 3 +1 -0.146927 0.137033 2.897930 Rho 0.5267293E-02 |GRAD(Rho)| 0.8664218E-17 GRAD(Rho)x 0.7990943E-17 GRAD(Rho)y 0.3348379E-17 GRAD(Rho)z -0.4296667E-19 Laplacian 0.2168192E-01 (-1/4)Del**2(Rho)) -0.5420480E-02 Diamond 0.5470022E-03 Metallicity 0.5067898E+00 Ellipticity -0.3628253E+01 Gb(Abramov) 0.4071494E-02 Vb(Abramov) -0.2722508E-02 Hb(Abramov) 0.1348986E-02 Ex_ueg -0.6768645E-03 Ec_ueg -0.1584336E-03 Delta_ex -0.1093008E-02 Delta_ec 0.6900249E-03 Delta_et -0.3803528E-02 Pxc 0.4272228E+01 Qxc -0.1584013E+01 3,+1 105 3 +1 -0.154429 2.906678 0.179253 Rho 0.5223619E-02 |GRAD(Rho)| 0.4144469E-17 GRAD(Rho)x 0.3241037E-17 GRAD(Rho)y 0.1848785E-17 GRAD(Rho)z 0.1803969E-17 Laplacian 0.2156429E-01 (-1/4)Del**2(Rho)) -0.5391071E-02 Diamond 0.5162809E-03 Metallicity 0.5025322E+00 Ellipticity -0.2630083E+01 Gb(Abramov) 0.4045579E-02 Vb(Abramov) -0.2700086E-02 Hb(Abramov) 0.1345493E-02 Ex_ueg -0.6693918E-03 Ec_ueg -0.1565487E-03 Delta_ex -0.1066322E-02 Delta_ec 0.6523490E-03 Delta_et -0.3600377E-02 Pxc 0.4275933E+01 Qxc -0.1634588E+01 3,+1 106 3 +3 -1.101190 -1.142842 1.094612 Rho 0.5066981E-02 |GRAD(Rho)| 0.2472574E-17 GRAD(Rho)x -0.2116674E-17 GRAD(Rho)y 0.6186070E-18 GRAD(Rho)z 0.1118320E-17 Laplacian 0.1970486E-01 (-1/4)Del**2(Rho)) -0.4926214E-02 Diamond 0.1411919E-03 Metallicity 0.5227436E+00 Ellipticity -0.1222943E+00 Gb(Abramov) 0.3713334E-02 Vb(Abramov) -0.2500454E-02 Hb(Abramov) 0.1212880E-02 Ex_ueg -0.6427629E-03 Ec_ueg -0.1497964E-03 Delta_ex -0.6842720E-03 Delta_ec 0.8851916E-04 Delta_et -0.6974146E-03 Pxc 0.4290910E+01 Qxc -0.7730213E+01 3,+3 107 3 -1 -0.879334 -1.924019 -3.030314 Rho 0.1561936E+00 |GRAD(Rho)| 0.4079767E-15 GRAD(Rho)x -0.3028990E-15 GRAD(Rho)y 0.4094218E-16 GRAD(Rho)z -0.2702238E-15 Laplacian 0.6126201E+00 (-1/4)Del**2(Rho)) -0.1531550E+00 Diamond 0.1306975E+01 Metallicity 0.5095583E+01 Ellipticity 0.5521343E-01 Gb(Abramov) 0.2321724E+00 Vb(Abramov) -0.3111897E+00 Hb(Abramov) -0.7901735E-01 Ex_ueg -0.6212541E-01 Ec_ueg -0.8841164E-02 Delta_ex -0.6648374E-01 Delta_ec 0.1544924E-01 Delta_et -0.2069430E+00 Pxc 0.7026837E+01 Qxc -0.4303366E+01 3,-1 108 3 +1 -1.442353 -1.037379 -2.162210 Rho 0.2757550E-01 |GRAD(Rho)| 0.6172397E-16 GRAD(Rho)x 0.2475492E-16 GRAD(Rho)y -0.6418657E-17 GRAD(Rho)z 0.5617689E-16 Laplacian 0.1097961E+00 (-1/4)Del**2(Rho)) -0.2744903E-01 Diamond 0.1523187E-01 Metallicity 0.1579666E+01 Ellipticity -0.2794389E+01 Gb(Abramov) 0.2552607E-01 Vb(Abramov) -0.2360311E-01 Hb(Abramov) 0.1922961E-02 Ex_ueg -0.6152944E-02 Ec_ueg -0.1219241E-02 Delta_ex -0.6895732E-02 Delta_ec 0.1658243E-02 Delta_et -0.1502255E-01 Pxc 0.5046537E+01 Qxc -0.4158458E+01 3,+1 109 3 -1 -1.853709 -0.554226 2.722441 Rho 0.1276079E+00 |GRAD(Rho)| 0.3002066E-13 GRAD(Rho)x -0.1193884E-13 GRAD(Rho)y 0.2677010E-13 GRAD(Rho)z 0.6485806E-14 Laplacian 0.5345664E+00 (-1/4)Del**2(Rho)) -0.1336416E+00 Diamond 0.8964575E+00 Metallicity 0.4169405E+01 Ellipticity 0.1366947E-01 Gb(Abramov) 0.1819621E+00 Vb(Abramov) -0.2302825E+00 Hb(Abramov) -0.4832047E-01 Ex_ueg -0.4744843E-01 Ec_ueg -0.7025909E-02 Delta_ex -0.5524869E-01 Delta_ec 0.1420328E-01 Delta_et -0.1846470E+00 Pxc 0.6753350E+01 Qxc -0.3889854E+01 3,-1 110 3 +1 -0.172594 -0.141405 -2.914084 Rho 0.5377957E-02 |GRAD(Rho)| 0.7858233E-14 GRAD(Rho)x -0.6129317E-14 GRAD(Rho)y 0.1644392E-14 GRAD(Rho)z 0.4634574E-14 Laplacian 0.2199987E-01 (-1/4)Del**2(Rho)) -0.5499967E-02 Diamond 0.5462792E-03 Metallicity 0.5170770E+00 Ellipticity -0.2855047E+01 Gb(Abramov) 0.4140629E-02 Vb(Abramov) -0.2781291E-02 Hb(Abramov) 0.1359338E-02 Ex_ueg -0.6958914E-03 Ec_ueg -0.1632139E-03 Delta_ex -0.1092892E-02 Delta_ec 0.6633145E-03 Delta_et -0.3693797E-02 Pxc 0.4263677E+01 Qxc -0.1647622E+01 3,+1 111 3 +1 1.681553 0.550426 0.516424 Rho 0.8548736E-02 |GRAD(Rho)| 0.7125748E-13 GRAD(Rho)x 0.2324216E-13 GRAD(Rho)y 0.6675937E-13 GRAD(Rho)z 0.8978678E-14 Laplacian 0.3309265E-01 (-1/4)Del**2(Rho)) -0.8273162E-02 Diamond 0.9007978E-03 Metallicity 0.7442488E+00 Ellipticity -0.1481734E+01 Gb(Abramov) 0.6541656E-02 Vb(Abramov) -0.4810151E-02 Hb(Abramov) 0.1731505E-02 Ex_ueg -0.1290984E-02 Ec_ueg -0.3026870E-03 Delta_ex -0.1519681E-02 Delta_ec 0.4838178E-03 Delta_et -0.3287020E-02 Pxc 0.4265080E+01 Qxc -0.3141020E+01 3,+1 112 3 +1 -0.552577 0.521680 -1.692002 Rho 0.8351480E-02 |GRAD(Rho)| 0.2887627E-17 GRAD(Rho)x 0.2010527E-17 GRAD(Rho)y 0.2057958E-17 GRAD(Rho)z 0.2469432E-18 Laplacian 0.3232029E-01 (-1/4)Del**2(Rho)) -0.8080073E-02 Diamond 0.8536076E-03 Metallicity 0.7329544E+00 Ellipticity -0.1473427E+01 Gb(Abramov) 0.6373770E-02 Vb(Abramov) -0.4667466E-02 Hb(Abramov) 0.1706304E-02 Ex_ueg -0.1251420E-02 Ec_ueg -0.2938744E-03 Delta_ex -0.1476179E-02 Delta_ec 0.4736656E-03 Delta_et -0.3197678E-02 Pxc 0.4258349E+01 Qxc -0.3116500E+01 3,+1 113 3 -1 -0.026396 0.018436 2.904801 Rho 0.5280539E-02 |GRAD(Rho)| 0.5376376E-15 GRAD(Rho)x 0.4535854E-15 GRAD(Rho)y -0.2735169E-15 GRAD(Rho)z 0.9221176E-16 Laplacian 0.2128585E-01 (-1/4)Del**2(Rho)) -0.5321461E-02 Diamond 0.6165419E-03 Metallicity 0.5183853E+00 Ellipticity 0.3633286E+01 Gb(Abramov) 0.4007402E-02 Vb(Abramov) -0.2693343E-02 Hb(Abramov) 0.1314059E-02 Ex_ueg -0.6791349E-03 Ec_ueg -0.1590054E-03 Delta_ex -0.1140662E-02 Delta_ec 0.7972169E-03 Delta_et -0.4350086E-02 Pxc 0.4271143E+01 Qxc -0.1430805E+01 3,-1 114 3 -1 -0.851223 -2.946980 -2.043945 Rho 0.1290115E+00 |GRAD(Rho)| 0.1915643E-15 GRAD(Rho)x -0.1357963E-15 GRAD(Rho)y -0.1112866E-15 GRAD(Rho)z 0.7662599E-16 Laplacian 0.5048440E+00 (-1/4)Del**2(Rho)) -0.1262110E+00 Diamond 0.8602684E+00 Metallicity 0.4496105E+01 Ellipticity 0.2333103E-01 Gb(Abramov) 0.1787170E+00 Vb(Abramov) -0.2312230E+00 Hb(Abramov) -0.5250598E-01 Ex_ueg -0.4814554E-01 Ec_ueg -0.7113811E-02 Delta_ex -0.5234400E-01 Delta_ec 0.1343212E-01 Delta_et -0.1750361E+00 Pxc 0.6767897E+01 Qxc -0.3896928E+01 3,-1 115 3 -1 -0.589532 1.756358 -2.845355 Rho 0.1629858E+00 |GRAD(Rho)| 0.4368607E-15 GRAD(Rho)x 0.2353261E-15 GRAD(Rho)y 0.3670566E-15 GRAD(Rho)z 0.2717282E-16 Laplacian 0.6789208E+00 (-1/4)Del**2(Rho)) -0.1697302E+00 Diamond 0.1486894E+01 Metallicity 0.4936021E+01 Ellipticity 0.3565134E-01 Gb(Abramov) 0.2527854E+00 Vb(Abramov) -0.3358407E+00 Hb(Abramov) -0.8305525E-01 Ex_ueg -0.6575338E-01 Ec_ueg -0.9279909E-02 Delta_ex -0.7412525E-01 Delta_ec 0.1634109E-01 Delta_et -0.2185519E+00 Pxc 0.7085563E+01 Qxc -0.4536126E+01 3,-1 116 3 -1 -0.529172 1.680895 1.784190 Rho 0.4292222E-01 |GRAD(Rho)| 0.7363721E-16 GRAD(Rho)x -0.8929104E-17 GRAD(Rho)y -0.6612998E-16 GRAD(Rho)z -0.3113735E-16 Laplacian 0.1800329E+00 (-1/4)Del**2(Rho)) -0.4500823E-01 Diamond 0.7571765E-01 Metallicity 0.2014025E+01 Ellipticity 0.1626682E-01 Gb(Abramov) 0.4511343E-01 Vb(Abramov) -0.4521864E-01 Hb(Abramov) -0.1052054E-03 Ex_ueg -0.1109927E-01 Ec_ueg -0.2027547E-02 Delta_ex -0.1434550E-01 Delta_ec 0.5516949E-02 Delta_et -0.5590034E-01 Pxc 0.5474238E+01 Qxc -0.2600260E+01 3,-1 117 3 -1 -0.869503 1.934782 3.036025 Rho 0.1453050E+00 |GRAD(Rho)| 0.3316250E-15 GRAD(Rho)x 0.1954274E-15 GRAD(Rho)y 0.2448535E-15 GRAD(Rho)z -0.1087658E-15 Laplacian 0.5674605E+00 (-1/4)Del**2(Rho)) -0.1418651E+00 Diamond 0.1098244E+01 Metallicity 0.4876917E+01 Ellipticity 0.6294246E-01 Gb(Abramov) 0.2098875E+00 Vb(Abramov) -0.2779098E+00 Hb(Abramov) -0.6802236E-01 Ex_ueg -0.5641908E-01 Ec_ueg -0.8143650E-02 Delta_ex -0.6037682E-01 Delta_ec 0.1435150E-01 Delta_et -0.1898350E+00 Pxc 0.6927984E+01 Qxc -0.4207004E+01 3,-1 118 3 +1 1.388148 1.098462 -2.172671 Rho 0.2721508E-01 |GRAD(Rho)| 0.1460993E-14 GRAD(Rho)x -0.8704585E-15 GRAD(Rho)y 0.1161347E-14 GRAD(Rho)z -0.1675624E-15 Laplacian 0.1095315E+00 (-1/4)Del**2(Rho)) -0.2738287E-01 Diamond 0.1665273E-01 Metallicity 0.1549138E+01 Ellipticity -0.4514525E+01 Gb(Abramov) 0.2532522E-01 Vb(Abramov) -0.2326757E-01 Hb(Abramov) 0.2057647E-02 Ex_ueg -0.6045949E-02 Ec_ueg -0.1200874E-02 Delta_ex -0.7022329E-02 Delta_ec 0.1954006E-02 Delta_et -0.1759160E-01 Pxc 0.5034625E+01 Qxc -0.3593811E+01 3,+1 119 3 +1 0.547229 0.517552 1.680188 Rho 0.8481036E-02 |GRAD(Rho)| 0.2999864E-15 GRAD(Rho)x 0.1562109E-15 GRAD(Rho)y 0.1123629E-15 GRAD(Rho)z 0.2301403E-15 Laplacian 0.3287544E-01 (-1/4)Del**2(Rho)) -0.8218859E-02 Diamond 0.8760235E-03 Metallicity 0.7393041E+00 Ellipticity -0.1463904E+01 Gb(Abramov) 0.6491946E-02 Vb(Abramov) -0.4765032E-02 Hb(Abramov) 0.1726914E-02 Ex_ueg -0.1277371E-02 Ec_ueg -0.2996605E-03 Delta_ex -0.1502460E-02 Delta_ec 0.4730828E-03 Delta_et -0.3213391E-02 Pxc 0.4262726E+01 Qxc -0.3175892E+01 3,+1 120 3 +1 0.175965 -0.178955 2.908328 Rho 0.5228072E-02 |GRAD(Rho)| 0.1323338E-16 GRAD(Rho)x 0.1050832E-16 GRAD(Rho)y 0.8024479E-17 GRAD(Rho)z 0.5525169E-18 Laplacian 0.2160283E-01 (-1/4)Del**2(Rho)) -0.5400708E-02 Diamond 0.5137965E-03 Metallicity 0.5023485E+00 Ellipticity -0.2542872E+01 Gb(Abramov) 0.4052645E-02 Vb(Abramov) -0.2704582E-02 Hb(Abramov) 0.1348063E-02 Ex_ueg -0.6701528E-03 Ec_ueg -0.1567408E-03 Delta_ex -0.1064907E-02 Delta_ec 0.6472659E-03 Delta_et -0.3575848E-02 Pxc 0.4275547E+01 Qxc -0.1645239E+01 3,+1 121 3 -1 -0.537639 -1.685637 -1.759978 Rho 0.5076860E-01 |GRAD(Rho)| 0.1554602E-15 GRAD(Rho)x 0.5535932E-16 GRAD(Rho)y -0.7412639E-16 GRAD(Rho)z -0.1249340E-15 Laplacian 0.2069947E+00 (-1/4)Del**2(Rho)) -0.5174868E-01 Diamond 0.1063012E+00 Metallicity 0.2317284E+01 Ellipticity 0.1380739E-01 Gb(Abramov) 0.5448519E-01 Vb(Abramov) -0.5722169E-01 Hb(Abramov) -0.2736504E-02 Ex_ueg -0.1388392E-01 Ec_ueg -0.2457403E-02 Delta_ex -0.1706885E-01 Delta_ec 0.6104415E-02 Delta_et -0.6460783E-01 Pxc 0.5649832E+01 Qxc -0.2796148E+01 3,-1 122 3 -1 -0.562050 -1.770134 2.813680 Rho 0.1416806E+00 |GRAD(Rho)| 0.6413432E-15 GRAD(Rho)x -0.5210540E-15 GRAD(Rho)y 0.3424859E-15 GRAD(Rho)z 0.1500909E-15 Laplacian 0.5946498E+00 (-1/4)Del**2(Rho)) -0.1486625E+00 Diamond 0.1106300E+01 Metallicity 0.4462063E+01 Ellipticity 0.2160375E-01 Gb(Abramov) 0.2096652E+00 Vb(Abramov) -0.2706679E+00 Hb(Abramov) -0.6100273E-01 Ex_ueg -0.5455051E-01 Ec_ueg -0.7913097E-02 Delta_ex -0.6277018E-01 Delta_ec 0.1493792E-01 Delta_et -0.1964559E+00 Pxc 0.6893700E+01 Qxc -0.4202069E+01 3,-1 123 3 -1 -0.824859 2.947183 2.057600 Rho 0.1151209E+00 |GRAD(Rho)| 0.4523317E-12 GRAD(Rho)x -0.3108604E-12 GRAD(Rho)y 0.1638341E-12 GRAD(Rho)z -0.2848300E-12 Laplacian 0.4463742E+00 (-1/4)Del**2(Rho)) -0.1115936E+00 Diamond 0.6553348E+00 Metallicity 0.4205693E+01 Ellipticity 0.2875612E-01 Gb(Abramov) 0.1526171E+00 Vb(Abramov) -0.1936406E+00 Hb(Abramov) -0.4102353E-01 Ex_ueg -0.4136096E-01 Ec_ueg -0.6249793E-02 Delta_ex -0.4492909E-01 Delta_ec 0.1199553E-01 Delta_et -0.1529412E+00 Pxc 0.6617972E+01 Qxc -0.3745485E+01 3,-1 124 3 -1 -0.543950 2.731847 -1.878199 Rho 0.1132666E+00 |GRAD(Rho)| 0.2872789E-15 GRAD(Rho)x 0.6011223E-16 GRAD(Rho)y -0.1748005E-15 GRAD(Rho)z -0.2199101E-15 Laplacian 0.4660142E+00 (-1/4)Del**2(Rho)) -0.1165036E+00 Diamond 0.6703495E+00 Metallicity 0.3920881E+01 Ellipticity 0.9513193E-02 Gb(Abramov) 0.1538018E+00 Vb(Abramov) -0.1911001E+00 Hb(Abramov) -0.3729825E-01 Ex_ueg -0.4047506E-01 Ec_ueg -0.6135476E-02 Delta_ex -0.4671716E-01 Delta_ec 0.1255530E-01 Delta_et -0.1595878E+00 Pxc 0.6596890E+01 Qxc -0.3720913E+01 3,-1 125 3 -1 0.519150 1.688682 -1.791463 Rho 0.4397497E-01 |GRAD(Rho)| 0.1486297E-15 GRAD(Rho)x 0.2144624E-16 GRAD(Rho)y -0.1245926E-15 GRAD(Rho)z 0.7815065E-16 Laplacian 0.1837441E+00 (-1/4)Del**2(Rho)) -0.4593602E-01 Diamond 0.8015045E-01 Metallicity 0.2054672E+01 Ellipticity 0.2071559E-01 Gb(Abramov) 0.4635459E-01 Vb(Abramov) -0.4677316E-01 Hb(Abramov) -0.4185663E-03 Ex_ueg -0.1146373E-01 Ec_ueg -0.2084644E-02 Delta_ex -0.1474395E-01 Delta_ec 0.5655757E-02 Delta_et -0.5768538E-01 Pxc 0.5499130E+01 Qxc -0.2606893E+01 3,-1 126 3 +1 1.052093 2.185638 -1.431221 Rho 0.2631988E-01 |GRAD(Rho)| 0.2493328E-15 GRAD(Rho)x -0.9263393E-16 GRAD(Rho)y 0.1046630E-15 GRAD(Rho)z -0.2064739E-15 Laplacian 0.1043220E+00 (-1/4)Del**2(Rho)) -0.2608050E-01 Diamond 0.1416579E-01 Metallicity 0.1538310E+01 Ellipticity -0.3124800E+01 Gb(Abramov) 0.2407365E-01 Vb(Abramov) -0.2206680E-01 Hb(Abramov) 0.2006853E-02 Ex_ueg -0.5782251E-02 Ec_ueg -0.1155395E-02 Delta_ex -0.6529516E-02 Delta_ec 0.1683362E-02 Delta_et -0.1506364E-01 Pxc 0.5004566E+01 Qxc -0.3878853E+01 3,+1 127 3 +1 0.541673 -0.517447 -1.659235 Rho 0.9159855E-02 |GRAD(Rho)| 0.7594671E-17 GRAD(Rho)x -0.5073314E-17 GRAD(Rho)y 0.2759607E-18 GRAD(Rho)z 0.5644853E-17 Laplacian 0.3534152E-01 (-1/4)Del**2(Rho)) -0.8835381E-02 Diamond 0.1027555E-02 Metallicity 0.7818838E+00 Ellipticity -0.1482066E+01 Gb(Abramov) 0.7041628E-02 Vb(Abramov) -0.5247874E-02 Hb(Abramov) 0.1793754E-02 Ex_ueg -0.1415478E-02 Ec_ueg -0.3300986E-03 Delta_ex -0.1639289E-02 Delta_ec 0.4949762E-03 Delta_et -0.3440193E-02 Pxc 0.4288046E+01 Qxc -0.3311853E+01 3,+1 128 3 -1 -0.466377 -0.475938 -0.477206 Rho 0.1857781E+00 |GRAD(Rho)| 0.1043721E-15 GRAD(Rho)x 0.7285839E-16 GRAD(Rho)y -0.6938894E-16 GRAD(Rho)z 0.2775558E-16 Laplacian 0.5099774E+00 (-1/4)Del**2(Rho)) -0.1274944E+00 Diamond 0.1359830E+01 Metallicity 0.8173091E+01 Ellipticity 0.2933094E-02 Gb(Abramov) 0.2586667E+00 Vb(Abramov) -0.3898391E+00 Hb(Abramov) -0.1311724E+00 Ex_ueg -0.7829085E-01 Ec_ueg -0.1077196E-01 Delta_ex -0.5794325E-01 Delta_ec 0.1256325E-01 Delta_et -0.1725572E+00 Pxc 0.7268021E+01 Qxc -0.4612122E+01 3,-1 129 3 +3 -0.021282 0.016675 -2.327825 Rho 0.4676313E-02 |GRAD(Rho)| 0.2403359E-13 GRAD(Rho)x 0.1848794E-13 GRAD(Rho)y 0.1456209E-14 GRAD(Rho)z 0.1528689E-13 Laplacian 0.1902184E-01 (-1/4)Del**2(Rho)) -0.4755461E-02 Diamond 0.1723282E-03 Metallicity 0.4737325E+00 Ellipticity -0.3154516E+00 Gb(Abramov) 0.3545777E-02 Vb(Abramov) -0.2336093E-02 Hb(Abramov) 0.1209684E-02 Ex_ueg -0.5775503E-03 Ec_ueg -0.1330099E-03 Delta_ex -0.6970208E-03 Delta_ec 0.1764572E-03 Delta_et -0.1111222E-02 Pxc 0.4342159E+01 Qxc -0.3950083E+01 3,+3 130 3 -1 -0.467379 0.460807 0.471245 Rho 0.1865329E+00 |GRAD(Rho)| 0.1065218E-11 GRAD(Rho)x 0.6216139E-12 GRAD(Rho)y -0.5942677E-12 GRAD(Rho)z -0.6285944E-12 Laplacian 0.5144790E+00 (-1/4)Del**2(Rho)) -0.1286197E+00 Diamond 0.1380969E+01 Metallicity 0.8156514E+01 Ellipticity 0.3029042E-02 Gb(Abramov) 0.2605946E+00 Vb(Abramov) -0.3925695E+00 Hb(Abramov) -0.1319749E+00 Ex_ueg -0.7871527E-01 Ec_ueg -0.1082189E-01 Delta_ex -0.5853253E-01 Delta_ec 0.1269307E-01 Delta_et -0.1745145E+00 Pxc 0.7273710E+01 Qxc -0.4611376E+01 3,-1 131 3 +1 1.049044 -2.163752 1.426166 Rho 0.2758844E-01 |GRAD(Rho)| 0.2613897E-09 GRAD(Rho)x -0.1483902E-09 GRAD(Rho)y -0.6208252E-10 GRAD(Rho)z 0.2060356E-09 Laplacian 0.1100043E+00 (-1/4)Del**2(Rho)) -0.2750108E-01 Diamond 0.1550407E-01 Metallicity 0.1577909E+01 Ellipticity -0.2941115E+01 Gb(Abramov) 0.2556642E-01 Vb(Abramov) -0.2363176E-01 Hb(Abramov) 0.1934659E-02 Ex_ueg -0.6156794E-02 Ec_ueg -0.1219901E-02 Delta_ex -0.6931924E-02 Delta_ec 0.1701078E-02 Delta_et -0.1540519E-01 Pxc 0.5046963E+01 Qxc -0.4075019E+01 3,+1 132 3 -1 0.055084 -3.102935 -3.271568 Rho 0.2507186E+00 |GRAD(Rho)| 0.2584370E-14 GRAD(Rho)x -0.4110481E-15 GRAD(Rho)y 0.2212423E-14 GRAD(Rho)z 0.1270902E-14 Laplacian 0.9193960E+00 (-1/4)Del**2(Rho)) -0.2298490E+00 Diamond 0.3409030E+01 Metallicity 0.7471734E+01 Ellipticity 0.2069465E-02 Gb(Abramov) 0.4394611E+00 Vb(Abramov) -0.6490731E+00 Hb(Abramov) -0.2096121E+00 Ex_ueg -0.1167617E+00 Ec_ueg -0.1518320E-01 Delta_ex -0.1122683E+00 Delta_ec 0.1988264E-01 Delta_et -0.2749844E+00 Pxc 0.7690189E+01 Qxc -0.5646548E+01 3,-1 133 3 -1 -0.026216 -2.908227 -0.004268 Rho 0.5424389E-02 |GRAD(Rho)| 0.4848321E-14 GRAD(Rho)x -0.3245218E-14 GRAD(Rho)y -0.1354288E-14 GRAD(Rho)z -0.3337765E-14 Laplacian 0.2182082E-01 (-1/4)Del**2(Rho)) -0.5455204E-02 Diamond 0.6543601E-03 Metallicity 0.5288432E+00 Ellipticity 0.3126025E+01 Gb(Abramov) 0.4117627E-02 Vb(Abramov) -0.2780051E-02 Hb(Abramov) 0.1337577E-02 Ex_ueg -0.7039139E-03 Ec_ueg -0.1652215E-03 Delta_ex -0.1174328E-02 Delta_ec 0.8158940E-03 Delta_et -0.4489089E-02 Pxc 0.4260426E+01 Qxc -0.1439314E+01 3,-1 134 3 +1 0.149126 -2.908745 0.178406 Rho 0.5382032E-02 |GRAD(Rho)| 0.3953000E-15 GRAD(Rho)x -0.3930603E-15 GRAD(Rho)y -0.3825539E-16 GRAD(Rho)z 0.1738438E-16 Laplacian 0.2214616E-01 (-1/4)Del**2(Rho)) -0.5536540E-02 Diamond 0.5458853E-03 Metallicity 0.5143102E+00 Ellipticity -0.2676946E+01 Gb(Abramov) 0.4165610E-02 Vb(Abramov) -0.2794680E-02 Hb(Abramov) 0.1370930E-02 Ex_ueg -0.6965945E-03 Ec_ueg -0.1633900E-03 Delta_ex -0.1096463E-02 Delta_ec 0.6608316E-03 Delta_et -0.3683688E-02 Pxc 0.4263384E+01 Qxc -0.1659217E+01 3,+1 135 3 -1 -0.042858 -3.116880 3.298626 Rho 0.2407530E+00 |GRAD(Rho)| 0.4076532E-15 GRAD(Rho)x 0.1378563E-15 GRAD(Rho)y 0.1914159E-15 GRAD(Rho)z -0.3324706E-15 Laplacian 0.8607430E+00 (-1/4)Del**2(Rho)) -0.2151857E+00 Diamond 0.3069051E+01 Metallicity 0.7459205E+01 Ellipticity 0.8767747E-03 Gb(Abramov) 0.4109763E+00 Vb(Abramov) -0.6067668E+00 Hb(Abramov) -0.1957905E+00 Ex_ueg -0.1106150E+00 Ec_ueg -0.1449118E-01 Delta_ex -0.1041511E+00 Delta_ec 0.1912321E-01 Delta_et -0.2654779E+00 Pxc 0.7633263E+01 Qxc -0.5446320E+01 3,-1 136 3 -1 0.534863 -2.727715 -1.844407 Rho 0.1264651E+00 |GRAD(Rho)| 0.2160756E-09 GRAD(Rho)x 0.1348976E-09 GRAD(Rho)y -0.5537379E-10 GRAD(Rho)z 0.1594524E-09 Laplacian 0.5310295E+00 (-1/4)Del**2(Rho)) -0.1327574E+00 Diamond 0.8814477E+00 Metallicity 0.4134715E+01 Ellipticity 0.1337870E-01 Gb(Abramov) 0.1799906E+00 Vb(Abramov) -0.2272238E+00 Hb(Abramov) -0.4723319E-01 Ex_ueg -0.4688269E-01 Ec_ueg -0.6954434E-02 Delta_ex -0.5477102E-01 Delta_ec 0.1415047E-01 Delta_et -0.1837037E+00 Pxc 0.6741411E+01 Qxc -0.3870613E+01 3,-1 137 3 -1 0.839331 -2.961252 2.056429 Rho 0.1211108E+00 |GRAD(Rho)| 0.4896220E-15 GRAD(Rho)x -0.3351269E-15 GRAD(Rho)y 0.9054443E-16 GRAD(Rho)z 0.3452845E-15 Laplacian 0.4689113E+00 (-1/4)Del**2(Rho)) -0.1172278E+00 Diamond 0.7316092E+00 Metallicity 0.4356732E+01 Ellipticity 0.3035522E-01 Gb(Abramov) 0.1632736E+00 Vb(Abramov) -0.2093194E+00 Hb(Abramov) -0.4604576E-01 Ex_ueg -0.4425501E-01 Ec_ueg -0.6620745E-02 Delta_ex -0.4776989E-01 Delta_ec 0.1245033E-01 Delta_et -0.1601537E+00 Pxc 0.6684295E+01 Qxc -0.3836836E+01 3,-1 138 3 -1 0.570206 -1.739049 -2.799975 Rho 0.1547891E+00 |GRAD(Rho)| 0.6397040E-13 GRAD(Rho)x -0.4435536E-13 GRAD(Rho)y -0.4566231E-13 GRAD(Rho)z 0.6306126E-14 Laplacian 0.6493432E+00 (-1/4)Del**2(Rho)) -0.1623358E+00 Diamond 0.1359041E+01 Metallicity 0.4735578E+01 Ellipticity 0.1698740E-01 Gb(Abramov) 0.2363495E+00 Vb(Abramov) -0.3103632E+00 Hb(Abramov) -0.7401370E-01 Ex_ueg -0.6138171E-01 Ec_ueg -0.8750789E-02 Delta_ex -0.7020390E-01 Delta_ec 0.1621915E-01 Delta_et -0.2165286E+00 Pxc 0.7014421E+01 Qxc -0.4328458E+01 3,-1 139 3 -1 0.556090 -1.699414 1.779436 Rho 0.4222051E-01 |GRAD(Rho)| 0.2391625E-14 GRAD(Rho)x 0.1992739E-14 GRAD(Rho)y -0.1318011E-14 GRAD(Rho)z 0.1082061E-15 Laplacian 0.1773658E+00 (-1/4)Del**2(Rho)) -0.4434146E-01 Diamond 0.7292394E-01 Metallicity 0.1988913E+01 Ellipticity 0.1013853E-01 Gb(Abramov) 0.4425952E-01 Vb(Abramov) -0.4417758E-01 Hb(Abramov) 0.8193761E-04 Ex_ueg -0.1085800E-01 Ec_ueg -0.1989595E-02 Delta_ex -0.1407441E-01 Delta_ec 0.5433936E-02 Delta_et -0.5481519E-01 Pxc 0.5457391E+01 Qxc -0.2590095E+01 3,-1 140 3 +1 1.745776 -1.729816 -1.735582 Rho 0.1207837E-01 |GRAD(Rho)| 0.1119142E-13 GRAD(Rho)x -0.3690894E-14 GRAD(Rho)y 0.4681865E-14 GRAD(Rho)z -0.9471286E-14 Laplacian 0.6065461E-01 (-1/4)Del**2(Rho)) -0.1516365E-01 Diamond 0.2445194E-02 Metallicity 0.7223762E+00 Ellipticity -0.1246672E+01 Gb(Abramov) 0.1193475E-01 Vb(Abramov) -0.8705839E-02 Hb(Abramov) 0.3228907E-02 Ex_ueg -0.2046742E-02 Ec_ueg -0.4631882E-03 Delta_ex -0.2984549E-02 Delta_ec 0.7836937E-03 Delta_et -0.5888517E-02 Pxc 0.4418812E+01 Qxc -0.3808311E+01 3,+1 141 3 -1 0.578812 1.753675 2.831249 Rho 0.1487775E+00 |GRAD(Rho)| 0.4374826E-15 GRAD(Rho)x -0.7289904E-16 GRAD(Rho)y 0.4122543E-15 GRAD(Rho)z -0.1269770E-15 Laplacian 0.6212244E+00 (-1/4)Del**2(Rho)) -0.1553061E+00 Diamond 0.1223696E+01 Metallicity 0.4633686E+01 Ellipticity 0.2744524E-01 Gb(Abramov) 0.2234773E+00 Vb(Abramov) -0.2916486E+00 Hb(Abramov) -0.6817125E-01 Ex_ueg -0.5822390E-01 Ec_ueg -0.8365300E-02 Delta_ex -0.6634901E-01 Delta_ec 0.1538215E-01 Delta_et -0.2035940E+00 Pxc 0.6960168E+01 Qxc -0.4313378E+01 3,-1 142 3 -1 0.552617 2.732105 1.877339 Rho 0.1144811E+00 |GRAD(Rho)| 0.4445331E-15 GRAD(Rho)x -0.2626209E-15 GRAD(Rho)y -0.3307155E-16 GRAD(Rho)z 0.3571362E-15 Laplacian 0.4750100E+00 (-1/4)Del**2(Rho)) -0.1187525E+00 Diamond 0.6910406E+00 Metallicity 0.3915614E+01 Ellipticity 0.7969298E-02 Gb(Abramov) 0.1566665E+00 Vb(Abramov) -0.1945805E+00 Hb(Abramov) -0.3791398E-01 Ex_ueg -0.4105474E-01 Ec_ueg -0.6210320E-02 Delta_ex -0.4772424E-01 Delta_ec 0.1273882E-01 Delta_et -0.1621901E+00 Pxc 0.6610728E+01 Qxc -0.3746363E+01 3,-1 143 3 -1 0.827172 2.952221 -2.068524 Rho 0.1002590E+00 |GRAD(Rho)| 0.2995740E-14 GRAD(Rho)x -0.2013143E-14 GRAD(Rho)y -0.4332506E-15 GRAD(Rho)z -0.2175777E-14 Laplacian 0.3890915E+00 (-1/4)Del**2(Rho)) -0.9727288E-01 Diamond 0.4838719E+00 Metallicity 0.3832069E+01 Ellipticity 0.1642787E-01 Gb(Abramov) 0.1269747E+00 Vb(Abramov) -0.1566764E+00 Hb(Abramov) -0.2970178E-01 Ex_ueg -0.3439928E-01 Ec_ueg -0.5340742E-02 Delta_ex -0.3791423E-01 Delta_ec 0.1079606E-01 Delta_et -0.1341195E+00 Pxc 0.6440918E+01 Qxc -0.3511857E+01 3,-1 144 3 -1 0.064411 3.104852 3.291657 Rho 0.2408499E+00 |GRAD(Rho)| 0.5787798E-12 GRAD(Rho)x -0.1131206E-12 GRAD(Rho)y -0.3983738E-12 GRAD(Rho)z -0.4043366E-12 Laplacian 0.8615672E+00 (-1/4)Del**2(Rho)) -0.2153918E+00 Diamond 0.3073425E+01 Metallicity 0.7457070E+01 Ellipticity 0.1872232E-02 Gb(Abramov) 0.4112931E+00 Vb(Abramov) -0.6071945E+00 Hb(Abramov) -0.1959013E+00 Ex_ueg -0.1106744E+00 Ec_ueg -0.1449789E-01 Delta_ex -0.1042615E+00 Delta_ec 0.1913874E-01 Delta_et -0.2656951E+00 Pxc 0.7633828E+01 Qxc -0.5447670E+01 3,-1 145 3 -1 -0.074100 3.100582 -3.301126 Rho 0.2395917E+00 |GRAD(Rho)| 0.1755521E-14 GRAD(Rho)x 0.3191349E-15 GRAD(Rho)y -0.1313131E-14 GRAD(Rho)z 0.1120577E-14 Laplacian 0.8600420E+00 (-1/4)Del**2(Rho)) -0.2150105E+00 Diamond 0.3046796E+01 Metallicity 0.7405363E+01 Ellipticity 0.2695723E-02 Gb(Abramov) 0.4087121E+00 Vb(Abramov) -0.6024137E+00 Hb(Abramov) -0.1937016E+00 Ex_ueg -0.1099041E+00 Ec_ueg -0.1441089E-01 Delta_ex -0.1039246E+00 Delta_ec 0.1911629E-01 Delta_et -0.2652528E+00 Pxc 0.7626463E+01 Qxc -0.5436444E+01 3,-1 146 3 -1 0.029400 2.907572 -0.010652 Rho 0.5269318E-02 |GRAD(Rho)| 0.2671952E-12 GRAD(Rho)x -0.2570732E-12 GRAD(Rho)y -0.5939580E-13 GRAD(Rho)z -0.4217614E-13 Laplacian 0.2114012E-01 (-1/4)Del**2(Rho)) -0.5285029E-02 Diamond 0.6128794E-03 Metallicity 0.5201115E+00 Ellipticity 0.3188505E+01 Gb(Abramov) 0.3981487E-02 Vb(Abramov) -0.2677945E-02 Hb(Abramov) 0.1303542E-02 Ex_ueg -0.6772114E-03 Ec_ueg -0.1585210E-03 Delta_ex -0.1134409E-02 Delta_ec 0.7953231E-03 Delta_et -0.4335734E-02 Pxc 0.4272061E+01 Qxc -0.1426350E+01 3,-1 147 3 +3 1.130834 -1.097539 -1.112569 Rho 0.5352615E-02 |GRAD(Rho)| 0.2065314E-17 GRAD(Rho)x 0.6491085E-18 GRAD(Rho)y -0.1958916E-17 GRAD(Rho)z -0.8263534E-19 Laplacian 0.2081040E-01 (-1/4)Del**2(Rho)) -0.5202601E-02 Diamond 0.1558916E-03 Metallicity 0.5423454E+00 Ellipticity -0.7772883E-01 Gb(Abramov) 0.3938668E-02 Vb(Abramov) -0.2674736E-02 Hb(Abramov) 0.1263932E-02 Ex_ueg -0.6915226E-03 Ec_ueg -0.1621187E-03 Delta_ex -0.7296415E-03 Delta_ec 0.8612345E-04 Delta_et -0.7056406E-03 Pxc 0.4265533E+01 Qxc -0.8472043E+01 3,+3 148 3 +1 2.167183 1.398027 -1.080270 Rho 0.2714763E-01 |GRAD(Rho)| 0.6507352E-16 GRAD(Rho)x 0.6003484E-16 GRAD(Rho)y 0.2485995E-16 GRAD(Rho)z 0.3516420E-17 Laplacian 0.1092425E+00 (-1/4)Del**2(Rho)) -0.2731063E-01 Diamond 0.1645731E-01 Metallicity 0.1546826E+01 Ellipticity -0.4282107E+01 Gb(Abramov) 0.2524788E-01 Vb(Abramov) -0.2318514E-01 Hb(Abramov) 0.2062745E-02 Ex_ueg -0.6025980E-02 Ec_ueg -0.1197440E-02 Delta_ex -0.6989942E-02 Delta_ec 0.1932369E-02 Delta_et -0.1738889E-01 Pxc 0.5032384E+01 Qxc -0.3617292E+01 3,+1 149 3 -1 0.482413 -0.473799 0.461448 Rho 0.1854293E+00 |GRAD(Rho)| 0.1363000E-13 GRAD(Rho)x -0.8000545E-14 GRAD(Rho)y 0.7827072E-14 GRAD(Rho)z -0.7778500E-14 Laplacian 0.5087185E+00 (-1/4)Del**2(Rho)) -0.1271796E+00 Diamond 0.1353564E+01 Metallicity 0.8167697E+01 Ellipticity 0.2579996E-02 Gb(Abramov) 0.2579139E+00 Vb(Abramov) -0.3886481E+00 Hb(Abramov) -0.1307342E+00 Ex_ueg -0.7809494E-01 Ec_ueg -0.1074891E-01 Delta_ex -0.5777403E-01 Delta_ec 0.1254043E-01 Delta_et -0.1722152E+00 Pxc 0.7265385E+01 Qxc -0.4607022E+01 3,-1 150 3 -1 0.471900 0.477240 -0.477812 Rho 0.1875021E+00 |GRAD(Rho)| 0.3308004E-15 GRAD(Rho)x -0.3122502E-16 GRAD(Rho)y 0.2463307E-15 GRAD(Rho)z -0.2185752E-15 Laplacian 0.5163678E+00 (-1/4)Del**2(Rho)) -0.1290920E+00 Diamond 0.1390913E+01 Metallicity 0.8197178E+01 Ellipticity 0.4168650E-03 Gb(Abramov) 0.2624262E+00 Vb(Abramov) -0.3957605E+00 Hb(Abramov) -0.1333343E+00 Ex_ueg -0.7926108E-01 Ec_ueg -0.1088604E-01 Delta_ex -0.5879611E-01 Delta_ec 0.1267237E-01 Delta_et -0.1741724E+00 Pxc 0.7280984E+01 Qxc -0.4639710E+01 3,-1 151 3 -1 0.872040 1.945053 -3.046011 Rho 0.1479199E+00 |GRAD(Rho)| 0.3377044E-15 GRAD(Rho)x -0.1214984E-15 GRAD(Rho)y 0.2443927E-15 GRAD(Rho)z 0.1988833E-15 Laplacian 0.5718796E+00 (-1/4)Del**2(Rho)) -0.1429699E+00 Diamond 0.1132837E+01 Metallicity 0.4985244E+01 Ellipticity 0.6458688E-01 Gb(Abramov) 0.2141032E+00 Vb(Abramov) -0.2852366E+00 Hb(Abramov) -0.7113335E-01 Ex_ueg -0.5777687E-01 Ec_ueg -0.8310494E-02 Delta_ex -0.6113520E-01 Delta_ec 0.1443699E-01 Delta_et -0.1915301E+00 Pxc 0.6952279E+01 Qxc -0.4234623E+01 3,-1 152 3 -1 1.694728 -1.760738 0.531639 Rho 0.5061320E-01 |GRAD(Rho)| 0.2724266E-15 GRAD(Rho)x 0.2525187E-15 GRAD(Rho)y -0.1022259E-15 GRAD(Rho)z -0.6581446E-18 Laplacian 0.2061811E+00 (-1/4)Del**2(Rho)) -0.5154527E-01 Diamond 0.1054191E+00 Metallicity 0.2314572E+01 Ellipticity 0.1378717E-01 Gb(Abramov) 0.5424772E-01 Vb(Abramov) -0.5695017E-01 Hb(Abramov) -0.2702451E-02 Ex_ueg -0.1382728E-01 Ec_ueg -0.2448797E-02 Delta_ex -0.1698758E-01 Delta_ec 0.6078753E-02 Delta_et -0.6428447E-01 Pxc 0.5646560E+01 Qxc -0.2794583E+01 3,-1 153 3 -1 2.742589 -1.852594 -0.537280 Rho 0.1299329E+00 |GRAD(Rho)| 0.2878019E-13 GRAD(Rho)x -0.9127986E-14 GRAD(Rho)y -0.2132716E-13 GRAD(Rho)z 0.1703324E-13 Laplacian 0.5425732E+00 (-1/4)Del**2(Rho)) -0.1356433E+00 Diamond 0.9296628E+00 Metallicity 0.4233373E+01 Ellipticity 0.1187543E-01 Gb(Abramov) 0.1861336E+00 Vb(Abramov) -0.2366240E+00 Hb(Abramov) -0.5049035E-01 Ex_ueg -0.4860457E-01 Ec_ueg -0.7171589E-02 Delta_ex -0.5631798E-01 Delta_ec 0.1435047E-01 Delta_et -0.1871107E+00 Pxc 0.6777378E+01 Qxc -0.3924469E+01 3,-1 154 3 -1 0.883871 -1.950457 3.051226 Rho 0.1582502E+00 |GRAD(Rho)| 0.4580320E-15 GRAD(Rho)x 0.4231912E-15 GRAD(Rho)y -0.6998525E-16 GRAD(Rho)z 0.1606381E-15 Laplacian 0.6156399E+00 (-1/4)Del**2(Rho)) -0.1539100E+00 Diamond 0.1318629E+01 Metallicity 0.5182349E+01 Ellipticity 0.7250129E-01 Gb(Abramov) 0.2355425E+00 Vb(Abramov) -0.3171751E+00 Hb(Abramov) -0.8163254E-01 Ex_ueg -0.6321846E-01 Ec_ueg -0.8973717E-02 Delta_ex -0.6688325E-01 Delta_ec 0.1521633E-01 Delta_et -0.2035346E+00 Pxc 0.7044846E+01 Qxc -0.4395491E+01 3,-1 155 3 -1 1.862613 -0.532078 -2.727902 Rho 0.1171652E+00 |GRAD(Rho)| 0.6437015E-14 GRAD(Rho)x -0.4322707E-14 GRAD(Rho)y -0.4281955E-14 GRAD(Rho)z -0.2101008E-14 Laplacian 0.4884965E+00 (-1/4)Del**2(Rho)) -0.1221241E+00 Diamond 0.7290024E+00 Metallicity 0.3957457E+01 Ellipticity 0.3951581E-02 Gb(Abramov) 0.1619663E+00 Vb(Abramov) -0.2018084E+00 Hb(Abramov) -0.3984212E-01 Ex_ueg -0.4234317E-01 Ec_ueg -0.6376111E-02 Delta_ex -0.4932628E-01 Delta_ec 0.1298697E-01 Delta_et -0.1659620E+00 Pxc 0.6640907E+01 Qxc -0.3798137E+01 3,-1 156 3 +1 1.416940 -1.067014 2.171191 Rho 0.2621186E-01 |GRAD(Rho)| 0.4687457E-15 GRAD(Rho)x 0.3477232E-15 GRAD(Rho)y 0.2099911E-15 GRAD(Rho)z 0.2339120E-15 Laplacian 0.1039690E+00 (-1/4)Del**2(Rho)) -0.2599224E-01 Diamond 0.1443724E-01 Metallicity 0.1532989E+01 Ellipticity -0.3527054E+01 Gb(Abramov) 0.2396914E-01 Vb(Abramov) -0.2194603E-01 Hb(Abramov) 0.2023109E-02 Ex_ueg -0.5750631E-02 Ec_ueg -0.1149921E-02 Delta_ex -0.6540903E-02 Delta_ec 0.1750340E-02 Delta_et -0.1563257E-01 Pxc 0.5000893E+01 Qxc -0.3736933E+01 3,+1 157 3 +1 2.903613 -0.128652 0.135127 Rho 0.5330962E-02 |GRAD(Rho)| 0.8389552E-17 GRAD(Rho)x -0.9501375E-18 GRAD(Rho)y 0.5065562E-17 GRAD(Rho)z 0.6619812E-17 Laplacian 0.2182492E-01 (-1/4)Del**2(Rho)) -0.5456229E-02 Diamond 0.5848744E-03 Metallicity 0.5136531E+00 Ellipticity -0.7471659E+01 Gb(Abramov) 0.4104587E-02 Vb(Abramov) -0.2752946E-02 Hb(Abramov) 0.1351642E-02 Ex_ueg -0.6877953E-03 Ec_ueg -0.1611831E-03 Delta_ex -0.1124348E-02 Delta_ec 0.7330787E-03 Delta_et -0.4040166E-02 Pxc 0.4267166E+01 Qxc -0.1533735E+01 3,+1 158 3 -1 1.791507 -0.525475 1.684041 Rho 0.4311395E-01 |GRAD(Rho)| 0.3874264E-16 GRAD(Rho)x -0.2337599E-16 GRAD(Rho)y -0.2817708E-16 GRAD(Rho)z 0.1267310E-16 Laplacian 0.1801744E+00 (-1/4)Del**2(Rho)) -0.4504359E-01 Diamond 0.7631134E-01 Metallicity 0.2027448E+01 Ellipticity 0.1880819E-01 Gb(Abramov) 0.4524966E-01 Vb(Abramov) -0.4545572E-01 Hb(Abramov) -0.2060624E-03 Ex_ueg -0.1116543E-01 Ec_ueg -0.2037932E-02 Delta_ex -0.1437650E-01 Delta_ec 0.5528038E-02 Delta_et -0.5608097E-01 Pxc 0.5478805E+01 Qxc -0.2600651E+01 3,-1 159 3 +3 2.336736 0.037096 -0.022881 Rho 0.4614855E-02 |GRAD(Rho)| 0.4521832E-16 GRAD(Rho)x -0.4514346E-16 GRAD(Rho)y 0.2333070E-18 GRAD(Rho)z -0.2590315E-17 Laplacian 0.1887009E-01 (-1/4)Del**2(Rho)) -0.4717524E-02 Diamond 0.1717640E-03 Metallicity 0.4671280E+00 Ellipticity -0.3641992E+00 Gb(Abramov) 0.3512297E-02 Vb(Abramov) -0.2307070E-02 Hb(Abramov) 0.1205227E-02 Ex_ueg -0.5674521E-03 Ec_ueg -0.1303763E-03 Delta_ex -0.6931075E-03 Delta_ec 0.1821587E-03 Delta_et -0.1133656E-02 Pxc 0.4352418E+01 Qxc -0.3804965E+01 3,+3 160 3 -1 -0.005178 0.017712 -2.913407 Rho 0.5411355E-02 |GRAD(Rho)| 0.4880371E-17 GRAD(Rho)x 0.3528803E-17 GRAD(Rho)y -0.3248683E-17 GRAD(Rho)z 0.9009067E-18 Laplacian 0.2165499E-01 (-1/4)Del**2(Rho)) -0.5413747E-02 Diamond 0.6468756E-03 Metallicity 0.5307605E+00 Ellipticity 0.3043108E+01 Gb(Abramov) 0.4088065E-02 Vb(Abramov) -0.2762383E-02 Hb(Abramov) 0.1325682E-02 Ex_ueg -0.7016595E-03 Ec_ueg -0.1646578E-03 Delta_ex -0.1164542E-02 Delta_ec 0.8090727E-03 Delta_et -0.4448504E-02 Pxc 0.4261319E+01 Qxc -0.1439354E+01 3,-1 161 3 -1 1.771598 0.541878 -1.693089 Rho 0.4408486E-01 |GRAD(Rho)| 0.1828260E-15 GRAD(Rho)x -0.1383205E-15 GRAD(Rho)y 0.6368714E-16 GRAD(Rho)z 0.1011768E-15 Laplacian 0.1846513E+00 (-1/4)Del**2(Rho)) -0.4616283E-01 Diamond 0.8054025E-01 Metallicity 0.2053099E+01 Ellipticity 0.1602893E-01 Gb(Abramov) 0.4657136E-01 Vb(Abramov) -0.4697989E-01 Hb(Abramov) -0.4085298E-03 Ex_ueg -0.1150194E-01 Ec_ueg -0.2090614E-02 Delta_ex -0.1481166E-01 Delta_ec 0.5658140E-02 Delta_et -0.5774381E-01 Pxc 0.5501702E+01 Qxc -0.2617762E+01 3,-1 162 3 -1 1.929488 -3.032162 0.877237 Rho 0.1529380E+00 |GRAD(Rho)| 0.1389126E-13 GRAD(Rho)x 0.4826055E-14 GRAD(Rho)y -0.1295164E-13 GRAD(Rho)z -0.1389785E-14 Laplacian 0.6009015E+00 (-1/4)Del**2(Rho)) -0.1502254E+00 Diamond 0.1250450E+01 Metallicity 0.5015745E+01 Ellipticity 0.5147229E-01 Gb(Abramov) 0.2257323E+00 Vb(Abramov) -0.3012392E+00 Hb(Abramov) -0.7550691E-01 Ex_ueg -0.6040490E-01 Ec_ueg -0.8631852E-02 Delta_ex -0.6487901E-01 Delta_ec 0.1524244E-01 Delta_et -0.2036139E+00 Pxc 0.6997908E+01 Qxc -0.4256471E+01 3,-1 163 3 -1 2.061162 0.846650 -2.950245 Rho 0.1160700E+00 |GRAD(Rho)| 0.1668132E-15 GRAD(Rho)x -0.6002414E-16 GRAD(Rho)y 0.1708974E-16 GRAD(Rho)z 0.1546987E-15 Laplacian 0.4491637E+00 (-1/4)Del**2(Rho)) -0.1122909E+00 Diamond 0.6671534E+00 Metallicity 0.4237165E+01 Ellipticity 0.2967287E-01 Gb(Abramov) 0.1541598E+00 Vb(Abramov) -0.1960287E+00 Hb(Abramov) -0.4186888E-01 Ex_ueg -0.4181626E-01 Ec_ueg -0.6308403E-02 Delta_ex -0.4531465E-01 Delta_ec 0.1207704E-01 Delta_et -0.1542524E+00 Pxc 0.6628660E+01 Qxc -0.3752132E+01 3,-1 164 3 -1 1.683629 1.797611 -0.548374 Rho 0.4380711E-01 |GRAD(Rho)| 0.1821006E-15 GRAD(Rho)x 0.1711934E-15 GRAD(Rho)y 0.2195912E-16 GRAD(Rho)z 0.5806231E-16 Laplacian 0.1841731E+00 (-1/4)Del**2(Rho)) -0.4604326E-01 Diamond 0.7985958E-01 Metallicity 0.2036861E+01 Ellipticity 0.1231022E-01 Gb(Abramov) 0.4632613E-01 Vb(Abramov) -0.4660900E-01 Hb(Abramov) -0.2828657E-03 Ex_ueg -0.1140542E-01 Ec_ueg -0.2075527E-02 Delta_ex -0.1476122E-01 Delta_ec 0.5663461E-02 Delta_et -0.5770371E-01 Pxc 0.5495191E+01 Qxc -0.2606395E+01 3,-1 165 3 +1 2.185528 -1.130959 1.326708 Rho 0.2845079E-01 |GRAD(Rho)| 0.1111543E-14 GRAD(Rho)x 0.6422871E-15 GRAD(Rho)y 0.5027773E-15 GRAD(Rho)z 0.7551225E-15 Laplacian 0.1157168E+00 (-1/4)Del**2(Rho)) -0.2892919E-01 Diamond 0.1879758E-01 Metallicity 0.1578971E+01 Ellipticity -0.4984812E+01 Gb(Abramov) 0.2689918E-01 Vb(Abramov) -0.2486918E-01 Hb(Abramov) 0.2030006E-02 Ex_ueg -0.6414717E-02 Ec_ueg -0.1263977E-02 Delta_ex -0.7516077E-02 Delta_ec 0.2079974E-02 Delta_et -0.1892818E-01 Pxc 0.5075025E+01 Qxc -0.3613544E+01 3,+1 166 3 -1 1.943812 3.063560 -0.888224 Rho 0.1619946E+00 |GRAD(Rho)| 0.2082746E-15 GRAD(Rho)x 0.3136055E-16 GRAD(Rho)y -0.6991749E-16 GRAD(Rho)z -0.1936656E-15 Laplacian 0.6276181E+00 (-1/4)Del**2(Rho)) -0.1569045E+00 Diamond 0.1383618E+01 Metallicity 0.5285489E+01 Ellipticity 0.7496570E-01 Gb(Abramov) 0.2428225E+00 Vb(Abramov) -0.3287406E+00 Hb(Abramov) -0.8591801E-01 Ex_ueg -0.6522074E-01 Ec_ueg -0.9215710E-02 Delta_ex -0.6859142E-01 Delta_ec 0.1543691E-01 Delta_et -0.2071289E+00 Pxc 0.7077126E+01 Qxc -0.4443338E+01 3,-1 167 3 -1 1.762292 2.828877 0.567550 Rho 0.1478477E+00 |GRAD(Rho)| 0.3271965E-13 GRAD(Rho)x 0.1489535E-13 GRAD(Rho)y -0.7609090E-14 GRAD(Rho)z -0.2812126E-13 Laplacian 0.6157361E+00 (-1/4)Del**2(Rho)) -0.1539340E+00 Diamond 0.1204871E+01 Metallicity 0.4626396E+01 Ellipticity 0.2668390E-01 Gb(Abramov) 0.2213160E+00 Vb(Abramov) -0.2886979E+00 Hb(Abramov) -0.6738195E-01 Ex_ueg -0.5773925E-01 Ec_ueg -0.8305878E-02 Delta_ex -0.6567220E-01 Delta_ec 0.1528990E-01 Delta_et -0.2022481E+00 Pxc 0.6951613E+01 Qxc -0.4295137E+01 3,-1 168 3 +1 2.917580 0.187623 -0.171740 Rho 0.5237438E-02 |GRAD(Rho)| 0.6299596E-16 GRAD(Rho)x 0.1123854E-16 GRAD(Rho)y -0.5180329E-16 GRAD(Rho)z 0.3403830E-16 Laplacian 0.2171541E-01 (-1/4)Del**2(Rho)) -0.5428852E-02 Diamond 0.5003252E-03 Metallicity 0.5012372E+00 Ellipticity -0.2207872E+01 Gb(Abramov) 0.4072758E-02 Vb(Abramov) -0.2716665E-02 Hb(Abramov) 0.1356093E-02 Ex_ueg -0.6717539E-03 Ec_ueg -0.1571450E-03 Delta_ex -0.1055653E-02 Delta_ec 0.6235322E-03 Delta_et -0.3458027E-02 Pxc 0.4274740E+01 Qxc -0.1693021E+01 3,+1 169 3 -1 1.873741 0.546677 2.745703 Rho 0.1148407E+00 |GRAD(Rho)| 0.5601031E-13 GRAD(Rho)x -0.2040753E-14 GRAD(Rho)y 0.5399380E-13 GRAD(Rho)z -0.1475329E-13 Laplacian 0.4731036E+00 (-1/4)Del**2(Rho)) -0.1182759E+00 Diamond 0.6918396E+00 Metallicity 0.3951998E+01 Ellipticity 0.1012954E-01 Gb(Abramov) 0.1567549E+00 Vb(Abramov) -0.1952340E+00 Hb(Abramov) -0.3847904E-01 Ex_ueg -0.4122679E-01 Ec_ueg -0.6232504E-02 Delta_ex -0.4758193E-01 Delta_ec 0.1270313E-01 Delta_et -0.1618646E+00 Pxc 0.6614804E+01 Qxc -0.3745686E+01 3,-1 170 3 -1 2.829741 0.583264 1.762262 Rho 0.1616386E+00 |GRAD(Rho)| 0.2074303E-15 GRAD(Rho)x 0.6671231E-16 GRAD(Rho)y -0.1938282E-15 GRAD(Rho)z 0.3174002E-16 Laplacian 0.6737147E+00 (-1/4)Del**2(Rho)) -0.1684287E+00 Diamond 0.1460484E+01 Metallicity 0.4905827E+01 Ellipticity 0.3466212E-01 Gb(Abramov) 0.2499994E+00 Vb(Abramov) -0.3315702E+00 Hb(Abramov) -0.8157076E-01 Ex_ueg -0.6502970E-01 Ec_ueg -0.9192666E-02 Delta_ex -0.7340107E-01 Delta_ec 0.1624458E-01 Delta_et -0.2170357E+00 Pxc 0.7074085E+01 Qxc -0.4518495E+01 3,-1 171 3 -1 2.949733 2.063411 -0.836828 Rho 0.1155980E+00 |GRAD(Rho)| 0.1838010E-14 GRAD(Rho)x -0.8140495E-15 GRAD(Rho)y 0.1189234E-14 GRAD(Rho)z 0.1140757E-14 Laplacian 0.4444079E+00 (-1/4)Del**2(Rho)) -0.1111020E+00 Diamond 0.6573812E+00 Metallicity 0.4253519E+01 Ellipticity 0.2602706E-01 Gb(Abramov) 0.1528304E+00 Vb(Abramov) -0.1945588E+00 Hb(Abramov) -0.4172841E-01 Ex_ueg -0.4158966E-01 Ec_ueg -0.6279245E-02 Delta_ex -0.4479881E-01 Delta_ec 0.1197353E-01 Delta_et -0.1528394E+00 Pxc 0.6623353E+01 Qxc -0.3741488E+01 3,-1 172 3 -1 3.109657 -3.277091 -0.056300 Rho 0.2511918E+00 |GRAD(Rho)| 0.2136172E-15 GRAD(Rho)x 0.1422473E-15 GRAD(Rho)y -0.1565588E-15 GRAD(Rho)z -0.2978845E-16 Laplacian 0.9209117E+00 (-1/4)Del**2(Rho)) -0.2302279E+00 Diamond 0.3422161E+01 Metallicity 0.7482917E+01 Ellipticity 0.1668524E-02 Gb(Abramov) 0.4406147E+00 Vb(Abramov) -0.6510015E+00 Hb(Abramov) -0.2103868E+00 Ex_ueg -0.1170556E+00 Ec_ueg -0.1521620E-01 Delta_ex -0.1125079E+00 Delta_ec 0.1990173E-01 Delta_et -0.2752470E+00 Pxc 0.7692831E+01 Qxc -0.5653169E+01 3,-1 173 3 -1 1.745071 -2.801739 -0.570349 Rho 0.1538889E+00 |GRAD(Rho)| 0.2532835E-15 GRAD(Rho)x 0.8624828E-16 GRAD(Rho)y 0.2848064E-16 GRAD(Rho)z -0.2364374E-15 Laplacian 0.6497909E+00 (-1/4)Del**2(Rho)) -0.1624477E+00 Diamond 0.1351708E+01 Metallicity 0.4686533E+01 Ellipticity 0.1511117E-01 Gb(Abramov) 0.2351846E+00 Vb(Abramov) -0.3079215E+00 Hb(Abramov) -0.7273687E-01 Ex_ueg -0.6090619E-01 Ec_ueg -0.8692923E-02 Delta_ex -0.7016289E-01 Delta_ec 0.1627520E-01 Delta_et -0.2171603E+00 Pxc 0.7006411E+01 Qxc -0.4311031E+01 3,-1 174 3 -1 2.736877 1.881985 0.532493 Rho 0.9928828E-01 |GRAD(Rho)| 0.1141281E-15 GRAD(Rho)x 0.1062027E-15 GRAD(Rho)y -0.2365594E-16 GRAD(Rho)z -0.3444714E-16 Laplacian 0.4105882E+00 (-1/4)Del**2(Rho)) -0.1026471E+00 Diamond 0.5047851E+00 Metallicity 0.3573030E+01 Ellipticity 0.1347838E-01 Gb(Abramov) 0.1295582E+00 Vb(Abramov) -0.1564693E+00 Hb(Abramov) -0.2691114E-01 Ex_ueg -0.3395593E-01 Ec_ueg -0.5281958E-02 Delta_ex -0.3992071E-01 Delta_ec 0.1142128E-01 Delta_et -0.1416185E+00 Pxc 0.6428664E+01 Qxc -0.3495291E+01 3,-1 175 3 -1 2.953462 -2.050126 0.851831 Rho 0.1295845E+00 |GRAD(Rho)| 0.5785571E-16 GRAD(Rho)x -0.3062871E-17 GRAD(Rho)y 0.5772699E-16 GRAD(Rho)z 0.2344587E-17 Laplacian 0.5081020E+00 (-1/4)Del**2(Rho)) -0.1270255E+00 Diamond 0.8702444E+00 Metallicity 0.4500397E+01 Ellipticity 0.2482282E-01 Gb(Abramov) 0.1799612E+00 Vb(Abramov) -0.2328969E+00 Hb(Abramov) -0.5293570E-01 Ex_ueg -0.4843090E-01 Ec_ueg -0.7149739E-02 Delta_ex -0.5273554E-01 Delta_ec 0.1350028E-01 Delta_et -0.1760454E+00 Pxc 0.6773800E+01 Qxc -0.3906255E+01 3,-1 176 3 -1 3.037172 -0.874121 1.948175 Rho 0.1425036E+00 |GRAD(Rho)| 0.1712820E-15 GRAD(Rho)x 0.5175032E-16 GRAD(Rho)y 0.8979904E-16 GRAD(Rho)z 0.1363655E-15 Laplacian 0.5539454E+00 (-1/4)Del**2(Rho)) -0.1384863E+00 Diamond 0.1048237E+01 Metallicity 0.4836406E+01 Ellipticity 0.5930697E-01 Gb(Abramov) 0.2039536E+00 Vb(Abramov) -0.2694208E+00 Hb(Abramov) -0.6546725E-01 Ex_ueg -0.5497344E-01 Ec_ueg -0.7965379E-02 Delta_ex -0.5866829E-01 Delta_ec 0.1409485E-01 Delta_et -0.1859582E+00 Pxc 0.6901548E+01 Qxc -0.4162393E+01 3,-1 177 3 -1 2.818678 -0.574013 -1.751482 Rho 0.1414104E+00 |GRAD(Rho)| 0.3147970E-13 GRAD(Rho)x 0.7852050E-14 GRAD(Rho)y 0.3042602E-13 GRAD(Rho)z 0.1890605E-14 Laplacian 0.5955416E+00 (-1/4)Del**2(Rho)) -0.1488854E+00 Diamond 0.1105378E+01 Metallicity 0.4441228E+01 Ellipticity 0.2062285E-01 Gb(Abramov) 0.2094626E+00 Vb(Abramov) -0.2700398E+00 Hb(Abramov) -0.6057720E-01 Ex_ueg -0.5441183E-01 Ec_ueg -0.7895941E-02 Delta_ex -0.6283444E-01 Delta_ec 0.1496656E-01 Delta_et -0.1967770E+00 Pxc 0.6891114E+01 Qxc -0.4198322E+01 3,-1 178 3 -1 3.035153 0.870142 -1.932973 Rho 0.1475964E+00 |GRAD(Rho)| 0.9696106E-12 GRAD(Rho)x -0.3789492E-12 GRAD(Rho)y -0.7282228E-12 GRAD(Rho)z -0.5159786E-12 Laplacian 0.5751067E+00 (-1/4)Del**2(Rho)) -0.1437767E+00 Diamond 0.1134563E+01 Metallicity 0.4939215E+01 Ellipticity 0.6776813E-01 Gb(Abramov) 0.2142084E+00 Vb(Abramov) -0.2846402E+00 Hb(Abramov) -0.7043175E-01 Ex_ueg -0.5760846E-01 Ec_ueg -0.8289830E-02 Delta_ex -0.6143006E-01 Delta_ec 0.1449591E-01 Delta_et -0.1921839E+00 Pxc 0.6949293E+01 Qxc -0.4237752E+01 3,-1 179 3 -1 -1.792835 -0.552150 -1.694319 Rho 0.4239165E-01 |GRAD(Rho)| 0.2022181E-15 GRAD(Rho)x 0.1495917E-15 GRAD(Rho)y -0.4126141E-16 GRAD(Rho)z 0.1296611E-15 Laplacian 0.1783150E+00 (-1/4)Del**2(Rho)) -0.4457875E-01 Diamond 0.7387977E-01 Metallicity 0.1991709E+01 Ellipticity 0.8496335E-02 Gb(Abramov) 0.4451715E-01 Vb(Abramov) -0.4445555E-01 Hb(Abramov) 0.6160011E-04 Ex_ueg -0.1091672E-01 Ec_ueg -0.1998843E-02 Delta_ex -0.1417256E-01 Delta_ec 0.5478347E-02 Delta_et -0.5532578E-01 Pxc 0.5461519E+01 Qxc -0.2587014E+01 3,-1 180 3 -1 -3.112629 -3.294515 0.077391 Rho 0.2403955E+00 |GRAD(Rho)| 0.6698041E-14 GRAD(Rho)x 0.7042435E-15 GRAD(Rho)y 0.6195836E-14 GRAD(Rho)z 0.2445282E-14 Laplacian 0.8592359E+00 (-1/4)Del**2(Rho)) -0.2148090E+00 Diamond 0.3058808E+01 Metallicity 0.7453803E+01 Ellipticity 0.2513797E-02 Gb(Abramov) 0.4100633E+00 Vb(Abramov) -0.6053176E+00 Hb(Abramov) -0.1952543E+00 Ex_ueg -0.1103960E+00 Ec_ueg -0.1446646E-01 Delta_ex -0.1039317E+00 Delta_ec 0.1910386E-01 Delta_et -0.2652202E+00 Pxc 0.7631173E+01 Qxc -0.5440349E+01 3,-1 181 3 -1 -0.533600 -2.752094 1.877042 Rho 0.1032215E+00 |GRAD(Rho)| 0.1311703E-13 GRAD(Rho)x -0.2254382E-14 GRAD(Rho)y 0.5078762E-14 GRAD(Rho)z -0.1188193E-13 Laplacian 0.4269616E+00 (-1/4)Del**2(Rho)) -0.1067404E+00 Diamond 0.5496262E+00 Metallicity 0.3665848E+01 Ellipticity 0.1290114E-01 Gb(Abramov) 0.1363760E+00 Vb(Abramov) -0.1660115E+00 Hb(Abramov) -0.2963555E-01 Ex_ueg -0.3576118E-01 Ec_ueg -0.5520608E-02 Delta_ex -0.4188320E-01 Delta_ec 0.1176113E-01 Delta_et -0.1469315E+00 Pxc 0.6477761E+01 Qxc -0.3561155E+01 3,-1 182 3 -1 2.058162 -0.826275 2.953927 Rho 0.1048503E+00 |GRAD(Rho)| 0.5145645E-15 GRAD(Rho)x -0.2208384E-15 GRAD(Rho)y -0.3961438E-15 GRAD(Rho)z 0.2430578E-15 Laplacian 0.4070177E+00 (-1/4)Del**2(Rho)) -0.1017544E+00 Diamond 0.5342009E+00 Metallicity 0.3947144E+01 Ellipticity 0.1795911E-01 Gb(Abramov) 0.1347762E+00 Vb(Abramov) -0.1677979E+00 Hb(Abramov) -0.3302175E-01 Ex_ueg -0.3651558E-01 Ec_ueg -0.5619794E-02 Delta_ex -0.4007783E-01 Delta_ec 0.1118015E-01 Delta_et -0.1401055E+00 Pxc 0.6497673E+01 Qxc -0.3584730E+01 3,-1 183 3 -1 3.105362 3.304910 0.042851 Rho 0.2398716E+00 |GRAD(Rho)| 0.3970119E-15 GRAD(Rho)x 0.3502515E-15 GRAD(Rho)y 0.1857780E-15 GRAD(Rho)z -0.2070826E-16 Laplacian 0.8616960E+00 (-1/4)Del**2(Rho)) -0.2154240E+00 Diamond 0.3055965E+01 Metallicity 0.7405549E+01 Ellipticity 0.1644387E-02 Gb(Abramov) 0.4095048E+00 Vb(Abramov) -0.6035857E+00 Hb(Abramov) -0.1940808E+00 Ex_ueg -0.1100754E+00 Ec_ueg -0.1443024E-01 Delta_ex -0.1041510E+00 Delta_ec 0.1913708E-01 Delta_et -0.2655116E+00 Pxc 0.7628105E+01 Qxc -0.5442366E+01 3,-1 184 3 -1 3.294346 0.072916 3.107962 Rho 0.2403761E+00 |GRAD(Rho)| 0.1201457E-14 GRAD(Rho)x 0.1039479E-14 GRAD(Rho)y 0.9526071E-16 GRAD(Rho)z 0.5949017E-15 Laplacian 0.8604319E+00 (-1/4)Del**2(Rho)) -0.2151080E+00 Diamond 0.3061339E+01 Metallicity 0.7442441E+01 Ellipticity 0.3839713E-02 Gb(Abramov) 0.4102267E+00 Vb(Abramov) -0.6053455E+00 Hb(Abramov) -0.1951188E+00 Ex_ueg -0.1103842E+00 Ec_ueg -0.1446512E-01 Delta_ex -0.1040666E+00 Delta_ec 0.1911735E-01 Delta_et -0.2653471E+00 Pxc 0.7631060E+01 Qxc -0.5443565E+01 3,-1 185 3 -1 3.280602 -0.058291 -3.105121 Rho 0.2406712E+00 |GRAD(Rho)| 0.4268118E-15 GRAD(Rho)x -0.4258746E-15 GRAD(Rho)y 0.1599198E-16 GRAD(Rho)z 0.2331035E-16 Laplacian 0.8635900E+00 (-1/4)Del**2(Rho)) -0.2158975E+00 Diamond 0.3076054E+01 Metallicity 0.7430406E+01 Ellipticity 0.5159025E-03 Gb(Abramov) 0.4112994E+00 Vb(Abramov) -0.6067012E+00 Hb(Abramov) -0.1954019E+00 Ex_ueg -0.1105649E+00 Ec_ueg -0.1448553E-01 Delta_ex -0.1044764E+00 Delta_ec 0.1917049E-01 Delta_et -0.2660522E+00 Pxc 0.7632785E+01 Qxc -0.5449852E+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 79 80 81 82 139 122 181 154 137 135 121 138 136 107 114 132 125 115 124 151 143 145 116 141 142 117 123 144 152 153 173 175 162 172 164 174 167 171 166 183 79 89 95 78 96 70 92 71 99 67 86 180 179 82 97 62 93 66 57 76 109 83 61 65 158 170 169 176 182 184 161 177 155 178 163 185 149 128 150 130 64 90 160 113 146 133 1 1 1 1 1 1 2 2 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 13 14 15 16 17 18 21 22 25 26 13 24 26 33 39 41 14 21 28 36 37 42 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 52 53 53 53 53 19 20 23 24 27 28 2.418372 1.909501 2.039103 1.878472 1.986931 1.715607 2.361894 1.899736 1.979540 1.908151 1.984733 1.727151 2.401101 1.855185 2.002440 1.906090 2.064056 1.717413 2.411713 1.890983 1.997052 1.912175 2.008014 1.715468 2.363213 1.969629 1.901326 1.982740 1.916327 1.726442 2.401740 2.054702 1.893271 2.007036 1.869424 1.716913 2.412964 2.009794 1.889925 2.007008 1.904349 1.716263 2.415429 1.985123 1.864379 2.047036 1.920468 1.716221 2.415896 1.887969 2.055017 1.875647 2.001566 1.716743 2.366774 1.895829 1.976269 1.906194 1.992776 1.727029 2.410467 1.858568 1.996599 1.920319 2.045898 1.716244 2.400894 1.910275 1.987557 1.906543 2.004827 1.715681 1.699433 1.698635 1.694743 1.696753 3.267340 3.265835 3.262936 3.271760 3.273434 3.260309 2.419992 1.910091 2.039613 1.879169 1.987806 1.715624 2.363628 1.900211 1.979874 1.908817 1.985393 1.727156 2.402976 1.855762 2.003059 1.906879 2.064839 1.717429 2.413329 1.891623 1.997676 1.912983 2.008857 1.715482 2.364939 1.970019 1.901754 1.983406 1.917001 1.726447 2.403678 2.055196 1.893894 2.007854 1.870101 1.716929 2.414555 2.010395 1.890572 2.007879 1.905118 1.716279 2.417022 1.985646 1.864957 2.047827 1.921312 1.716233 2.417482 1.888601 2.055500 1.876325 2.002495 1.716759 2.368544 1.896323 1.976653 1.906844 1.993432 1.727034 2.412063 1.859139 1.997186 1.921132 2.046685 1.716256 2.402760 1.910841 1.988135 1.907362 2.005645 1.715696 1.699435 1.698639 1.694745 1.696758 3.276303 3.282604 3.272147 3.281378 3.282593 3.269471 32 27 24 27 29 25 30 27 27 27 28 23 30 25 26 26 28 23 30 27 29 27 28 24 30 27 25 25 26 22 32 26 28 26 25 23 31 27 28 27 29 24 30 27 27 27 28 22 27 27 27 24 27 23 30 28 26 27 28 22 30 25 27 25 26 24 30 25 28 26 27 23 21 24 24 26 35 35 35 35 35 35 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 Mo W Mo Mo W Mo Mo Mo Mo W Mo Mo O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O As 2.3853 2.4886 2.3736 2.3815 2.4891 2.3706 2.3837 2.3887 2.3869 2.4787 2.3921 2.3714 -1.1363 -1.1366 -1.1308 -1.1397 -0.9246 -0.9150 -0.8977 -0.8865 -0.9254 -0.8953 -0.8856 -0.9170 -0.8970 -0.8896 -0.8978 -0.9484 -0.9049 -0.8775 -0.8791 -0.9125 -0.8757 -0.8828 -0.9005 -0.9140 -0.9066 -0.8805 -0.9128 -0.8718 -0.6620 -0.7429 -0.6665 -0.6614 -0.7401 -0.6643 -0.6640 -0.6648 -0.6660 -0.7416 -0.6641 -0.6608 2.4503 1.9241 2.0884 1.9087 1.9211 2.0889 1.9127 1.9200 1.9203 1.9160 2.0902 1.9146 1.9239 1.9370 1.9373 1.9393 1.9378 1.9392 1.9405 1.9448 1.9487 1.9385 1.9453 1.9485 1.9407 1.9454 1.9466 1.9449 1.9358 1.9530 1.9548 1.9549 1.9511 1.9550 1.9548 1.9534 1.9507 1.9526 1.9532 1.9509 1.9575 1.9856 1.9740 1.9848 1.9856 1.9745 1.9849 1.9852 1.9853 1.9849 1.9741 1.9854 1.9856 0.8072 6.0596 6.0908 6.0687 6.0615 6.0905 6.0679 6.0600 6.0619 6.0581 6.0912 6.0584 6.0727 5.1605 5.1603 5.1526 5.1627 4.9567 4.9464 4.9266 4.9107 4.9586 4.9233 4.9098 4.9485 4.9251 4.9160 4.9266 4.9823 4.9213 4.8936 4.8957 4.9307 4.8917 4.8993 4.9165 4.9324 4.9235 4.8986 4.9311 4.8852 4.6403 4.7309 4.6458 4.6397 4.7275 4.6434 4.6428 4.6435 4.6453 4.7295 4.6428 4.6391 1.1891 3.6310 3.3032 3.6490 3.6359 3.3025 3.6489 3.6363 3.6291 3.6390 3.3109 3.6348 3.6320 0.0388 0.0390 0.0390 0.0392 0.0287 0.0282 0.0262 0.0271 0.0283 0.0266 0.0274 0.0278 0.0265 0.0270 0.0263 0.0303 0.0307 0.0291 0.0285 0.0307 0.0289 0.0287 0.0306 0.0308 0.0305 0.0287 0.0309 0.0291 0.0361 0.0379 0.0358 0.0361 0.0381 0.0359 0.0360 0.0359 0.0359 0.0380 0.0360 0.0361 10.5534 0.0000 14.0290 0.0000 0.0000 14.0290 0.0000 0.0000 0.0000 0.0000 14.0289 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 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 53 Mo W Mo Mo W Mo Mo Mo Mo W Mo Mo O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O As 3.177442 2.518975 3.173956 3.178559 2.520000 3.175147 3.177202 3.176787 3.174680 2.518095 3.175017 3.180625 -1.177912 -1.176805 -1.217564 -1.177122 -1.042540 -1.061589 -1.163142 -1.149287 -1.045296 -1.161926 -1.150272 -1.061911 -1.163088 -1.155753 -1.163825 -0.939404 -1.025357 -1.121144 -1.121088 -1.004202 -1.118003 -1.124878 -1.024152 -1.007396 -1.027134 -1.123699 -1.009536 -1.112662 -0.926486 -0.766176 -0.929401 -0.924715 -0.762657 -0.927464 -0.928118 -0.928973 -0.930122 -0.764903 -0.927367 -0.924938 2.321523 2.385537 1.962927 2.393980 2.392496 1.964266 2.395075 2.390419 2.384899 2.390594 1.969351 2.390839 2.383784 -0.874846 -0.873415 -0.931521 -0.877813 -0.801219 -0.806820 -0.908516 -0.902888 -0.802138 -0.904146 -0.902851 -0.809293 -0.904878 -0.906430 -0.906348 -0.704129 -0.819160 -0.904030 -0.899715 -0.813851 -0.901472 -0.903108 -0.817592 -0.815329 -0.824555 -0.900030 -0.816234 -0.893466 -0.674239 -0.638106 -0.669637 -0.669712 -0.633667 -0.667752 -0.674552 -0.676645 -0.675315 -0.633669 -0.671525 -0.672218 1.678662 2.460909 2.053721 2.466632 2.468550 2.055566 2.468395 2.467109 2.459045 2.465422 2.060407 2.464293 2.459372 -0.890072 -0.888519 -0.929879 -0.891097 -0.877838 -0.886715 -0.988965 -0.975072 -0.880949 -0.979642 -0.974278 -0.894288 -0.980916 -0.976954 -0.987658 -0.785873 -0.859703 -0.935163 -0.938455 -0.850834 -0.931999 -0.946284 -0.854603 -0.850879 -0.867209 -0.933135 -0.853826 -0.926674 -0.636177 -0.601298 -0.626765 -0.629374 -0.595493 -0.627129 -0.636004 -0.636117 -0.637782 -0.596642 -0.631319 -0.628895 1.671054 0.50182818 1.77217858 0.57134994 1.92844216 -0.17734522 3.36428638 3.73223261 0.08577623 -3.45827430 0.09156898 -361.4468 414.6338 -143.1542 -344.9366 -10.3122 -445.2160 Jun12-2024 20:34:10 Nodes: 1 Procs: 1 Jun12-2024 20:34:13 Nodes: 1 Procs: 1 0 Jun12-2024 20:34:17 Nodes: 1 Procs: 1 Jun12-2024 20:34:19 Nodes: 1 Procs: 1 Molybdenum (TZP, 3d frozen) 0 Jun12-2024 20:34:22 Nodes: 1 Procs: 1 Jun12-2024 20:34:24 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun12-2024 20:34:27 Nodes: 1 Procs: 1 Jun12-2024 20:34:29 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Jun12-2024 20:34:35 Nodes: 1 Procs: 5 *** (NO TITLE) *** -3 -16.28764496 -16.35488448 -16.35850351 -16.36011605 -16.36039326 -16.36084026 -16.36103759 -16.36109879 -16.36115870 -16.36120053 -16.36124666 -16.36129498 -16.36133428 -16.36137236 -16.36137933 -16.36138788 GEOMETRY CONVERGED