ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:50:05 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.34 0.07 4.31 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 Jun19-2024 22:50:05 Nodes: 1 Procs: 1 Jun19-2024 22:50:09 Nodes: 1 Procs: 1 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:50:14 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.47 0.08 3.34 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 3.000 0.000 0.000 14.000 0.000 0.000 -72.755 -5.438 1.149 14.442 84.369 82466.595 -39.462 -0.588 19.371 119.253 -3.592 3.193 26.757 -25.167 53.137 407.274 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 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -72.7547 -39.4619 -25.1674 -5.4383 -3.5916 -0.5880 1.1490 3.1925 14.4417 19.3711 26.7574 53.1371 84.3692 119.2525 407.2740 82466.5951 1 Ta -0.0000 4.0000 6.0000 3.0000 14.0000 Jun19-2024 22:50:05 Nodes: 1 Procs: 1 Jun19-2024 22:50:09 Nodes: 1 Procs: 1 0 Jun19-2024 22:50:14 Nodes: 1 Procs: 1 Jun19-2024 22:50:16 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:50:20 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.91 0.05 1.67 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 Jun19-2024 22:50:05 Nodes: 1 Procs: 1 Jun19-2024 22:50:09 Nodes: 1 Procs: 1 0 Jun19-2024 22:50:14 Nodes: 1 Procs: 1 Jun19-2024 22:50:16 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun19-2024 22:50:20 Nodes: 1 Procs: 1 Jun19-2024 22:50:22 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:50:24 Arsenic (TZP, 3p frozen) c1-24 c1-24 c1-24 c1-24 c1-24 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.45 0.07 3.01 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 Jun19-2024 22:50:05 Nodes: 1 Procs: 1 Jun19-2024 22:50:09 Nodes: 1 Procs: 1 0 Jun19-2024 22:50:14 Nodes: 1 Procs: 1 Jun19-2024 22:50:16 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun19-2024 22:50:20 Nodes: 1 Procs: 1 Jun19-2024 22:50:22 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun19-2024 22:50:24 Nodes: 1 Procs: 1 Jun19-2024 22:50:27 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:50:32 Arsenic (TZP, 3p frozen) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP 2909.409200000006 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-3 3.446030 1.479999 -1.512643 Rho 0.3189360E+03 3,-3 32 3 -3 -3.423083 1.503526 1.515532 Rho 0.3189316E+03 3,-3 33 3 -3 1.594150 -1.506291 3.446640 Rho 0.3189217E+03 3,-3 34 3 -3 1.580079 1.484292 -3.458172 Rho 0.3189267E+03 3,-3 35 3 -3 -1.572592 1.488468 3.470089 Rho 0.3189156E+03 3,-3 36 3 -3 -1.489552 -1.581763 -3.456595 Rho 0.3189290E+03 3,-3 37 3 -3 -1.499932 -3.440614 -1.507443 Rho 0.3189297E+03 3,-3 38 3 -3 -1.572661 3.447193 1.510479 Rho 0.3189082E+03 3,-3 39 3 -3 1.578195 -3.465136 1.488630 Rho 0.3189248E+03 3,-3 40 3 -3 1.602929 3.438171 -1.496346 Rho 0.3189333E+03 3,-3 41 3 -3 -0.201031 -3.825524 3.818575 Rho 0.3191504E+03 3,-3 42 3 -3 0.242801 -3.789371 -3.729855 Rho 0.3192900E+03 3,-3 43 3 -3 -0.164111 3.860077 -3.821902 Rho 0.3191449E+03 3,-3 44 3 -3 0.184517 3.824197 3.832601 Rho 0.3191563E+03 3,-3 45 3 -3 3.786948 -3.743038 -0.257633 Rho 0.3192832E+03 3,-3 46 3 -3 3.835777 3.716630 0.223214 Rho 0.3192788E+03 3,-3 47 3 -3 -3.819021 3.775022 -0.192984 Rho 0.3192719E+03 3,-3 48 3 -3 -3.771600 -3.788840 0.224060 Rho 0.3192777E+03 3,-3 49 3 -3 -3.863507 0.179045 -3.818619 Rho 0.3191415E+03 3,-3 50 3 -3 -3.819345 -0.217681 3.741870 Rho 0.3192821E+03 3,-3 51 3 -3 3.828957 0.221595 3.721026 Rho 0.3192782E+03 3,-3 52 3 -3 3.788125 -0.252957 -3.738004 Rho 0.3192876E+03 3,-3 53 3 -3 0.003429 -0.001902 0.001433 Rho 0.4276082E+05 3,-3 54 3 +1 -1.311577 -2.184481 -1.139731 Rho 0.2809329E-01 |GRAD(Rho)| 0.1075726E-15 GRAD(Rho)x 0.1997674E-16 GRAD(Rho)y 0.1029003E-15 GRAD(Rho)z 0.2417249E-16 Laplacian 0.1131431E+00 (-1/4)Del**2(Rho)) -0.2828577E-01 Diamond 0.1818187E-01 Metallicity 0.1581210E+01 Ellipticity -0.5501435E+01 Gb(Abramov) 0.2631147E-01 Vb(Abramov) -0.2433717E-01 Hb(Abramov) 0.1974300E-02 Ex_ueg -0.6307470E-02 Ec_ueg -0.1245683E-02 Delta_ex -0.7335260E-02 Delta_ec 0.2053540E-02 Delta_et -0.1862721E-01 Pxc 0.5063463E+01 Qxc -0.3572008E+01 3,+1 55 3 +1 -2.966572 0.121684 0.117036 Rho 0.5237022E-02 |GRAD(Rho)| 0.8756923E-12 GRAD(Rho)x 0.4943864E-12 GRAD(Rho)y -0.6686277E-12 GRAD(Rho)z 0.2745106E-12 Laplacian 0.2109061E-01 (-1/4)Del**2(Rho)) -0.5272652E-02 Diamond 0.5419126E-03 Metallicity 0.5160179E+00 Ellipticity -0.5481199E+01 Gb(Abramov) 0.3968565E-02 Vb(Abramov) -0.2664478E-02 Hb(Abramov) 0.1304087E-02 Ex_ueg -0.6716829E-03 Ec_ueg -0.1571271E-03 Delta_ex -0.1074179E-02 Delta_ec 0.6929267E-03 Delta_et -0.3804275E-02 Pxc 0.4274776E+01 Qxc -0.1550206E+01 3,+1 56 3 +3 -1.115864 1.130008 -1.146316 Rho 0.4778276E-02 |GRAD(Rho)| 0.6314456E-13 GRAD(Rho)x -0.2098172E-13 GRAD(Rho)y -0.4373415E-13 GRAD(Rho)z 0.4042680E-13 Laplacian 0.1758571E-01 (-1/4)Del**2(Rho)) -0.4396427E-02 Diamond 0.1130896E-03 Metallicity 0.5311764E+00 Ellipticity -0.6249386E-01 Gb(Abramov) 0.3320164E-02 Vb(Abramov) -0.2243902E-02 Hb(Abramov) 0.1076263E-02 Ex_ueg -0.5944017E-03 Ec_ueg -0.1373836E-03 Delta_ex -0.5976918E-03 Delta_ec 0.7337679E-04 Delta_et -0.5882445E-03 Pxc 0.4326583E+01 Qxc -0.8145515E+01 3,+3 57 3 +1 -2.175032 1.328732 1.125625 Rho 0.2799145E-01 |GRAD(Rho)| 0.2212436E-14 GRAD(Rho)x -0.1395977E-14 GRAD(Rho)y 0.1542019E-14 GRAD(Rho)z -0.7538560E-15 Laplacian 0.1136333E+00 (-1/4)Del**2(Rho)) -0.2840832E-01 Diamond 0.1854547E-01 Metallicity 0.1564888E+01 Ellipticity -0.6402381E+01 Gb(Abramov) 0.2634819E-01 Vb(Abramov) -0.2428806E-01 Hb(Abramov) 0.2060133E-02 Ex_ueg -0.6277003E-02 Ec_ueg -0.1240477E-02 Delta_ex -0.7395029E-02 Delta_ec 0.2125118E-02 Delta_et -0.1925068E-01 Pxc 0.5060152E+01 Qxc -0.3479820E+01 3,+1 58 3 -1 -1.833015 -2.801265 0.557527 Rho 0.1485021E+00 |GRAD(Rho)| 0.1108999E-15 GRAD(Rho)x -0.5781508E-16 GRAD(Rho)y 0.9433237E-16 GRAD(Rho)z -0.7589415E-17 Laplacian 0.6207309E+00 (-1/4)Del**2(Rho)) -0.1551827E+00 Diamond 0.1234950E+01 Metallicity 0.4623073E+01 Ellipticity 0.8949468E-02 Gb(Abramov) 0.2230253E+00 Vb(Abramov) -0.2908679E+00 Hb(Abramov) -0.6784261E-01 Ex_ueg -0.5808025E-01 Ec_ueg -0.8347696E-02 Delta_ex -0.6641686E-01 Delta_ec 0.1564643E-01 Delta_et -0.2076692E+00 Pxc 0.6957639E+01 Qxc -0.4244857E+01 3,-1 59 3 +3 -1.112594 -1.118136 1.128016 Rho 0.5024126E-02 |GRAD(Rho)| 0.3120481E-17 GRAD(Rho)x 0.7638781E-18 GRAD(Rho)y -0.2212769E-17 GRAD(Rho)z 0.2063382E-17 Laplacian 0.1913309E-01 (-1/4)Del**2(Rho)) -0.4783272E-02 Diamond 0.1332308E-03 Metallicity 0.5307977E+00 Ellipticity -0.7197004E-01 Gb(Abramov) 0.3612006E-02 Vb(Abramov) -0.2440740E-02 Hb(Abramov) 0.1171266E-02 Ex_ueg -0.6355247E-03 Ec_ueg -0.1479512E-03 Delta_ex -0.6607510E-03 Delta_ec 0.8219763E-04 Delta_et -0.6572890E-03 Pxc 0.4295502E+01 Qxc -0.8038565E+01 3,+3 60 3 +1 0.539348 0.561256 1.692091 Rho 0.8214050E-02 |GRAD(Rho)| 0.2275682E-16 GRAD(Rho)x 0.1116345E-16 GRAD(Rho)y 0.7251126E-17 GRAD(Rho)z 0.1845729E-16 Laplacian 0.3126432E-01 (-1/4)Del**2(Rho)) -0.7816080E-02 Diamond 0.7851493E-03 Metallicity 0.7370435E+00 Ellipticity -0.1453273E+01 Gb(Abramov) 0.6170852E-02 Vb(Abramov) -0.4525624E-02 Hb(Abramov) 0.1645228E-02 Ex_ueg -0.1224038E-02 Ec_ueg -0.2877449E-03 Delta_ex -0.1411428E-02 Delta_ec 0.4392663E-03 Delta_et -0.2967630E-02 Pxc 0.4253900E+01 Qxc -0.3213148E+01 3,+1 61 3 +1 -0.543279 1.705723 -0.551795 Rho 0.7994082E-02 |GRAD(Rho)| 0.3363488E-16 GRAD(Rho)x -0.1783803E-17 GRAD(Rho)y 0.3313581E-16 GRAD(Rho)z 0.5490084E-17 Laplacian 0.3032250E-01 (-1/4)Del**2(Rho)) -0.7580625E-02 Diamond 0.7308684E-03 Metallicity 0.7263219E+00 Ellipticity -0.1441381E+01 Gb(Abramov) 0.5971413E-02 Vb(Abramov) -0.4362200E-02 Hb(Abramov) 0.1609213E-02 Ex_ueg -0.1180529E-02 Ec_ueg -0.2779517E-03 Delta_ex -0.1358096E-02 Delta_ec 0.4233782E-03 Delta_et -0.2842535E-02 Pxc 0.4247243E+01 Qxc -0.3207761E+01 3,+1 62 3 +1 1.651635 -0.530634 -0.532941 Rho 0.8984177E-02 |GRAD(Rho)| 0.1019905E-16 GRAD(Rho)x -0.9026248E-17 GRAD(Rho)y 0.3683075E-17 GRAD(Rho)z 0.2997057E-17 Laplacian 0.3490728E-01 (-1/4)Del**2(Rho)) -0.8726819E-02 Diamond 0.1000221E-02 Metallicity 0.7664686E+00 Ellipticity -0.1479005E+01 Gb(Abramov) 0.6932685E-02 Vb(Abramov) -0.5138551E-02 Hb(Abramov) 0.1794134E-02 Ex_ueg -0.1379398E-02 Ec_ueg -0.3222019E-03 Delta_ex -0.1616178E-02 Delta_ec 0.4978111E-03 Delta_et -0.3435616E-02 Pxc 0.4281160E+01 Qxc -0.3246569E+01 3,+1 63 3 +1 -2.964368 -0.161083 -0.174735 Rho 0.5190396E-02 |GRAD(Rho)| 0.2379323E-15 GRAD(Rho)x -0.2262704E-15 GRAD(Rho)y 0.1807164E-16 GRAD(Rho)z 0.7132229E-16 Laplacian 0.2080988E-01 (-1/4)Del**2(Rho)) -0.5202470E-02 Diamond 0.4825761E-03 Metallicity 0.5152418E+00 Ellipticity -0.2640039E+01 Gb(Abramov) 0.3915068E-02 Vb(Abramov) -0.2627666E-02 Hb(Abramov) 0.1287402E-02 Ex_ueg -0.6637212E-03 Ec_ueg -0.1551155E-03 Delta_ex -0.1017668E-02 Delta_ec 0.6115685E-03 Delta_et -0.3376401E-02 Pxc 0.4278884E+01 Qxc -0.1664029E+01 3,+1 64 3 -1 -3.274647 0.057116 -3.254309 Rho 0.2160884E+00 |GRAD(Rho)| 0.2982715E-12 GRAD(Rho)x 0.2132512E-12 GRAD(Rho)y -0.4410274E-13 GRAD(Rho)z 0.2038253E-12 Laplacian 0.8047627E+00 (-1/4)Del**2(Rho)) -0.2011907E+00 Diamond 0.2505094E+01 Metallicity 0.6662919E+01 Ellipticity 0.3289142E-02 Gb(Abramov) 0.3575466E+00 Vb(Abramov) -0.5139026E+00 Hb(Abramov) -0.1563560E+00 Ex_ueg -0.9576947E-01 Ec_ueg -0.1280186E-01 Delta_ex -0.9459689E-01 Delta_ec 0.1828804E-01 Delta_et -0.2519088E+00 Pxc 0.7480904E+01 Qxc -0.5172609E+01 3,-1 65 3 +1 -1.674811 -0.542002 0.537806 Rho 0.8476751E-02 |GRAD(Rho)| 0.8035993E-17 GRAD(Rho)x 0.1257884E-17 GRAD(Rho)y 0.7621571E-17 GRAD(Rho)z -0.2215079E-17 Laplacian 0.3280188E-01 (-1/4)Del**2(Rho)) -0.8200471E-02 Diamond 0.8654072E-03 Metallicity 0.7403381E+00 Ellipticity -0.1454712E+01 Gb(Abramov) 0.6478834E-02 Vb(Abramov) -0.4757197E-02 Hb(Abramov) 0.1721637E-02 Ex_ueg -0.1276510E-02 Ec_ueg -0.2994690E-03 Delta_ex -0.1495208E-02 Delta_ec 0.4654184E-03 Delta_et -0.3166188E-02 Pxc 0.4262579E+01 Qxc -0.3212610E+01 3,+1 66 3 -1 -2.966861 0.044549 0.037449 Rho 0.5240691E-02 |GRAD(Rho)| 0.1841080E-16 GRAD(Rho)x 0.6165077E-18 GRAD(Rho)y -0.1002677E-16 GRAD(Rho)z 0.1542859E-16 Laplacian 0.2074928E-01 (-1/4)Del**2(Rho)) -0.5187321E-02 Diamond 0.5793145E-03 Metallicity 0.5251189E+00 Ellipticity 0.5515819E+01 Gb(Abramov) 0.3912207E-02 Vb(Abramov) -0.2637094E-02 Hb(Abramov) 0.1275114E-02 Ex_ueg -0.6723103E-03 Ec_ueg -0.1572854E-03 Delta_ex -0.1096767E-02 Delta_ec 0.7528266E-03 Delta_et -0.4106601E-02 Pxc 0.4274462E+01 Qxc -0.1456866E+01 3,-1 67 3 -1 -3.241984 -0.064039 3.207104 Rho 0.2394188E+00 |GRAD(Rho)| 0.5758103E-15 GRAD(Rho)x 0.2653043E-15 GRAD(Rho)y 0.5160802E-16 GRAD(Rho)z -0.5084366E-15 Laplacian 0.8752235E+00 (-1/4)Del**2(Rho)) -0.2188059E+00 Diamond 0.3082181E+01 Metallicity 0.7268164E+01 Ellipticity 0.1949206E-02 Gb(Abramov) 0.4109234E+00 Vb(Abramov) -0.6030410E+00 Hb(Abramov) -0.1921176E+00 Ex_ueg -0.1097984E+00 Ec_ueg -0.1439895E-01 Delta_ex -0.1056553E+00 Delta_ec 0.1930813E-01 Delta_et -0.2672520E+00 Pxc 0.7625448E+01 Qxc -0.5472066E+01 3,-1 68 3 -1 -2.794690 -0.565168 1.818767 Rho 0.1292378E+00 |GRAD(Rho)| 0.2175956E-12 GRAD(Rho)x 0.2941230E-13 GRAD(Rho)y 0.1345781E-12 GRAD(Rho)z 0.1684385E-12 Laplacian 0.5424413E+00 (-1/4)Del**2(Rho)) -0.1356103E+00 Diamond 0.9170510E+00 Metallicity 0.4196719E+01 Ellipticity 0.9108407E-02 Gb(Abramov) 0.1852600E+00 Vb(Abramov) -0.2349096E+00 Hb(Abramov) -0.4964963E-01 Ex_ueg -0.4825822E-01 Ec_ueg -0.7128001E-02 Delta_ex -0.5615373E-01 Delta_ec 0.1422614E-01 Delta_et -0.1850710E+00 Pxc 0.6770232E+01 Qxc -0.3947221E+01 3,-1 69 3 -1 -1.740790 -1.735435 -0.532692 Rho 0.4460834E-01 |GRAD(Rho)| 0.3144023E-16 GRAD(Rho)x 0.7196815E-17 GRAD(Rho)y 0.1147603E-16 GRAD(Rho)z -0.2837243E-16 Laplacian 0.1804788E+00 (-1/4)Del**2(Rho)) -0.4511971E-01 Diamond 0.7743348E-01 Metallicity 0.2142300E+01 Ellipticity 0.2367706E-01 Gb(Abramov) 0.4618980E-01 Vb(Abramov) -0.4725989E-01 Hb(Abramov) -0.1070091E-02 Ex_ueg -0.1168440E-01 Ec_ueg -0.2119085E-02 Delta_ex -0.1439098E-01 Delta_ec 0.5300484E-02 Delta_et -0.5422198E-01 Pxc 0.5513891E+01 Qxc -0.2715032E+01 3,-1 70 3 +1 -2.180843 -1.027715 -1.448483 Rho 0.2576667E-01 |GRAD(Rho)| 0.3860429E-16 GRAD(Rho)x -0.3406754E-16 GRAD(Rho)y -0.2702151E-17 GRAD(Rho)z 0.1795529E-16 Laplacian 0.9895890E-01 (-1/4)Del**2(Rho)) -0.2473973E-01 Diamond 0.1184094E-01 Metallicity 0.1565269E+01 Ellipticity -0.2445368E+01 Gb(Abramov) 0.2294720E-01 Vb(Abramov) -0.2115468E-01 Hb(Abramov) 0.1792523E-02 Ex_ueg -0.5620775E-02 Ec_ueg -0.1127392E-02 Delta_ex -0.6032342E-02 Delta_ec 0.1371683E-02 Delta_et -0.1226234E-01 Pxc 0.4985644E+01 Qxc -0.4397767E+01 3,+1 71 3 +1 1.659845 0.526634 0.519911 Rho 0.9074659E-02 |GRAD(Rho)| 0.1355878E-12 GRAD(Rho)x -0.8758395E-13 GRAD(Rho)y -0.8574233E-13 GRAD(Rho)z -0.5797712E-13 Laplacian 0.3537053E-01 (-1/4)Del**2(Rho)) -0.8842632E-02 Diamond 0.1018634E-02 Metallicity 0.7691696E+00 Ellipticity -0.1469541E+01 Gb(Abramov) 0.7028669E-02 Vb(Abramov) -0.5214705E-02 Hb(Abramov) 0.1813963E-02 Ex_ueg -0.1397952E-02 Ec_ueg -0.3262674E-03 Delta_ex -0.1638102E-02 Delta_ec 0.4978244E-03 Delta_et -0.3449768E-02 Pxc 0.4284681E+01 Qxc -0.3290522E+01 3,+1 72 3 -1 -3.222335 -3.223742 0.073931 Rho 0.2389459E+00 |GRAD(Rho)| 0.1333746E-15 GRAD(Rho)x 0.1217559E-15 GRAD(Rho)y 0.9324139E-17 GRAD(Rho)z 0.5364090E-16 Laplacian 0.8723826E+00 (-1/4)Del**2(Rho)) -0.2180957E+00 Diamond 0.3065742E+01 Metallicity 0.7267844E+01 Ellipticity 0.5167649E-02 Gb(Abramov) 0.4095780E+00 Vb(Abramov) -0.6010603E+00 Hb(Abramov) -0.1914823E+00 Ex_ueg -0.1095094E+00 Ec_ueg -0.1436628E-01 Delta_ex -0.1052627E+00 Delta_ec 0.1926503E-01 Delta_et -0.2666741E+00 Pxc 0.7622667E+01 Qxc -0.5463924E+01 3,-1 73 3 +1 -1.769464 -1.767333 1.765738 Rho 0.1192496E-01 |GRAD(Rho)| 0.5798519E-14 GRAD(Rho)x 0.2970221E-14 GRAD(Rho)y -0.4735200E-14 GRAD(Rho)z -0.1542235E-14 Laplacian 0.5820532E-01 (-1/4)Del**2(Rho)) -0.1455133E-01 Diamond 0.2249405E-02 Metallicity 0.7369062E+00 Ellipticity -0.1246805E+01 Gb(Abramov) 0.1148805E-01 Vb(Abramov) -0.8424766E-02 Hb(Abramov) 0.3063283E-02 Ex_ueg -0.2012154E-02 Ec_ueg -0.4561062E-03 Delta_ex -0.2837985E-02 Delta_ec 0.7227707E-03 Delta_et -0.5436504E-02 Pxc 0.4411590E+01 Qxc -0.3926536E+01 3,+1 74 3 +1 -1.689682 0.534811 -0.557451 Rho 0.8133616E-02 |GRAD(Rho)| 0.3451705E-15 GRAD(Rho)x 0.2526209E-15 GRAD(Rho)y -0.3634618E-17 GRAD(Rho)z 0.2351853E-15 Laplacian 0.3091623E-01 (-1/4)Del**2(Rho)) -0.7729058E-02 Diamond 0.7696916E-03 Metallicity 0.7332173E+00 Ellipticity -0.1456149E+01 Gb(Abramov) 0.6097219E-02 Vb(Abramov) -0.4465379E-02 Hb(Abramov) 0.1631840E-02 Ex_ueg -0.1208083E-02 Ec_ueg -0.2841614E-03 Delta_ex -0.1394013E-02 Delta_ec 0.4375125E-03 Delta_et -0.2945695E-02 Pxc 0.4251396E+01 Qxc -0.3186224E+01 3,+1 75 3 -1 -2.828472 0.598210 -1.821093 Rho 0.1179027E+00 |GRAD(Rho)| 0.1710698E-13 GRAD(Rho)x 0.3977030E-14 GRAD(Rho)y 0.1659587E-13 GRAD(Rho)z -0.1187120E-14 Laplacian 0.5078269E+00 (-1/4)Del**2(Rho)) -0.1269567E+00 Diamond 0.7964635E+00 Metallicity 0.3846835E+01 Ellipticity 0.1989718E-01 Gb(Abramov) 0.1660347E+00 Vb(Abramov) -0.2051128E+00 Hb(Abramov) -0.3907802E-01 Ex_ueg -0.4269889E-01 Ec_ueg -0.6421751E-02 Delta_ex -0.5180639E-01 Delta_ec 0.1428708E-01 Delta_et -0.1840830E+00 Pxc 0.6649104E+01 Qxc -0.3626100E+01 3,-1 76 3 -1 -3.002445 0.852566 2.001324 Rho 0.1410738E+00 |GRAD(Rho)| 0.6843886E-12 GRAD(Rho)x 0.2583490E-12 GRAD(Rho)y -0.4800207E-12 GRAD(Rho)z 0.4137919E-12 Laplacian 0.5575184E+00 (-1/4)Del**2(Rho)) -0.1393796E+00 Diamond 0.1047285E+01 Metallicity 0.4725319E+01 Ellipticity 0.4304081E-01 Gb(Abramov) 0.2026886E+00 Vb(Abramov) -0.2659975E+00 Hb(Abramov) -0.6330897E-01 Ex_ueg -0.5423922E-01 Ec_ueg -0.7874579E-02 Delta_ex -0.5895525E-01 Delta_ec 0.1431723E-01 Delta_et -0.1888188E+00 Pxc 0.6887889E+01 Qxc -0.4117782E+01 3,-1 77 3 +1 0.545520 1.694109 0.567220 Rho 0.8054448E-02 |GRAD(Rho)| 0.6561117E-15 GRAD(Rho)x -0.8614728E-16 GRAD(Rho)y -0.4292364E-15 GRAD(Rho)z -0.4886893E-15 Laplacian 0.3056734E-01 (-1/4)Del**2(Rho)) -0.7641835E-02 Diamond 0.7484357E-03 Metallicity 0.7295949E+00 Ellipticity -0.1449846E+01 Gb(Abramov) 0.6023797E-02 Vb(Abramov) -0.4405760E-02 Hb(Abramov) 0.1618038E-02 Ex_ueg -0.1192430E-02 Ec_ueg -0.2806371E-03 Delta_ex -0.1373665E-02 Delta_ec 0.4303786E-03 Delta_et -0.2892154E-02 Pxc 0.4249009E+01 Qxc -0.3191759E+01 3,+1 78 3 +1 0.105587 2.972027 -0.091322 Rho 0.4791357E-02 |GRAD(Rho)| 0.2867193E-17 GRAD(Rho)x 0.4329871E-19 GRAD(Rho)y -0.4362832E-18 GRAD(Rho)z -0.2833475E-17 Laplacian 0.1880242E-01 (-1/4)Del**2(Rho)) -0.4700605E-02 Diamond 0.4319874E-03 Metallicity 0.4990726E+00 Ellipticity -0.6305819E+01 Gb(Abramov) 0.3524727E-02 Vb(Abramov) -0.2348849E-02 Hb(Abramov) 0.1175878E-02 Ex_ueg -0.5965724E-03 Ec_ueg -0.1379451E-03 Delta_ex -0.9448272E-03 Delta_ec 0.6235343E-03 Delta_et -0.3330449E-02 Pxc 0.4324708E+01 Qxc -0.1515277E+01 3,+1 79 3 -1 -2.820275 1.843979 -0.565319 Rho 0.1518530E+00 |GRAD(Rho)| 0.1310444E-15 GRAD(Rho)x -0.4186376E-16 GRAD(Rho)y 0.1107241E-15 GRAD(Rho)z -0.5621588E-16 Laplacian 0.6310157E+00 (-1/4)Del**2(Rho)) -0.1577539E+00 Diamond 0.1289447E+01 Metallicity 0.4720034E+01 Ellipticity 0.9225351E-02 Gb(Abramov) 0.2292699E+00 Vb(Abramov) -0.3007860E+00 Hb(Abramov) -0.7151601E-01 Ex_ueg -0.5983419E-01 Ec_ueg -0.8562236E-02 Delta_ex -0.6788877E-01 Delta_ec 0.1581622E-01 Delta_et -0.2105612E+00 Pxc 0.6988150E+01 Qxc -0.4292351E+01 3,-1 80 3 +1 -1.784271 1.795529 -1.788098 Rho 0.1135482E-01 |GRAD(Rho)| 0.1666108E-16 GRAD(Rho)x -0.1086736E-16 GRAD(Rho)y -0.1261140E-16 GRAD(Rho)z 0.6667757E-18 Laplacian 0.5315261E-01 (-1/4)Del**2(Rho)) -0.1328815E-01 Diamond 0.1880706E-02 Metallicity 0.7436852E+00 Ellipticity -0.1249493E+01 Gb(Abramov) 0.1050580E-01 Vb(Abramov) -0.7723452E-02 Hb(Abramov) 0.2782350E-02 Ex_ueg -0.1884917E-02 Ec_ueg -0.4298679E-03 Delta_ex -0.2545797E-02 Delta_ec 0.6378589E-03 Delta_et -0.4759646E-02 Pxc 0.4384875E+01 Qxc -0.3991160E+01 3,+1 81 3 -1 -3.005428 2.001000 0.844473 Rho 0.1296356E+00 |GRAD(Rho)| 0.1709134E-15 GRAD(Rho)x -0.1360674E-15 GRAD(Rho)y -0.8237226E-16 GRAD(Rho)z 0.6254491E-16 Laplacian 0.5066867E+00 (-1/4)Del**2(Rho)) -0.1266717E+00 Diamond 0.8642731E+00 Metallicity 0.4515933E+01 Ellipticity 0.2499909E-01 Gb(Abramov) 0.1797879E+00 Vb(Abramov) -0.2329042E+00 Hb(Abramov) -0.5311624E-01 Ex_ueg -0.4845636E-01 Ec_ueg -0.7152943E-02 Delta_ex -0.5254573E-01 Delta_ec 0.1337590E-01 Delta_et -0.1742778E+00 Pxc 0.6774325E+01 Qxc -0.3928388E+01 3,-1 82 3 -1 -2.801551 -1.813796 0.567531 Rho 0.1442056E+00 |GRAD(Rho)| 0.3497457E-15 GRAD(Rho)x -0.6241616E-16 GRAD(Rho)y 0.3096346E-15 GRAD(Rho)z 0.1501756E-15 Laplacian 0.5960099E+00 (-1/4)Del**2(Rho)) -0.1490025E+00 Diamond 0.1149792E+01 Metallicity 0.4584903E+01 Ellipticity 0.1209606E-01 Gb(Abramov) 0.2131953E+00 Vb(Abramov) -0.2773881E+00 Hb(Abramov) -0.6419282E-01 Ex_ueg -0.5585063E-01 Ec_ueg -0.8073630E-02 Delta_ex -0.6336751E-01 Delta_ec 0.1522875E-01 Delta_et -0.2015002E+00 Pxc 0.6917661E+01 Qxc -0.4161046E+01 3,-1 83 3 -1 -3.024986 -0.872797 -2.006245 Rho 0.1091794E+00 |GRAD(Rho)| 0.5240573E-16 GRAD(Rho)x 0.7155734E-17 GRAD(Rho)y -0.3964114E-16 GRAD(Rho)z 0.3352218E-16 Laplacian 0.4522894E+00 (-1/4)Del**2(Rho)) -0.1130724E+00 Diamond 0.6457845E+00 Metallicity 0.3799831E+01 Ellipticity 0.4383371E-02 Gb(Abramov) 0.1469909E+00 Vb(Abramov) -0.1809094E+00 Hb(Abramov) -0.3391853E-01 Ex_ueg -0.3853947E-01 Ec_ueg -0.5884383E-02 Delta_ex -0.4530395E-01 Delta_ec 0.1292231E-01 Delta_et -0.1640510E+00 Pxc 0.6549450E+01 Qxc -0.3505870E+01 3,-1 84 3 +1 -1.085846 2.186118 1.393793 Rho 0.2634200E-01 |GRAD(Rho)| 0.1631093E-15 GRAD(Rho)x 0.6492927E-16 GRAD(Rho)y 0.1051705E-15 GRAD(Rho)z 0.1064330E-15 Laplacian 0.1020202E+00 (-1/4)Del**2(Rho)) -0.2550505E-01 Diamond 0.1389146E-01 Metallicity 0.1575221E+01 Ellipticity -0.3468344E+01 Gb(Abramov) 0.2369938E-01 Vb(Abramov) -0.2189371E-01 Hb(Abramov) 0.1805669E-02 Ex_ueg -0.5788730E-02 Ec_ueg -0.1156516E-02 Delta_ex -0.6389140E-02 Delta_ec 0.1650230E-02 Delta_et -0.1476930E-01 Pxc 0.5005317E+01 Qxc -0.3871665E+01 3,+1 85 3 +3 1.086659 1.143413 1.136991 Rho 0.5012266E-02 |GRAD(Rho)| 0.6513027E-17 GRAD(Rho)x -0.6158496E-17 GRAD(Rho)y -0.6913956E-18 GRAD(Rho)z 0.2003602E-17 Laplacian 0.1909896E-01 (-1/4)Del**2(Rho)) -0.4774741E-02 Diamond 0.1324377E-03 Metallicity 0.5296555E+00 Ellipticity -0.1421848E-01 Gb(Abramov) 0.3604655E-02 Vb(Abramov) -0.2434570E-02 Hb(Abramov) 0.1170086E-02 Ex_ueg -0.6335251E-03 Ec_ueg -0.1474407E-03 Delta_ex -0.6590229E-03 Delta_ec 0.8184372E-04 Delta_et -0.6548125E-03 Pxc 0.4296814E+01 Qxc -0.8052211E+01 3,+3 86 3 +1 -0.159705 -2.936872 -0.149358 Rho 0.5528520E-02 |GRAD(Rho)| 0.9956384E-13 GRAD(Rho)x -0.9873604E-13 GRAD(Rho)y -0.1275097E-13 GRAD(Rho)z 0.1251344E-14 Laplacian 0.2251995E-01 (-1/4)Del**2(Rho)) -0.5629988E-02 Diamond 0.5835404E-03 Metallicity 0.5289246E+00 Ellipticity -0.3200648E+01 Gb(Abramov) 0.4249632E-02 Vb(Abramov) -0.2869276E-02 Hb(Abramov) 0.1380356E-02 Ex_ueg -0.7219884E-03 Ec_ueg -0.1697276E-03 Delta_ex -0.1127458E-02 Delta_ec 0.6836092E-03 Delta_et -0.3836383E-02 Pxc 0.4253807E+01 Qxc -0.1649272E+01 3,+1 87 3 -1 -1.994622 -3.008785 -0.846533 Rho 0.1310383E+00 |GRAD(Rho)| 0.3371227E-15 GRAD(Rho)x 0.2503558E-15 GRAD(Rho)y 0.4636997E-16 GRAD(Rho)z -0.2209604E-15 Laplacian 0.5090183E+00 (-1/4)Del**2(Rho)) -0.1272546E+00 Diamond 0.8804852E+00 Metallicity 0.4576608E+01 Ellipticity 0.2958641E-01 Gb(Abramov) 0.1819021E+00 Vb(Abramov) -0.2365496E+00 Hb(Abramov) -0.5464752E-01 Ex_ueg -0.4915672E-01 Ec_ueg -0.7240982E-02 Delta_ex -0.5293574E-01 Delta_ec 0.1342288E-01 Delta_et -0.1752340E+00 Pxc 0.6788681E+01 Qxc -0.3943693E+01 3,-1 88 3 +1 -0.537594 -0.553485 1.687367 Rho 0.8313996E-02 |GRAD(Rho)| 0.5897798E-16 GRAD(Rho)x 0.5242568E-17 GRAD(Rho)y 0.4521654E-16 GRAD(Rho)z -0.3750176E-16 Laplacian 0.3166808E-01 (-1/4)Del**2(Rho)) -0.7917021E-02 Diamond 0.8061513E-03 Metallicity 0.7424623E+00 Ellipticity -0.1454156E+01 Gb(Abramov) 0.6257696E-02 Vb(Abramov) -0.4598370E-02 Hb(Abramov) 0.1659325E-02 Ex_ueg -0.1243936E-02 Ec_ueg -0.2922017E-03 Delta_ex -0.1432918E-02 Delta_ec 0.4429633E-03 Delta_et -0.3003572E-02 Pxc 0.4257115E+01 Qxc -0.3234846E+01 3,+1 89 3 -1 -1.740955 1.747725 0.525076 Rho 0.4278367E-01 |GRAD(Rho)| 0.1202377E-15 GRAD(Rho)x 0.6540725E-16 GRAD(Rho)y -0.8458323E-16 GRAD(Rho)z 0.5499700E-16 Laplacian 0.1719883E+00 (-1/4)Del**2(Rho)) -0.4299708E-01 Diamond 0.6953163E-01 Metallicity 0.2096900E+01 Ellipticity 0.1538259E-01 Gb(Abramov) 0.4369148E-01 Vb(Abramov) -0.4438588E-01 Hb(Abramov) -0.6943999E-03 Ex_ueg -0.1105153E-01 Ec_ueg -0.2020047E-02 Delta_ex -0.1356165E-01 Delta_ec 0.5035098E-02 Delta_et -0.5093660E-01 Pxc 0.5470928E+01 Qxc -0.2693423E+01 3,-1 90 3 +1 -0.529527 -1.678325 0.550461 Rho 0.8473527E-02 |GRAD(Rho)| 0.1680215E-15 GRAD(Rho)x 0.1317145E-15 GRAD(Rho)y 0.1029141E-15 GRAD(Rho)z -0.1706421E-16 Laplacian 0.3230181E-01 (-1/4)Del**2(Rho)) -0.8075454E-02 Diamond 0.8450117E-03 Metallicity 0.7513229E+00 Ellipticity -0.1462970E+01 Gb(Abramov) 0.6394848E-02 Vb(Abramov) -0.4714242E-02 Hb(Abramov) 0.1680606E-02 Ex_ueg -0.1275863E-02 Ec_ueg -0.2993249E-03 Delta_ex -0.1469165E-02 Delta_ec 0.4527758E-03 Delta_et -0.3084370E-02 Pxc 0.4262468E+01 Qxc -0.3244795E+01 3,+1 91 3 -1 -2.000731 -0.873825 -3.037655 Rho 0.1078707E+00 |GRAD(Rho)| 0.2834809E-13 GRAD(Rho)x -0.1460367E-13 GRAD(Rho)y 0.2089195E-13 GRAD(Rho)z 0.1240455E-13 Laplacian 0.4443528E+00 (-1/4)Del**2(Rho)) -0.1110882E+00 Diamond 0.6270113E+00 Metallicity 0.3790741E+01 Ellipticity 0.5327087E-02 Gb(Abramov) 0.1442432E+00 Vb(Abramov) -0.1773983E+00 Hb(Abramov) -0.3315504E-01 Ex_ueg -0.3792476E-01 Ec_ueg -0.5804246E-02 Delta_ex -0.4441056E-01 Delta_ec 0.1277674E-01 Delta_et -0.1618838E+00 Pxc 0.6533968E+01 Qxc -0.3475891E+01 3,-1 92 3 +1 -1.444415 -1.027454 -2.193325 Rho 0.2549488E-01 |GRAD(Rho)| 0.3217483E-14 GRAD(Rho)x 0.2219711E-14 GRAD(Rho)y -0.1287083E-14 GRAD(Rho)z 0.1941262E-14 Laplacian 0.9792535E-01 (-1/4)Del**2(Rho)) -0.2448134E-01 Diamond 0.1126781E-01 Metallicity 0.1554079E+01 Ellipticity -0.2292639E+01 Gb(Abramov) 0.2266188E-01 Vb(Abramov) -0.2084242E-01 Hb(Abramov) 0.1819459E-02 Ex_ueg -0.5541862E-02 Ec_ueg -0.1113663E-02 Delta_ex -0.5922440E-02 Delta_ec 0.1304677E-02 Delta_et -0.1164970E-01 Pxc 0.4976248E+01 Qxc -0.4539392E+01 3,+1 93 3 -1 -1.743054 -0.518303 -1.751651 Rho 0.3984674E-01 |GRAD(Rho)| 0.1265890E-13 GRAD(Rho)x -0.1554175E-14 GRAD(Rho)y -0.9460388E-14 GRAD(Rho)z 0.8266397E-14 Laplacian 0.1703702E+00 (-1/4)Del**2(Rho)) -0.4259256E-01 Diamond 0.6807674E-01 Metallicity 0.1880214E+01 Ellipticity 0.1266745E-01 Gb(Abramov) 0.4174223E-01 Vb(Abramov) -0.4089190E-01 Hb(Abramov) 0.8503309E-03 Ex_ueg -0.1005176E-01 Ec_ueg -0.1861849E-02 Delta_ex -0.1352172E-01 Delta_ec 0.5568055E-02 Delta_et -0.5533387E-01 Pxc 0.5398804E+01 Qxc -0.2428446E+01 3,-1 94 3 -1 -1.837751 -0.557737 2.813181 Rho 0.1530089E+00 |GRAD(Rho)| 0.6391042E-16 GRAD(Rho)x -0.1254964E-16 GRAD(Rho)y -0.8321252E-17 GRAD(Rho)z -0.6211123E-16 Laplacian 0.6316071E+00 (-1/4)Del**2(Rho)) -0.1579018E+00 Diamond 0.1303447E+01 Metallicity 0.4775591E+01 Ellipticity 0.9509269E-02 Gb(Abramov) 0.2309469E+00 Vb(Abramov) -0.3039920E+00 Hb(Abramov) -0.7304513E-01 Ex_ueg -0.6044223E-01 Ec_ueg -0.8636402E-02 Delta_ex -0.6808922E-01 Delta_ec 0.1581800E-01 Delta_et -0.2108398E+00 Pxc 0.6998543E+01 Qxc -0.4304540E+01 3,-1 95 3 -1 -1.847820 0.600792 -2.860844 Rho 0.1313943E+00 |GRAD(Rho)| 0.1120789E-13 GRAD(Rho)x 0.9385992E-14 GRAD(Rho)y 0.6194047E-15 GRAD(Rho)z 0.6093962E-14 Laplacian 0.5598398E+00 (-1/4)Del**2(Rho)) -0.1399600E+00 Diamond 0.9918092E+00 Metallicity 0.4180008E+01 Ellipticity 0.2001535E-01 Gb(Abramov) 0.1908123E+00 Vb(Abramov) -0.2416646E+00 Hb(Abramov) -0.5085230E-01 Ex_ueg -0.4933486E-01 Ec_ueg -0.7263347E-02 Delta_ex -0.5849976E-01 Delta_ec 0.1518324E-01 Delta_et -0.1991119E+00 Pxc 0.6792304E+01 Qxc -0.3852915E+01 3,-1 96 3 +3 -2.336704 0.000884 -0.016509 Rho 0.4410810E-02 |GRAD(Rho)| 0.1942533E-16 GRAD(Rho)x 0.1618789E-16 GRAD(Rho)y 0.7548823E-17 GRAD(Rho)z 0.7636160E-17 Laplacian 0.1786460E-01 (-1/4)Del**2(Rho)) -0.4466150E-02 Diamond 0.1463651E-03 Metallicity 0.4575977E+00 Ellipticity -0.3015963E+00 Gb(Abramov) 0.3318050E-02 Vb(Abramov) -0.2169950E-02 Hb(Abramov) 0.1148100E-02 Ex_ueg -0.5342479E-03 Ec_ueg -0.1216463E-03 Delta_ex -0.6414842E-03 Delta_ec 0.1595765E-03 Delta_et -0.9994248E-03 Pxc 0.4391813E+01 Qxc -0.4019917E+01 3,+3 97 3 -1 -1.735935 0.536613 1.742933 Rho 0.4501628E-01 |GRAD(Rho)| 0.1549625E-15 GRAD(Rho)x -0.1097810E-15 GRAD(Rho)y -0.5290081E-16 GRAD(Rho)z 0.9572362E-16 Laplacian 0.1819043E+00 (-1/4)Del**2(Rho)) -0.4547606E-01 Diamond 0.7907851E-01 Metallicity 0.2158007E+01 Ellipticity 0.1422040E-01 Gb(Abramov) 0.4667366E-01 Vb(Abramov) -0.4787125E-01 Hb(Abramov) -0.1197592E-02 Ex_ueg -0.1182709E-01 Ec_ueg -0.2141302E-02 Delta_ex -0.1454081E-01 Delta_ec 0.5347426E-02 Delta_et -0.5483511E-01 Pxc 0.5523315E+01 Qxc -0.2719216E+01 3,-1 98 3 -1 -2.024488 0.847422 3.037717 Rho 0.1544413E+00 |GRAD(Rho)| 0.6447937E-15 GRAD(Rho)x 0.4105060E-15 GRAD(Rho)y 0.4906828E-15 GRAD(Rho)z 0.8046135E-16 Laplacian 0.5999687E+00 (-1/4)Del**2(Rho)) -0.1499922E+00 Diamond 0.1258640E+01 Metallicity 0.5106114E+01 Ellipticity 0.2856664E-01 Gb(Abramov) 0.2276410E+00 Vb(Abramov) -0.3052898E+00 Hb(Abramov) -0.7764880E-01 Ex_ueg -0.6119790E-01 Ec_ueg -0.8728428E-02 Delta_ex -0.6489031E-01 Delta_ec 0.1510258E-01 Delta_et -0.2018248E+00 Pxc 0.7011331E+01 Qxc -0.4296639E+01 3,-1 99 3 +1 -1.074598 1.399777 2.197762 Rho 0.2575530E-01 |GRAD(Rho)| 0.3576397E-16 GRAD(Rho)x -0.2743658E-16 GRAD(Rho)y -0.1759201E-17 GRAD(Rho)z 0.2287358E-16 Laplacian 0.9877943E-01 (-1/4)Del**2(Rho)) -0.2469486E-01 Diamond 0.1241483E-01 Metallicity 0.1566959E+01 Ellipticity -0.2843433E+01 Gb(Abramov) 0.2291254E-01 Vb(Abramov) -0.2113023E-01 Hb(Abramov) 0.1782315E-02 Ex_ueg -0.5617466E-02 Ec_ueg -0.1126817E-02 Delta_ex -0.6083568E-02 Delta_ec 0.1481494E-02 Delta_et -0.1321375E-01 Pxc 0.4985252E+01 Qxc -0.4106374E+01 3,+1 100 3 +1 -0.099624 0.111935 2.951199 Rho 0.4913586E-02 |GRAD(Rho)| 0.4035069E-14 GRAD(Rho)x 0.1746041E-15 GRAD(Rho)y 0.3800882E-14 GRAD(Rho)z 0.1343349E-14 Laplacian 0.1932871E-01 (-1/4)Del**2(Rho)) -0.4832178E-02 Diamond 0.4495194E-03 Metallicity 0.5062999E+00 Ellipticity -0.5031867E+01 Gb(Abramov) 0.3629207E-02 Vb(Abramov) -0.2426237E-02 Hb(Abramov) 0.1202971E-02 Ex_ueg -0.6169498E-03 Ec_ueg -0.1431960E-03 Delta_ex -0.9665374E-03 Delta_ec 0.6242789E-03 Delta_et -0.3366319E-02 Pxc 0.4308430E+01 Qxc -0.1548246E+01 3,+1 101 3 -1 -0.538942 -1.730258 -1.734030 Rho 0.4827646E-01 |GRAD(Rho)| 0.2808998E-13 GRAD(Rho)x 0.4622525E-14 GRAD(Rho)y -0.2758078E-13 GRAD(Rho)z 0.2641961E-14 Laplacian 0.1965798E+00 (-1/4)Del**2(Rho)) -0.4914496E-01 Diamond 0.9443272E-01 Metallicity 0.2243709E+01 Ellipticity 0.1435170E-01 Gb(Abramov) 0.5114114E-01 Vb(Abramov) -0.5313732E-01 Hb(Abramov) -0.1996178E-02 Ex_ueg -0.1298272E-01 Ec_ueg -0.2319827E-02 Delta_ex -0.1601275E-01 Delta_ec 0.5812199E-02 Delta_et -0.6071626E-01 Pxc 0.5596417E+01 Qxc -0.2755024E+01 3,-1 102 3 +3 -0.000022 0.008947 2.370780 Rho 0.4309026E-02 |GRAD(Rho)| 0.2706388E-16 GRAD(Rho)x 0.1512276E-16 GRAD(Rho)y -0.1706393E-16 GRAD(Rho)z -0.1458006E-16 Laplacian 0.1720264E-01 (-1/4)Del**2(Rho)) -0.4300661E-02 Diamond 0.1412074E-03 Metallicity 0.4570704E+00 Ellipticity -0.2405725E+00 Gb(Abramov) 0.3194725E-02 Vb(Abramov) -0.2088789E-02 Hb(Abramov) 0.1105936E-02 Ex_ueg -0.5178737E-03 Ec_ueg -0.1172996E-03 Delta_ex -0.6193171E-03 Delta_ec 0.1630848E-03 Delta_et -0.1002110E-02 Pxc 0.4414964E+01 Qxc -0.3797515E+01 3,+3 103 3 +3 1.102047 -1.108664 -1.116102 Rho 0.5276852E-02 |GRAD(Rho)| 0.2866058E-17 GRAD(Rho)x -0.2830766E-17 GRAD(Rho)y 0.3469195E-20 GRAD(Rho)z 0.4483749E-18 Laplacian 0.2063912E-01 (-1/4)Del**2(Rho)) -0.5159781E-02 Diamond 0.1546040E-03 Metallicity 0.5340068E+00 Ellipticity -0.6967493E-01 Gb(Abramov) 0.3899080E-02 Vb(Abramov) -0.2638380E-02 Hb(Abramov) 0.1260701E-02 Ex_ueg -0.6785028E-03 Ec_ueg -0.1588463E-03 Delta_ex -0.7233390E-03 Delta_ec 0.9002965E-04 Delta_et -0.7218410E-03 Pxc 0.4271443E+01 Qxc -0.8034453E+01 3,+3 104 3 -1 0.553408 -2.773603 -1.801793 Rho 0.1327638E+00 |GRAD(Rho)| 0.4920239E-15 GRAD(Rho)x 0.1935843E-15 GRAD(Rho)y -0.3045592E-15 GRAD(Rho)z 0.3344493E-15 Laplacian 0.5593284E+00 (-1/4)Del**2(Rho)) -0.1398321E+00 Diamond 0.9758428E+00 Metallicity 0.4256759E+01 Ellipticity 0.8398085E-02 Gb(Abramov) 0.1924266E+00 Vb(Abramov) -0.2450212E+00 Hb(Abramov) -0.5259455E-01 Ex_ueg -0.5002164E-01 Ec_ueg -0.7349455E-02 Delta_ex -0.5826966E-01 Delta_ec 0.1455711E-01 Delta_et -0.1901625E+00 Pxc 0.6806169E+01 Qxc -0.4002831E+01 3,-1 105 3 +1 0.539708 -1.660314 -0.522641 Rho 0.8921095E-02 |GRAD(Rho)| 0.2828959E-16 GRAD(Rho)x 0.2240253E-16 GRAD(Rho)y 0.1225231E-16 GRAD(Rho)z 0.1217821E-16 Laplacian 0.3470825E-01 (-1/4)Del**2(Rho)) -0.8677063E-02 Diamond 0.9768135E-03 Metallicity 0.7618638E+00 Ellipticity -0.1464352E+01 Gb(Abramov) 0.6886499E-02 Vb(Abramov) -0.5095934E-02 Hb(Abramov) 0.1790564E-02 Ex_ueg -0.1366499E-02 Ec_ueg -0.3193696E-03 Delta_ex -0.1600579E-02 Delta_ec 0.4886939E-03 Delta_et -0.3371560E-02 Pxc 0.4278738E+01 Qxc -0.3275217E+01 3,+1 106 3 -1 -0.853701 -2.022675 -3.022376 Rho 0.1602568E+00 |GRAD(Rho)| 0.3100125E-15 GRAD(Rho)x -0.1358776E-15 GRAD(Rho)y 0.2520092E-15 GRAD(Rho)z 0.1188963E-15 Laplacian 0.6274645E+00 (-1/4)Del**2(Rho)) -0.1568661E+00 Diamond 0.1369983E+01 Metallicity 0.5192600E+01 Ellipticity 0.4050721E-01 Gb(Abramov) 0.2403346E+00 Vb(Abramov) -0.3238031E+00 Hb(Abramov) -0.8346847E-01 Ex_ueg -0.6428956E-01 Ec_ueg -0.9103299E-02 Delta_ex -0.6843203E-01 Delta_ec 0.1554905E-01 Delta_et -0.2085447E+00 Pxc 0.7062226E+01 Qxc -0.4401043E+01 3,-1 107 3 +3 0.001269 2.382085 0.010676 Rho 0.4169163E-02 |GRAD(Rho)| 0.6180290E-15 GRAD(Rho)x 0.3009441E-15 GRAD(Rho)y -0.4570359E-15 GRAD(Rho)z -0.2872468E-15 Laplacian 0.1661995E-01 (-1/4)Del**2(Rho)) -0.4154986E-02 Diamond 0.1303609E-03 Metallicity 0.4477804E+00 Ellipticity -0.2384895E+00 Gb(Abramov) 0.3080078E-02 Vb(Abramov) -0.2005169E-02 Hb(Abramov) 0.1074909E-02 Ex_ueg -0.4955836E-03 Ec_ueg -0.1113356E-03 Delta_ex -0.5932573E-03 Delta_ec 0.1573589E-03 Delta_et -0.9594594E-03 Pxc 0.4451259E+01 Qxc -0.3770091E+01 3,+3 108 3 +1 -0.066494 2.975450 0.089802 Rho 0.4794637E-02 |GRAD(Rho)| 0.6355962E-17 GRAD(Rho)x 0.4213081E-17 GRAD(Rho)y 0.3914640E-18 GRAD(Rho)z 0.4742885E-17 Laplacian 0.1876082E-01 (-1/4)Del**2(Rho)) -0.4690205E-02 Diamond 0.4391566E-03 Metallicity 0.5007498E+00 Ellipticity -0.1008182E+02 Gb(Abramov) 0.3518240E-02 Vb(Abramov) -0.2346275E-02 Hb(Abramov) 0.1171965E-02 Ex_ueg -0.5971168E-03 Ec_ueg -0.1380859E-03 Delta_ex -0.9504475E-03 Delta_ec 0.6357047E-03 Delta_et -0.3390931E-02 Pxc 0.4324242E+01 Qxc -0.1495109E+01 3,+1 109 3 -1 -0.890780 3.030907 2.007421 Rho 0.1229598E+00 |GRAD(Rho)| 0.2516764E-12 GRAD(Rho)x 0.1816429E-12 GRAD(Rho)y -0.9085763E-13 GRAD(Rho)z 0.1486330E-12 Laplacian 0.5031635E+00 (-1/4)Del**2(Rho)) -0.1257909E+00 Diamond 0.8254159E+00 Metallicity 0.4163988E+01 Ellipticity 0.1851176E-01 Gb(Abramov) 0.1711592E+00 Vb(Abramov) -0.2165275E+00 Hb(Abramov) -0.4536832E-01 Ex_ueg -0.4515814E-01 Ec_ueg -0.6735756E-02 Delta_ex -0.5178227E-01 Delta_ec 0.1391346E-01 Delta_et -0.1804720E+00 Pxc 0.6704243E+01 Qxc -0.3721740E+01 3,-1 110 3 +3 -0.002135 -2.314484 0.021827 Rho 0.4684233E-02 |GRAD(Rho)| 0.2963118E-17 GRAD(Rho)x 0.8502257E-18 GRAD(Rho)y 0.1825608E-17 GRAD(Rho)z 0.2173555E-17 Laplacian 0.1899806E-01 (-1/4)Del**2(Rho)) -0.4749516E-02 Diamond 0.1655988E-03 Metallicity 0.4756652E+00 Ellipticity -0.3028499E+00 Gb(Abramov) 0.3542874E-02 Vb(Abramov) -0.2336232E-02 Hb(Abramov) 0.1206642E-02 Ex_ueg -0.5788550E-03 Ec_ueg -0.1333495E-03 Delta_ex -0.6894515E-03 Delta_ec 0.1637399E-03 Delta_et -0.1048819E-02 Pxc 0.4340886E+01 Qxc -0.4210650E+01 3,+3 111 3 -1 -0.591362 -1.819754 2.813694 Rho 0.1171260E+00 |GRAD(Rho)| 0.3173520E-12 GRAD(Rho)x -0.2084032E-12 GRAD(Rho)y 0.2285627E-12 GRAD(Rho)z 0.7098951E-13 Laplacian 0.5078626E+00 (-1/4)Del**2(Rho)) -0.1269657E+00 Diamond 0.7900313E+00 Metallicity 0.3804424E+01 Ellipticity 0.1638119E-01 Gb(Abramov) 0.1651490E+00 Vb(Abramov) -0.2033323E+00 Hb(Abramov) -0.3818331E-01 Ex_ueg -0.4232426E-01 Ec_ueg -0.6373684E-02 Delta_ex -0.5172702E-01 Delta_ec 0.1430511E-01 Delta_et -0.1840827E+00 Pxc 0.6640470E+01 Qxc -0.3615982E+01 3,-1 112 3 +3 -0.024662 0.029520 -2.365903 Rho 0.4297034E-02 |GRAD(Rho)| 0.9614805E-16 GRAD(Rho)x -0.5371948E-16 GRAD(Rho)y -0.5056049E-16 GRAD(Rho)z 0.6166280E-16 Laplacian 0.1705382E-01 (-1/4)Del**2(Rho)) -0.4263454E-02 Diamond 0.1365127E-03 Metallicity 0.4589228E+00 Ellipticity -0.2410001E+00 Gb(Abramov) 0.3168402E-02 Vb(Abramov) -0.2073350E-02 Hb(Abramov) 0.1095052E-02 Ex_ueg -0.5159530E-03 Ec_ueg -0.1167879E-03 Delta_ex -0.6101793E-03 Delta_ec 0.1556984E-03 Delta_et -0.9642098E-03 Pxc 0.4417864E+01 Qxc -0.3918983E+01 3,+3 113 3 +1 -0.113488 -0.082691 -2.960923 Rho 0.4951730E-02 |GRAD(Rho)| 0.4021406E-17 GRAD(Rho)x 0.3857459E-17 GRAD(Rho)y 0.2998195E-18 GRAD(Rho)z 0.1096278E-17 Laplacian 0.1933489E-01 (-1/4)Del**2(Rho)) -0.4833723E-02 Diamond 0.4587218E-03 Metallicity 0.5127036E+00 Ellipticity -0.6643967E+01 Gb(Abramov) 0.3635527E-02 Vb(Abramov) -0.2437330E-02 Hb(Abramov) 0.1198196E-02 Ex_ueg -0.6233439E-03 Ec_ueg -0.1448362E-03 Delta_ex -0.9723762E-03 Delta_ec 0.6318029E-03 Delta_et -0.3411944E-02 Pxc 0.4303787E+01 Qxc -0.1539050E+01 3,+1 114 3 -1 -0.856044 -3.006488 -1.988027 Rho 0.1422482E+00 |GRAD(Rho)| 0.8977484E-15 GRAD(Rho)x 0.7520704E-15 GRAD(Rho)y 0.3425401E-15 GRAD(Rho)z -0.3507259E-15 Laplacian 0.5563773E+00 (-1/4)Del**2(Rho)) -0.1390943E+00 Diamond 0.1057530E+01 Metallicity 0.4800890E+01 Ellipticity 0.4640364E-01 Gb(Abramov) 0.2040256E+00 Vb(Abramov) -0.2689570E+00 Hb(Abramov) -0.6493131E-01 Ex_ueg -0.5484210E-01 Ec_ueg -0.7949149E-02 Delta_ex -0.5897438E-01 Delta_ec 0.1429578E-01 Delta_et -0.1888461E+00 Pxc 0.6899117E+01 Qxc -0.4125301E+01 3,-1 115 3 +1 0.180748 -2.935759 0.198394 Rho 0.5481901E-02 |GRAD(Rho)| 0.2971318E-12 GRAD(Rho)x -0.2855188E-12 GRAD(Rho)y 0.5790434E-13 GRAD(Rho)z 0.5842430E-13 Laplacian 0.2205251E-01 (-1/4)Del**2(Rho)) -0.5513127E-02 Diamond 0.5284175E-03 Metallicity 0.5325665E+00 Ellipticity -0.2392854E+01 Gb(Abramov) 0.4164769E-02 Vb(Abramov) -0.2816411E-02 Hb(Abramov) 0.1348358E-02 Ex_ueg -0.7138823E-03 Ec_ueg -0.1677095E-03 Delta_ex -0.1072194E-02 Delta_ec 0.6158404E-03 Delta_et -0.3469559E-02 Pxc 0.4256659E+01 Qxc -0.1741026E+01 3,+1 116 3 -1 -0.027107 -2.937483 -0.013727 Rho 0.5549282E-02 |GRAD(Rho)| 0.3615080E-17 GRAD(Rho)x 0.2372470E-17 GRAD(Rho)y 0.7597300E-19 GRAD(Rho)z -0.2726613E-17 Laplacian 0.2192413E-01 (-1/4)Del**2(Rho)) -0.5481033E-02 Diamond 0.6645816E-03 Metallicity 0.5467038E+00 Ellipticity 0.3040103E+01 Gb(Abramov) 0.4153439E-02 Vb(Abramov) -0.2825845E-02 Hb(Abramov) 0.1327594E-02 Ex_ueg -0.7256059E-03 Ec_ueg -0.1706267E-03 Delta_ex -0.1174087E-02 Delta_ec 0.8005759E-03 Delta_et -0.4441914E-02 Pxc 0.4252593E+01 Qxc -0.1466553E+01 3,-1 117 3 -1 -0.580719 -2.813490 1.809829 Rho 0.1217978E+00 |GRAD(Rho)| 0.1376728E-13 GRAD(Rho)x 0.1786006E-14 GRAD(Rho)y 0.5222798E-14 GRAD(Rho)z -0.1261232E-13 Laplacian 0.5249026E+00 (-1/4)Del**2(Rho)) -0.1312257E+00 Diamond 0.8545101E+00 Metallicity 0.3928862E+01 Ellipticity 0.1783598E-01 Gb(Abramov) 0.1734117E+00 Vb(Abramov) -0.2155977E+00 Hb(Abramov) -0.4218604E-01 Ex_ueg -0.4459002E-01 Ec_ueg -0.6663447E-02 Delta_ex -0.5394022E-01 Delta_ec 0.1462172E-01 Delta_et -0.1894596E+00 Pxc 0.6691734E+01 Qxc -0.3689047E+01 3,-1 118 3 +1 -0.561792 0.557518 -1.712779 Rho 0.7722974E-02 |GRAD(Rho)| 0.1798464E-14 GRAD(Rho)x 0.1545363E-14 GRAD(Rho)y 0.3746552E-15 GRAD(Rho)z 0.8402146E-15 Laplacian 0.2854555E-01 (-1/4)Del**2(Rho)) -0.7136388E-02 Diamond 0.6472235E-03 Metallicity 0.7284208E+00 Ellipticity -0.1440731E+01 Gb(Abramov) 0.5623974E-02 Vb(Abramov) -0.4111560E-02 Hb(Abramov) 0.1512414E-02 Ex_ueg -0.1127451E-02 Ec_ueg -0.2659120E-03 Delta_ex -0.1262659E-02 Delta_ec 0.3899814E-03 Delta_et -0.2602343E-02 Pxc 0.4239941E+01 Qxc -0.3237742E+01 3,+1 119 3 +1 0.083802 0.112900 -2.962041 Rho 0.4951063E-02 |GRAD(Rho)| 0.1434862E-16 GRAD(Rho)x 0.8924194E-17 GRAD(Rho)y 0.1123208E-16 GRAD(Rho)z -0.2862881E-18 Laplacian 0.1932910E-01 (-1/4)Del**2(Rho)) -0.4832276E-02 Diamond 0.4573278E-03 Metallicity 0.5127420E+00 Ellipticity -0.6273342E+01 Gb(Abramov) 0.3634469E-02 Vb(Abramov) -0.2436662E-02 Hb(Abramov) 0.1197807E-02 Ex_ueg -0.6232318E-03 Ec_ueg -0.1448074E-03 Delta_ex -0.9709560E-03 Delta_ec 0.6296425E-03 Delta_et -0.3400908E-02 Pxc 0.4303866E+01 Qxc -0.1542075E+01 3,+1 120 3 -1 -0.470407 0.470476 0.473445 Rho 0.1854635E+00 |GRAD(Rho)| 0.1610586E-15 GRAD(Rho)x 0.1006140E-15 GRAD(Rho)y -0.1144917E-15 GRAD(Rho)z 0.5204170E-16 Laplacian 0.5033742E+00 (-1/4)Del**2(Rho)) -0.1258436E+00 Diamond 0.1341553E+01 Metallicity 0.8256948E+01 Ellipticity 0.4810460E-02 Gb(Abramov) 0.2570763E+00 Vb(Abramov) -0.3883091E+00 Hb(Abramov) -0.1312328E+00 Ex_ueg -0.7811413E-01 Ec_ueg -0.1075116E-01 Delta_ex -0.5718409E-01 Delta_ec 0.1243371E-01 Delta_et -0.1708307E+00 Pxc 0.7265644E+01 Qxc -0.4599118E+01 3,-1 121 3 -1 -0.018230 0.011957 -2.962846 Rho 0.4955146E-02 |GRAD(Rho)| 0.3370014E-17 GRAD(Rho)x 0.1618625E-18 GRAD(Rho)y -0.3145336E-17 GRAD(Rho)z 0.1199023E-17 Laplacian 0.1919336E-01 (-1/4)Del**2(Rho)) -0.4798340E-02 Diamond 0.4843756E-03 Metallicity 0.5170783E+00 Ellipticity 0.1033527E+02 Gb(Abramov) 0.3612413E-02 Vb(Abramov) -0.2426486E-02 Hb(Abramov) 0.1185927E-02 Ex_ueg -0.6239173E-03 Ec_ueg -0.1449831E-03 Delta_ex -0.9922530E-03 Delta_ec 0.6751486E-03 Delta_et -0.3628075E-02 Pxc 0.4303380E+01 Qxc -0.1469681E+01 3,-1 122 3 -1 -0.597100 1.848179 -2.862046 Rho 0.1346729E+00 |GRAD(Rho)| 0.1385090E-15 GRAD(Rho)x 0.5198749E-16 GRAD(Rho)y 0.1038937E-15 GRAD(Rho)z 0.7541981E-16 Laplacian 0.5713017E+00 (-1/4)Del**2(Rho)) -0.1428254E+00 Diamond 0.1041192E+01 Metallicity 0.4267903E+01 Ellipticity 0.1787902E-01 Gb(Abramov) 0.1968111E+00 Vb(Abramov) -0.2507968E+00 Hb(Abramov) -0.5398571E-01 Ex_ueg -0.5098299E-01 Ec_ueg -0.7469700E-02 Delta_ex -0.6003622E-01 Delta_ec 0.1537646E-01 Delta_et -0.2024202E+00 Pxc 0.6825306E+01 Qxc -0.3904425E+01 3,-1 123 3 -1 -0.536218 1.743998 1.743403 Rho 0.4215560E-01 |GRAD(Rho)| 0.1936491E-14 GRAD(Rho)x -0.1660594E-14 GRAD(Rho)y -0.9959642E-15 GRAD(Rho)z -0.2190978E-16 Laplacian 0.1807032E+00 (-1/4)Del**2(Rho)) -0.4517579E-01 Diamond 0.7783850E-01 Metallicity 0.1947181E+01 Ellipticity 0.1479939E-01 Gb(Abramov) 0.4477810E-01 Vb(Abramov) -0.4438041E-01 Hb(Abramov) 0.3976916E-03 Ex_ueg -0.1083575E-01 Ec_ueg -0.1986088E-02 Delta_ex -0.1453387E-01 Delta_ec 0.5893474E-02 Delta_et -0.5947873E-01 Pxc 0.5455822E+01 Qxc -0.2466095E+01 3,-1 124 3 -1 -0.889421 1.997963 3.040528 Rho 0.1150669E+00 |GRAD(Rho)| 0.4545325E-15 GRAD(Rho)x 0.3800264E-15 GRAD(Rho)y 0.1724288E-15 GRAD(Rho)z -0.1801334E-15 Laplacian 0.4742652E+00 (-1/4)Del**2(Rho)) -0.1185663E+00 Diamond 0.7199272E+00 Metallicity 0.3955266E+01 Ellipticity 0.1409440E-01 Gb(Abramov) 0.1572044E+00 Vb(Abramov) -0.1958425E+00 Hb(Abramov) -0.3863812E-01 Ex_ueg -0.4133508E-01 Ec_ueg -0.6246460E-02 Delta_ex -0.4807207E-01 Delta_ec 0.1335523E-01 Delta_et -0.1712058E+00 Pxc 0.6617362E+01 Qxc -0.3599493E+01 3,-1 125 3 -1 -0.599789 2.837906 -1.826019 Rho 0.1148084E+00 |GRAD(Rho)| 0.4231523E-12 GRAD(Rho)x 0.2663732E-12 GRAD(Rho)y -0.7962063E-13 GRAD(Rho)z -0.3190043E-12 Laplacian 0.4961597E+00 (-1/4)Del**2(Rho)) -0.1240399E+00 Diamond 0.7535084E+00 Metallicity 0.3766586E+01 Ellipticity 0.1775167E-01 Gb(Abramov) 0.1605611E+00 Vb(Abramov) -0.1970824E+00 Hb(Abramov) -0.3652121E-01 Ex_ueg -0.4121134E-01 Ec_ueg -0.6230513E-02 Delta_ex -0.5029865E-01 Delta_ec 0.1403937E-01 Delta_et -0.1799891E+00 Pxc 0.6614438E+01 Qxc -0.3582686E+01 3,-1 126 3 -1 0.531712 -1.741303 1.744202 Rho 0.4303249E-01 |GRAD(Rho)| 0.7857859E-16 GRAD(Rho)x -0.2033133E-16 GRAD(Rho)y -0.6326489E-16 GRAD(Rho)z 0.4193787E-16 Laplacian 0.1852810E+00 (-1/4)Del**2(Rho)) -0.4632026E-01 Diamond 0.8217110E-01 Metallicity 0.1965364E+01 Ellipticity 0.1328652E-01 Gb(Abramov) 0.4605287E-01 Vb(Abramov) -0.4578548E-01 Hb(Abramov) 0.2673911E-03 Ex_ueg -0.1113731E-01 Ec_ueg -0.2033519E-02 Delta_ex -0.1498229E-01 Delta_ec 0.6051220E-02 Delta_et -0.6141646E-01 Pxc 0.5476866E+01 Qxc -0.2475912E+01 3,-1 127 3 +1 0.099327 -0.097624 2.947669 Rho 0.4919182E-02 |GRAD(Rho)| 0.2222668E-15 GRAD(Rho)x 0.1678491E-15 GRAD(Rho)y -0.1456074E-15 GRAD(Rho)z -0.5261916E-17 Laplacian 0.1930100E-01 (-1/4)Del**2(Rho)) -0.4825249E-02 Diamond 0.4587754E-03 Metallicity 0.5079898E+00 Ellipticity -0.7747238E+01 Gb(Abramov) 0.3625362E-02 Vb(Abramov) -0.2425475E-02 Hb(Abramov) 0.1199887E-02 Ex_ueg -0.6178868E-03 Ec_ueg -0.1434365E-03 Delta_ex -0.9741042E-03 Delta_ec 0.6389940E-03 Delta_et -0.3440685E-02 Pxc 0.4307737E+01 Qxc -0.1524434E+01 3,+1 128 3 -1 1.812213 -0.561535 -2.780513 Rho 0.1337367E+00 |GRAD(Rho)| 0.2604522E-15 GRAD(Rho)x 0.2266796E-15 GRAD(Rho)y 0.1258894E-15 GRAD(Rho)z -0.2456734E-16 Laplacian 0.5579356E+00 (-1/4)Del**2(Rho)) -0.1394839E+00 Diamond 0.9835434E+00 Metallicity 0.4319634E+01 Ellipticity 0.1084265E-01 Gb(Abramov) 0.1934092E+00 Vb(Abramov) -0.2473344E+00 Hb(Abramov) -0.5392527E-01 Ex_ueg -0.5051101E-01 Ec_ueg -0.7410707E-02 Delta_ex -0.5824545E-01 Delta_ec 0.1452754E-01 Delta_et -0.1900576E+00 Pxc 0.6815950E+01 Qxc -0.4009312E+01 3,-1 129 3 +1 0.544777 -0.531391 -1.666170 Rho 0.8729119E-02 |GRAD(Rho)| 0.7466195E-17 GRAD(Rho)x 0.4506612E-18 GRAD(Rho)y 0.7208479E-17 GRAD(Rho)z 0.1891775E-17 Laplacian 0.3386804E-01 (-1/4)Del**2(Rho)) -0.8467011E-02 Diamond 0.9226904E-03 Metallicity 0.7529631E+00 Ellipticity -0.1454808E+01 Gb(Abramov) 0.6707232E-02 Vb(Abramov) -0.4947453E-02 Hb(Abramov) 0.1759779E-02 Ex_ueg -0.1327432E-02 Ec_ueg -0.3107609E-03 Delta_ex -0.1552078E-02 Delta_ec 0.4747962E-03 Delta_et -0.3259105E-02 Pxc 0.4271553E+01 Qxc -0.3268935E+01 3,+1 130 3 +3 2.282220 -0.004491 -0.013640 Rho 0.4939814E-02 |GRAD(Rho)| 0.7937460E-15 GRAD(Rho)x -0.5515098E-15 GRAD(Rho)y -0.2751857E-15 GRAD(Rho)z 0.5001424E-15 Laplacian 0.2036536E-01 (-1/4)Del**2(Rho)) -0.5091339E-02 Diamond 0.1876164E-03 Metallicity 0.4848106E+00 Ellipticity -0.3377338E+00 Gb(Abramov) 0.3805615E-02 Vb(Abramov) -0.2519892E-02 Hb(Abramov) 0.1285724E-02 Ex_ueg -0.6213446E-03 Ec_ueg -0.1443237E-03 Delta_ex -0.7462974E-03 Delta_ec 0.1701427E-03 Delta_et -0.1111399E-02 Pxc 0.4305216E+01 Qxc -0.4386303E+01 3,+3 131 3 -1 0.040627 3.253831 3.256955 Rho 0.2178942E+00 |GRAD(Rho)| 0.3674628E-14 GRAD(Rho)x -0.6159624E-15 GRAD(Rho)y -0.2461139E-14 GRAD(Rho)z -0.2658247E-14 Laplacian 0.8142910E+00 (-1/4)Del**2(Rho)) -0.2035727E+00 Diamond 0.2557473E+01 Metallicity 0.6676921E+01 Ellipticity 0.2100711E-02 Gb(Abramov) 0.3622550E+00 Vb(Abramov) -0.5209373E+00 Hb(Abramov) -0.1586823E+00 Ex_ueg -0.9683801E-01 Ec_ueg -0.1292440E-01 Delta_ex -0.9590598E-01 Delta_ec 0.1843091E-01 Delta_et -0.2538841E+00 Pxc 0.7492649E+01 Qxc -0.5203541E+01 3,-1 132 3 -1 -0.047671 3.270756 -3.257470 Rho 0.2164961E+00 |GRAD(Rho)| 0.2794652E-12 GRAD(Rho)x 0.4215230E-13 GRAD(Rho)y -0.1975097E-12 GRAD(Rho)z 0.1931681E-12 Laplacian 0.8073907E+00 (-1/4)Del**2(Rho)) -0.2018477E+00 Diamond 0.2517940E+01 Metallicity 0.6662127E+01 Ellipticity 0.3435555E-02 Gb(Abramov) 0.3586876E+00 Vb(Abramov) -0.5155275E+00 Hb(Abramov) -0.1568399E+00 Ex_ueg -0.9601045E-01 Ec_ueg -0.1282951E-01 Delta_ex -0.9494564E-01 Delta_ec 0.1832665E-01 Delta_et -0.2524252E+00 Pxc 0.7483564E+01 Qxc -0.5180741E+01 3,-1 133 3 -1 -0.467400 -0.475524 -0.473068 Rho 0.1849813E+00 |GRAD(Rho)| 0.3451533E-15 GRAD(Rho)x -0.2636780E-15 GRAD(Rho)y -0.2116363E-15 GRAD(Rho)z -0.6938894E-16 Laplacian 0.5019795E+00 (-1/4)Del**2(Rho)) -0.1254949E+00 Diamond 0.1333954E+01 Metallicity 0.8244044E+01 Ellipticity 0.3943023E-02 Gb(Abramov) 0.2560941E+00 Vb(Abramov) -0.3866934E+00 Hb(Abramov) -0.1305993E+00 Ex_ueg -0.7784348E-01 Ec_ueg -0.1071930E-01 Delta_ex -0.5699057E-01 Delta_ec 0.1241169E-01 Delta_et -0.1704921E+00 Pxc 0.7261993E+01 Qxc -0.4591687E+01 3,-1 134 3 -1 0.477021 -0.472505 0.477848 Rho 0.1839345E+00 |GRAD(Rho)| 0.1642904E-12 GRAD(Rho)x -0.9570122E-13 GRAD(Rho)y 0.9439324E-13 GRAD(Rho)z -0.9445916E-13 Laplacian 0.4981722E+00 (-1/4)Del**2(Rho)) -0.1245431E+00 Diamond 0.1314899E+01 Metallicity 0.8228843E+01 Ellipticity 0.4493138E-02 Gb(Abramov) 0.2538363E+00 Vb(Abramov) -0.3831295E+00 Hb(Abramov) -0.1292932E+00 Ex_ueg -0.7725664E-01 Ec_ueg -0.1065016E-01 Delta_ex -0.5647818E-01 Delta_ec 0.1233662E-01 Delta_et -0.1693586E+00 Pxc 0.7254036E+01 Qxc -0.4578092E+01 3,-1 135 3 -1 0.472305 0.475166 -0.472325 Rho 0.1845114E+00 |GRAD(Rho)| 0.2251401E-15 GRAD(Rho)x -0.3816392E-16 GRAD(Rho)y -0.1006140E-15 GRAD(Rho)z -0.1977585E-15 Laplacian 0.4998467E+00 (-1/4)Del**2(Rho)) -0.1249617E+00 Diamond 0.1324360E+01 Metallicity 0.8244197E+01 Ellipticity 0.3496616E-02 Gb(Abramov) 0.2550092E+00 Vb(Abramov) -0.3850568E+00 Hb(Abramov) -0.1300476E+00 Ex_ueg -0.7757992E-01 Ec_ueg -0.1068826E-01 Delta_ex -0.5671313E-01 Delta_ec 0.1236889E-01 Delta_et -0.1698625E+00 Pxc 0.7258426E+01 Qxc -0.4585143E+01 3,-1 136 3 +1 2.188566 -1.170712 1.287440 Rho 0.2832232E-01 |GRAD(Rho)| 0.9091360E-14 GRAD(Rho)x 0.6814286E-14 GRAD(Rho)y 0.2185871E-14 GRAD(Rho)z 0.5607165E-14 Laplacian 0.1149861E+00 (-1/4)Del**2(Rho)) -0.2874653E-01 Diamond 0.1905949E-01 Metallicity 0.1577063E+01 Ellipticity -0.6599023E+01 Gb(Abramov) 0.2672020E-01 Vb(Abramov) -0.2469387E-01 Hb(Abramov) 0.2026329E-02 Ex_ueg -0.6376124E-02 Ec_ueg -0.1257400E-02 Delta_ex -0.7505271E-02 Delta_ec 0.2148374E-02 Delta_et -0.1951843E-01 Pxc 0.5070882E+01 Qxc -0.3493466E+01 3,+1 137 3 -1 0.072612 -3.220386 -3.191614 Rho 0.2399554E+00 |GRAD(Rho)| 0.4883548E-13 GRAD(Rho)x -0.1071447E-13 GRAD(Rho)y 0.3407875E-13 GRAD(Rho)z 0.3329780E-13 Laplacian 0.8820531E+00 (-1/4)Del**2(Rho)) -0.2205133E+00 Diamond 0.3110697E+01 Metallicity 0.7238845E+01 Ellipticity 0.2466122E-02 Gb(Abramov) 0.4130524E+00 Vb(Abramov) -0.6055916E+00 Hb(Abramov) -0.1925391E+00 Ex_ueg -0.1101266E+00 Ec_ueg -0.1443603E-01 Delta_ex -0.1065212E+00 Delta_ec 0.1940865E-01 Delta_et -0.2684989E+00 Pxc 0.7628596E+01 Qxc -0.5488337E+01 3,-1 138 3 -1 -0.058116 -3.251777 3.244729 Rho 0.2169468E+00 |GRAD(Rho)| 0.1146158E-14 GRAD(Rho)x -0.1512191E-15 GRAD(Rho)y -0.8983699E-15 GRAD(Rho)z 0.6955157E-15 Laplacian 0.8116412E+00 (-1/4)Del**2(Rho)) -0.2029103E+00 Diamond 0.2534829E+01 Metallicity 0.6650246E+01 Ellipticity 0.2107504E-02 Gb(Abramov) 0.3601741E+00 Vb(Abramov) -0.5174379E+00 Hb(Abramov) -0.1572638E+00 Ex_ueg -0.9627702E-01 Ec_ueg -0.1286009E-01 Delta_ex -0.9548027E-01 Delta_ec 0.1838286E-01 Delta_et -0.2531161E+00 Pxc 0.7486499E+01 Qxc -0.5193984E+01 3,-1 139 3 +1 1.741658 -1.753559 -1.749037 Rho 0.1250778E-01 |GRAD(Rho)| 0.9977885E-12 GRAD(Rho)x 0.5774848E-12 GRAD(Rho)y 0.7986955E-12 GRAD(Rho)z 0.1554951E-12 Laplacian 0.6290698E-01 (-1/4)Del**2(Rho)) -0.1572674E-01 Diamond 0.2623493E-02 Metallicity 0.7382690E+00 Ellipticity -0.1240251E+01 Gb(Abramov) 0.1241959E-01 Vb(Abramov) -0.9112438E-02 Hb(Abramov) 0.3307153E-02 Ex_ueg -0.2144332E-02 Ec_ueg -0.4830603E-03 Delta_ex -0.3113986E-02 Delta_ec 0.7947260E-03 Delta_et -0.6036088E-02 Pxc 0.4439056E+01 Qxc -0.3918314E+01 3,+1 140 3 +1 1.031766 2.192098 -1.451677 Rho 0.2594598E-01 |GRAD(Rho)| 0.3406140E-16 GRAD(Rho)x 0.3254827E-17 GRAD(Rho)y -0.3387198E-16 GRAD(Rho)z 0.1507891E-17 Laplacian 0.9972722E-01 (-1/4)Del**2(Rho)) -0.2493181E-01 Diamond 0.1188436E-01 Metallicity 0.1571265E+01 Ellipticity -0.2373046E+01 Gb(Abramov) 0.2315028E-01 Vb(Abramov) -0.2136876E-01 Hb(Abramov) 0.1781523E-02 Ex_ueg -0.5672987E-02 Ec_ueg -0.1136460E-02 Delta_ex -0.6073894E-02 Delta_ec 0.1352158E-02 Delta_et -0.1211413E-01 Pxc 0.4991806E+01 Qxc -0.4492001E+01 3,+1 141 3 -1 0.515179 1.747799 -1.751504 Rho 0.4111862E-01 |GRAD(Rho)| 0.4970559E-16 GRAD(Rho)x 0.1821015E-16 GRAD(Rho)y -0.1787324E-16 GRAD(Rho)z -0.4265658E-16 Laplacian 0.1761639E+00 (-1/4)Del**2(Rho)) -0.4404097E-01 Diamond 0.7355663E-01 Metallicity 0.1916140E+01 Ellipticity 0.1231964E-01 Gb(Abramov) 0.4342543E-01 Vb(Abramov) -0.4280988E-01 Hb(Abramov) 0.6155483E-03 Ex_ueg -0.1048181E-01 Ec_ueg -0.1930171E-02 Delta_ex -0.1409409E-01 Delta_ec 0.5765971E-02 Delta_et -0.5779883E-01 Pxc 0.5430510E+01 Qxc -0.2444356E+01 3,-1 142 3 -1 0.587218 1.824636 2.822046 Rho 0.1108988E+00 |GRAD(Rho)| 0.3639417E-15 GRAD(Rho)x -0.2305149E-15 GRAD(Rho)y 0.2795209E-15 GRAD(Rho)z -0.3441664E-16 Laplacian 0.4831163E+00 (-1/4)Del**2(Rho)) -0.1207791E+00 Diamond 0.7046889E+00 Metallicity 0.3651236E+01 Ellipticity 0.1843382E-01 Gb(Abramov) 0.1540182E+00 Vb(Abramov) -0.1872573E+00 Hb(Abramov) -0.3323912E-01 Ex_ueg -0.3935088E-01 Ec_ueg -0.5989867E-02 Delta_ex -0.4859512E-01 Delta_ec 0.1380257E-01 Delta_et -0.1758230E+00 Pxc 0.6569574E+01 Qxc -0.3520731E+01 3,-1 143 3 -1 0.874754 1.996001 -3.039578 Rho 0.1089114E+00 |GRAD(Rho)| 0.1298072E-15 GRAD(Rho)x 0.1382358E-16 GRAD(Rho)y -0.1126079E-15 GRAD(Rho)z -0.6307346E-16 Laplacian 0.4473090E+00 (-1/4)Del**2(Rho)) -0.1118272E+00 Diamond 0.6385124E+00 Metallicity 0.3826437E+01 Ellipticity 0.4754552E-02 Gb(Abramov) 0.1458681E+00 Vb(Abramov) -0.1799091E+00 Hb(Abramov) -0.3404091E-01 Ex_ueg -0.3841342E-01 Ec_ueg -0.5867966E-02 Delta_ex -0.4480578E-01 Delta_ec 0.1283405E-01 Delta_et -0.1629160E+00 Pxc 0.6546292E+01 Qxc -0.3491164E+01 3,-1 144 3 +1 1.038125 1.435388 -2.196258 Rho 0.2571367E-01 |GRAD(Rho)| 0.5004814E-16 GRAD(Rho)x -0.1940335E-16 GRAD(Rho)y 0.5526486E-17 GRAD(Rho)z 0.4580157E-16 Laplacian 0.9886094E-01 (-1/4)Del**2(Rho)) -0.2471524E-01 Diamond 0.1179694E-01 Metallicity 0.1561452E+01 Ellipticity -0.2437722E+01 Gb(Abramov) 0.2290877E-01 Vb(Abramov) -0.2110230E-01 Hb(Abramov) 0.1806470E-02 Ex_ueg -0.5605365E-02 Ec_ueg -0.1124713E-02 Delta_ex -0.6023099E-02 Delta_ec 0.1370580E-02 Delta_et -0.1224676E-01 Pxc 0.4983817E+01 Qxc -0.4394563E+01 3,+1 145 3 +1 1.071221 -2.196968 1.411142 Rho 0.2606373E-01 |GRAD(Rho)| 0.3519071E-14 GRAD(Rho)x 0.2613100E-14 GRAD(Rho)y -0.7113731E-15 GRAD(Rho)z -0.2247113E-14 Laplacian 0.9996793E-01 (-1/4)Del**2(Rho)) -0.2499198E-01 Diamond 0.1252392E-01 Metallicity 0.1579356E+01 Ellipticity -0.2698221E+01 Gb(Abramov) 0.2323986E-01 Vb(Abramov) -0.2148774E-01 Hb(Abramov) 0.1752120E-02 Ex_ueg -0.5707341E-02 Ec_ueg -0.1142419E-02 Delta_ex -0.6151239E-02 Delta_ec 0.1453737E-02 Delta_et -0.1301239E-01 Pxc 0.4995838E+01 Qxc -0.4231329E+01 3,+1 146 3 -1 0.891586 -2.005198 3.023480 Rho 0.1123278E+00 |GRAD(Rho)| 0.2176796E-15 GRAD(Rho)x -0.1812922E-15 GRAD(Rho)y 0.1167347E-15 GRAD(Rho)z -0.2984266E-16 Laplacian 0.4629009E+00 (-1/4)Del**2(Rho)) -0.1157252E+00 Diamond 0.6826140E+00 Metallicity 0.3892876E+01 Ellipticity 0.1050506E-01 Gb(Abramov) 0.1522341E+00 Vb(Abramov) -0.1887431E+00 Hb(Abramov) -0.3650892E-01 Ex_ueg -0.4002839E-01 Ec_ueg -0.6077695E-02 Delta_ex -0.4665611E-01 Delta_ec 0.1310675E-01 Delta_et -0.1672576E+00 Pxc 0.6586114E+01 Qxc -0.3559701E+01 3,-1 147 3 -1 0.558126 -1.811511 -2.780372 Rho 0.1398293E+00 |GRAD(Rho)| 0.1022750E-12 GRAD(Rho)x 0.9782974E-13 GRAD(Rho)y -0.4420563E-14 GRAD(Rho)z 0.2949527E-13 Laplacian 0.5829593E+00 (-1/4)Del**2(Rho)) -0.1457398E+00 Diamond 0.1082712E+01 Metallicity 0.4452853E+01 Ellipticity 0.1096253E-01 Gb(Abramov) 0.2053196E+00 Vb(Abramov) -0.2648993E+00 Hb(Abramov) -0.5957973E-01 Ex_ueg -0.5360218E-01 Ec_ueg -0.7795654E-02 Delta_ex -0.6150407E-01 Delta_ec 0.1498797E-01 Delta_et -0.1973718E+00 Pxc 0.6875906E+01 Qxc -0.4103561E+01 3,-1 148 3 +1 1.064199 -1.424151 2.194294 Rho 0.2654496E-01 |GRAD(Rho)| 0.6303330E-16 GRAD(Rho)x 0.4912186E-17 GRAD(Rho)y 0.3191689E-16 GRAD(Rho)z -0.5413298E-16 Laplacian 0.1024271E+00 (-1/4)Del**2(Rho)) -0.2560679E-01 Diamond 0.1307476E-01 Metallicity 0.1589162E+01 Ellipticity -0.2652138E+01 Gb(Abramov) 0.2385341E-01 Vb(Abramov) -0.2210004E-01 Hb(Abramov) 0.1753374E-02 Ex_ueg -0.5848275E-02 Ec_ueg -0.1166811E-02 Delta_ex -0.6325617E-02 Delta_ec 0.1474142E-02 Delta_et -0.1325351E-01 Pxc 0.5012188E+01 Qxc -0.4291050E+01 3,+1 149 3 -1 0.592483 2.825769 1.831148 Rho 0.1125893E+00 |GRAD(Rho)| 0.2033105E-15 GRAD(Rho)x -0.1423286E-15 GRAD(Rho)y -0.5476915E-16 GRAD(Rho)z 0.1344546E-15 Laplacian 0.4897568E+00 (-1/4)Del**2(Rho)) -0.1224392E+00 Diamond 0.7279062E+00 Metallicity 0.3693695E+01 Ellipticity 0.1672371E-01 Gb(Abramov) 0.1570017E+00 Vb(Abramov) -0.1915641E+00 Hb(Abramov) -0.3456245E-01 Ex_ueg -0.4015267E-01 Ec_ueg -0.6093782E-02 Delta_ex -0.4944335E-01 Delta_ec 0.1395547E-01 Delta_et -0.1783036E+00 Pxc 0.6589122E+01 Qxc -0.3542936E+01 3,-1 150 3 -1 0.885257 3.022251 -2.008853 Rho 0.1044199E+00 |GRAD(Rho)| 0.2352169E-15 GRAD(Rho)x 0.1415426E-15 GRAD(Rho)y 0.1313918E-15 GRAD(Rho)z 0.1342717E-15 Laplacian 0.4345541E+00 (-1/4)Del**2(Rho)) -0.1086385E+00 Diamond 0.5877708E+00 Metallicity 0.3671764E+01 Ellipticity 0.5640044E-02 Gb(Abramov) 0.1389082E+00 Vb(Abramov) -0.1691778E+00 Hb(Abramov) -0.3026966E-01 Ex_ueg -0.3631584E-01 Ec_ueg -0.5593562E-02 Delta_ex -0.4307496E-01 Delta_ec 0.1253129E-01 Delta_et -0.1576844E+00 Pxc 0.6492434E+01 Qxc -0.3437391E+01 3,-1 151 3 +1 1.773281 1.765026 1.768602 Rho 0.1186827E-01 |GRAD(Rho)| 0.1095773E-13 GRAD(Rho)x -0.7952102E-14 GRAD(Rho)y 0.5957926E-14 GRAD(Rho)z 0.4619426E-14 Laplacian 0.5807464E-01 (-1/4)Del**2(Rho)) -0.1451866E-01 Diamond 0.2243240E-02 Metallicity 0.7327221E+00 Ellipticity -0.1253181E+01 Gb(Abramov) 0.1145213E-01 Vb(Abramov) -0.8385601E-02 Hb(Abramov) 0.3066530E-02 Ex_ueg -0.1999410E-02 Ec_ueg -0.4534915E-03 Delta_ex -0.2831999E-02 Delta_ec 0.7282236E-03 Delta_et -0.5465510E-02 Pxc 0.4408925E+01 Qxc -0.3888914E+01 3,+1 152 3 -1 1.806096 -2.779974 -0.551091 Rho 0.1412085E+00 |GRAD(Rho)| 0.9279077E-14 GRAD(Rho)x 0.6901516E-14 GRAD(Rho)y 0.1298508E-14 GRAD(Rho)z 0.6065000E-14 Laplacian 0.5869396E+00 (-1/4)Del**2(Rho)) -0.1467349E+00 Diamond 0.1104622E+01 Metallicity 0.4495603E+01 Ellipticity 0.1176241E-01 Gb(Abramov) 0.2077669E+00 Vb(Abramov) -0.2687989E+00 Hb(Abramov) -0.6103201E-01 Ex_ueg -0.5430831E-01 Ec_ueg -0.7883130E-02 Delta_ex -0.6208956E-01 Delta_ec 0.1508477E-01 Delta_et -0.1990023E+00 Pxc 0.6889181E+01 Qxc -0.4116043E+01 3,-1 153 3 -1 1.735385 -1.735750 0.545603 Rho 0.4647108E-01 |GRAD(Rho)| 0.1414345E-16 GRAD(Rho)x -0.9778572E-17 GRAD(Rho)y -0.4088205E-17 GRAD(Rho)z -0.9365008E-17 Laplacian 0.1888591E+00 (-1/4)Del**2(Rho)) -0.4721478E-01 Diamond 0.8581820E-01 Metallicity 0.2191694E+01 Ellipticity 0.1351199E-01 Gb(Abramov) 0.4872324E-01 Vb(Abramov) -0.5023171E-01 Hb(Abramov) -0.1508465E-02 Ex_ueg -0.1233944E-01 Ec_ueg -0.2220757E-02 Delta_ex -0.1522186E-01 Delta_ec 0.5558008E-02 Delta_et -0.5747618E-01 Pxc 0.5556411E+01 Qxc -0.2738726E+01 3,-1 154 3 -1 1.734777 -0.530948 1.745570 Rho 0.4667062E-01 |GRAD(Rho)| 0.1343823E-16 GRAD(Rho)x -0.1348053E-17 GRAD(Rho)y 0.4102816E-17 GRAD(Rho)z -0.1272540E-16 Laplacian 0.1896262E+00 (-1/4)Del**2(Rho)) -0.4740655E-01 Diamond 0.8681375E-01 Metallicity 0.2198471E+01 Ellipticity 0.1823118E-01 Gb(Abramov) 0.4897468E-01 Vb(Abramov) -0.5054282E-01 Hb(Abramov) -0.1568137E-02 Ex_ueg -0.1241013E-01 Ec_ueg -0.2231681E-02 Delta_ex -0.1530692E-01 Delta_ec 0.5592514E-02 Delta_et -0.5790102E-01 Pxc 0.5560889E+01 Qxc -0.2737038E+01 3,-1 155 3 -1 1.730971 0.546527 -1.734743 Rho 0.4644497E-01 |GRAD(Rho)| 0.2948264E-14 GRAD(Rho)x 0.1977756E-14 GRAD(Rho)y -0.9746971E-15 GRAD(Rho)z -0.1957219E-14 Laplacian 0.1883070E+00 (-1/4)Del**2(Rho)) -0.4707676E-01 Diamond 0.8550618E-01 Metallicity 0.2196061E+01 Ellipticity 0.1562131E-01 Gb(Abramov) 0.4861508E-01 Vb(Abramov) -0.5015340E-01 Hb(Abramov) -0.1538321E-02 Ex_ueg -0.1233020E-01 Ec_ueg -0.2219328E-02 Delta_ex -0.1517542E-01 Delta_ec 0.5542141E-02 Delta_et -0.5730370E-01 Pxc 0.5555824E+01 Qxc -0.2738188E+01 3,-1 156 3 -1 1.838629 0.565741 2.815240 Rho 0.1596730E+00 |GRAD(Rho)| 0.2089090E-12 GRAD(Rho)x 0.1393793E-12 GRAD(Rho)y -0.1467135E-12 GRAD(Rho)z -0.5188002E-13 Laplacian 0.6573158E+00 (-1/4)Del**2(Rho)) -0.1643290E+00 Diamond 0.1428601E+01 Metallicity 0.4926724E+01 Ellipticity 0.1065110E-01 Gb(Abramov) 0.2444865E+00 Vb(Abramov) -0.3246441E+00 Hb(Abramov) -0.8015759E-01 Ex_ueg -0.6397747E-01 Ec_ueg -0.9065574E-02 Delta_ex -0.7162016E-01 Delta_ec 0.1629931E-01 Delta_et -0.2184952E+00 Pxc 0.7057189E+01 Qxc -0.4394062E+01 3,-1 157 3 -1 2.025593 0.850151 -3.023183 Rho 0.1590837E+00 |GRAD(Rho)| 0.3730627E-15 GRAD(Rho)x -0.3195957E-15 GRAD(Rho)y 0.1168770E-15 GRAD(Rho)z -0.1528861E-15 Laplacian 0.6241499E+00 (-1/4)Del**2(Rho)) -0.1560375E+00 Diamond 0.1350617E+01 Metallicity 0.5156645E+01 Ellipticity 0.3976011E-01 Gb(Abramov) 0.2381300E+00 Vb(Abramov) -0.3202225E+00 Hb(Abramov) -0.8209249E-01 Ex_ueg -0.6366286E-01 Ec_ueg -0.9027517E-02 Delta_ex -0.6794508E-01 Delta_ec 0.1549320E-01 Delta_et -0.2075966E+00 Pxc 0.7052089E+01 Qxc -0.4385476E+01 3,-1 158 3 +1 2.184620 1.305003 -1.146731 Rho 0.2782482E-01 |GRAD(Rho)| 0.9833524E-16 GRAD(Rho)x -0.9541167E-16 GRAD(Rho)y -0.1826295E-16 GRAD(Rho)z 0.1526094E-16 Laplacian 0.1116912E+00 (-1/4)Del**2(Rho)) -0.2792279E-01 Diamond 0.1768835E-01 Metallicity 0.1576335E+01 Ellipticity -0.5380913E+01 Gb(Abramov) 0.2595114E-01 Vb(Abramov) -0.2397948E-01 Hb(Abramov) 0.1971653E-02 Ex_ueg -0.6227231E-02 Ec_ueg -0.1231965E-02 Delta_ex -0.7220321E-02 Delta_ec 0.2023045E-02 Delta_et -0.1830792E-01 Pxc 0.5054714E+01 Qxc -0.3569036E+01 3,+1 159 3 +1 2.928237 0.186267 -0.210043 Rho 0.5886983E-02 |GRAD(Rho)| 0.2940532E-17 GRAD(Rho)x -0.1524885E-17 GRAD(Rho)y -0.6993375E-18 GRAD(Rho)z -0.2415033E-17 Laplacian 0.2454423E-01 (-1/4)Del**2(Rho)) -0.6136059E-02 Diamond 0.6388368E-03 Metallicity 0.5388713E+00 Ellipticity -0.2193185E+01 Gb(Abramov) 0.4641797E-02 Vb(Abramov) -0.3147535E-02 Hb(Abramov) 0.1494262E-02 Ex_ueg -0.7850708E-03 Ec_ueg -0.1852808E-03 Delta_ex -0.1204497E-02 Delta_ec 0.6740243E-03 Delta_et -0.3883304E-02 Pxc 0.4237195E+01 Qxc -0.1787023E+01 3,+1 160 3 -1 1.729759 1.746780 -0.531487 Rho 0.4541872E-01 |GRAD(Rho)| 0.4749383E-16 GRAD(Rho)x 0.4056187E-16 GRAD(Rho)y -0.9033606E-18 GRAD(Rho)z 0.2468974E-16 Laplacian 0.1835630E+00 (-1/4)Del**2(Rho)) -0.4589074E-01 Diamond 0.8079042E-01 Metallicity 0.2170466E+01 Ellipticity 0.2390406E-01 Gb(Abramov) 0.4719454E-01 Vb(Abramov) -0.4849834E-01 Hb(Abramov) -0.1303802E-02 Ex_ueg -0.1196828E-01 Ec_ueg -0.2163248E-02 Delta_ex -0.1470711E-01 Delta_ec 0.5397516E-02 Delta_et -0.5547936E-01 Pxc 0.5532550E+01 Qxc -0.2724793E+01 3,-1 161 3 -1 2.024012 -3.028870 0.849449 Rho 0.1561360E+00 |GRAD(Rho)| 0.6968639E-16 GRAD(Rho)x -0.2616993E-16 GRAD(Rho)y 0.2507218E-17 GRAD(Rho)z 0.6453713E-16 Laplacian 0.6105830E+00 (-1/4)Del**2(Rho)) -0.1526457E+00 Diamond 0.1294240E+01 Metallicity 0.5109444E+01 Ellipticity 0.3376741E-01 Gb(Abramov) 0.2317530E+00 Vb(Abramov) -0.3108602E+00 Hb(Abramov) -0.7910725E-01 Ex_ueg -0.6209490E-01 Ec_ueg -0.8837458E-02 Delta_ex -0.6618286E-01 Delta_ec 0.1526757E-01 Delta_et -0.2041789E+00 Pxc 0.7026330E+01 Qxc -0.4334864E+01 3,-1 162 3 +1 2.925047 -0.216176 0.191572 Rho 0.5885934E-02 |GRAD(Rho)| 0.9991795E-17 GRAD(Rho)x -0.1521100E-18 GRAD(Rho)y -0.6086261E-17 GRAD(Rho)z -0.7922769E-17 Laplacian 0.2456850E-01 (-1/4)Del**2(Rho)) -0.6142125E-02 Diamond 0.6377712E-03 Metallicity 0.5381791E+00 Ellipticity -0.2175974E+01 Gb(Abramov) 0.4645677E-02 Vb(Abramov) -0.3149230E-02 Hb(Abramov) 0.1496448E-02 Ex_ueg -0.7848842E-03 Ec_ueg -0.1852351E-03 Delta_ex -0.1204490E-02 Delta_ec 0.6726318E-03 Delta_et -0.3876012E-02 Pxc 0.4237231E+01 Qxc -0.1790712E+01 3,+1 163 3 -1 2.768591 -1.809072 -0.554963 Rho 0.1380961E+00 |GRAD(Rho)| 0.2764316E-12 GRAD(Rho)x -0.5680074E-13 GRAD(Rho)y -0.2018240E-12 GRAD(Rho)z 0.1801533E-12 Laplacian 0.5810190E+00 (-1/4)Del**2(Rho)) -0.1452547E+00 Diamond 0.1064680E+01 Metallicity 0.4375808E+01 Ellipticity 0.1002128E-01 Gb(Abramov) 0.2027710E+00 Vb(Abramov) -0.2602872E+00 Hb(Abramov) -0.5751624E-01 Ex_ueg -0.5271814E-01 Ec_ueg -0.7685901E-02 Delta_ex -0.6113149E-01 Delta_ec 0.1501571E-01 Delta_et -0.1974311E+00 Pxc 0.6859071E+01 Qxc -0.4071169E+01 3,-1 164 3 -1 2.778847 1.798805 0.551006 Rho 0.1347702E+00 |GRAD(Rho)| 0.4577811E-15 GRAD(Rho)x -0.4722039E-16 GRAD(Rho)y -0.4261186E-15 GRAD(Rho)z 0.1604890E-15 Laplacian 0.5640601E+00 (-1/4)Del**2(Rho)) -0.1410150E+00 Diamond 0.1002027E+01 Metallicity 0.4327901E+01 Ellipticity 0.9198599E-02 Gb(Abramov) 0.1957265E+00 Vb(Abramov) -0.2504380E+00 Hb(Abramov) -0.5471150E-01 Ex_ueg -0.5103209E-01 Ec_ueg -0.7475833E-02 Delta_ex -0.5897691E-01 Delta_ec 0.1462797E-01 Delta_et -0.1915399E+00 Pxc 0.6826275E+01 Qxc -0.4031792E+01 3,-1 165 3 -1 2.036564 3.020597 -0.846478 Rho 0.1615362E+00 |GRAD(Rho)| 0.5502446E-12 GRAD(Rho)x 0.3097219E-12 GRAD(Rho)y -0.2002814E-12 GRAD(Rho)z 0.4083244E-12 Laplacian 0.6277578E+00 (-1/4)Del**2(Rho)) -0.1569395E+00 Diamond 0.1388251E+01 Metallicity 0.5259415E+01 Ellipticity 0.3349126E-01 Gb(Abramov) 0.2421946E+00 Vb(Abramov) -0.3274497E+00 Hb(Abramov) -0.8525513E-01 Ex_ueg -0.6497479E-01 Ec_ueg -0.9186040E-02 Delta_ex -0.6863979E-01 Delta_ec 0.1559698E-01 Delta_et -0.2095816E+00 Pxc 0.7073209E+01 Qxc -0.4400840E+01 3,-1 166 3 -1 1.843627 2.819571 0.574709 Rho 0.1586730E+00 |GRAD(Rho)| 0.1455230E-15 GRAD(Rho)x -0.1370432E-15 GRAD(Rho)y -0.9981436E-17 GRAD(Rho)z 0.4792174E-16 Laplacian 0.6535756E+00 (-1/4)Del**2(Rho)) -0.1633939E+00 Diamond 0.1410485E+01 Metallicity 0.4903307E+01 Ellipticity 0.1093533E-01 Gb(Abramov) 0.2424577E+00 Vb(Abramov) -0.3215214E+00 Hb(Abramov) -0.7906378E-01 Ex_ueg -0.6344379E-01 Ec_ueg -0.9001003E-02 Delta_ex -0.7110809E-01 Delta_ec 0.1624380E-01 Delta_et -0.2176065E+00 Pxc 0.7048524E+01 Qxc -0.4377554E+01 3,-1 167 3 -1 2.769333 -0.553679 -1.805580 Rho 0.1370329E+00 |GRAD(Rho)| 0.7349342E-13 GRAD(Rho)x -0.2120482E-13 GRAD(Rho)y -0.7015527E-13 GRAD(Rho)z -0.5466032E-14 Laplacian 0.5766319E+00 (-1/4)Del**2(Rho)) -0.1441580E+00 Diamond 0.1046093E+01 Metallicity 0.4352673E+01 Ellipticity 0.8581359E-02 Gb(Abramov) 0.2006841E+00 Vb(Abramov) -0.2572102E+00 Hb(Abramov) -0.5652609E-01 Ex_ueg -0.5217770E-01 Ec_ueg -0.7618675E-02 Delta_ex -0.6054725E-01 Delta_ec 0.1491459E-01 Delta_et -0.1958379E+00 Pxc 0.6848659E+01 Qxc -0.4059600E+01 3,-1 168 3 -1 3.007055 -0.852331 1.986844 Rho 0.1265948E+00 |GRAD(Rho)| 0.1994326E-15 GRAD(Rho)x 0.1299687E-15 GRAD(Rho)y -0.1497148E-15 GRAD(Rho)z 0.2160950E-16 Laplacian 0.4976667E+00 (-1/4)Del**2(Rho)) -0.1244167E+00 Diamond 0.8231943E+00 Metallicity 0.4419447E+01 Ellipticity 0.2883190E-01 Gb(Abramov) 0.1745866E+00 Vb(Abramov) -0.2247565E+00 Hb(Abramov) -0.5016993E-01 Ex_ueg -0.4694685E-01 Ec_ueg -0.6962545E-02 Delta_ex -0.5129392E-01 Delta_ec 0.1317141E-01 Delta_et -0.1708686E+00 Pxc 0.6742771E+01 Qxc -0.3894339E+01 3,-1 169 3 -1 3.221972 -3.201128 -0.083572 Rho 0.2393646E+00 |GRAD(Rho)| 0.1164200E-13 GRAD(Rho)x 0.3240680E-15 GRAD(Rho)y -0.1016526E-13 GRAD(Rho)z 0.5665553E-14 Laplacian 0.8769120E+00 (-1/4)Del**2(Rho)) -0.2192280E+00 Diamond 0.3085070E+01 Metallicity 0.7251432E+01 Ellipticity 0.1879830E-02 Gb(Abramov) 0.4111048E+00 Vb(Abramov) -0.6029817E+00 Hb(Abramov) -0.1918768E+00 Ex_ueg -0.1097653E+00 Ec_ueg -0.1439520E-01 Delta_ex -0.1058411E+00 Delta_ec 0.1932555E-01 Delta_et -0.2673979E+00 Pxc 0.7625130E+01 Qxc -0.5476744E+01 3,-1 170 3 -1 3.008829 1.983994 -0.847333 Rho 0.1245959E+00 |GRAD(Rho)| 0.1699892E-15 GRAD(Rho)x -0.4950061E-16 GRAD(Rho)y 0.9530137E-16 GRAD(Rho)z -0.1317712E-15 Laplacian 0.4899589E+00 (-1/4)Del**2(Rho)) -0.1224897E+00 Diamond 0.7953306E+00 Metallicity 0.4371457E+01 Ellipticity 0.2727821E-01 Gb(Abramov) 0.1709029E+00 Vb(Abramov) -0.2193161E+00 Hb(Abramov) -0.4841319E-01 Ex_ueg -0.4596105E-01 Ec_ueg -0.6837717E-02 Delta_ex -0.5031013E-01 Delta_ec 0.1302182E-01 Delta_et -0.1684873E+00 Pxc 0.6721694E+01 Qxc -0.3863524E+01 3,-1 171 3 -1 3.010832 -1.996738 0.848082 Rho 0.1458124E+00 |GRAD(Rho)| 0.1005443E-15 GRAD(Rho)x -0.6680041E-16 GRAD(Rho)y -0.7251957E-16 GRAD(Rho)z -0.1969182E-16 Laplacian 0.5690973E+00 (-1/4)Del**2(Rho)) -0.1422743E+00 Diamond 0.1115911E+01 Metallicity 0.4891224E+01 Ellipticity 0.4271021E-01 Gb(Abramov) 0.2108321E+00 Vb(Abramov) -0.2793899E+00 Hb(Abramov) -0.6855781E-01 Ex_ueg -0.5668190E-01 Ec_ueg -0.8175990E-02 Delta_ex -0.6070497E-01 Delta_ec 0.1456292E-01 Delta_et -0.1931348E+00 Pxc 0.6932727E+01 Qxc -0.4168462E+01 3,-1 172 3 -1 3.247087 3.192568 0.073745 Rho 0.2389613E+00 |GRAD(Rho)| 0.3212452E-15 GRAD(Rho)x 0.2336456E-15 GRAD(Rho)y -0.2117447E-15 GRAD(Rho)z -0.6142005E-16 Laplacian 0.8737824E+00 (-1/4)Del**2(Rho)) -0.2184456E+00 Diamond 0.3068989E+01 Metallicity 0.7256977E+01 Ellipticity 0.2556321E-02 Gb(Abramov) 0.4098395E+00 Vb(Abramov) -0.6012334E+00 Hb(Abramov) -0.1913939E+00 Ex_ueg -0.1095187E+00 Ec_ueg -0.1436734E-01 Delta_ex -0.1054231E+00 Delta_ec 0.1927733E-01 Delta_et -0.2667647E+00 Pxc 0.7622757E+01 Qxc -0.5468762E+01 3,-1 173 3 -1 3.223838 -0.078388 -3.196134 Rho 0.2398228E+00 |GRAD(Rho)| 0.5600200E-14 GRAD(Rho)x -0.4090153E-14 GRAD(Rho)y 0.1075474E-14 GRAD(Rho)z 0.3671000E-14 Laplacian 0.8789416E+00 (-1/4)Del**2(Rho)) -0.2197354E+00 Diamond 0.3099422E+01 Metallicity 0.7257782E+01 Ellipticity 0.2870648E-02 Gb(Abramov) 0.4122889E+00 Vb(Abramov) -0.6048424E+00 Hb(Abramov) -0.1925535E+00 Ex_ueg -0.1100455E+00 Ec_ueg -0.1442687E-01 Delta_ex -0.1061395E+00 Delta_ec 0.1936011E-01 Delta_et -0.2678967E+00 Pxc 0.7627819E+01 Qxc -0.5482382E+01 3,-1 174 3 -1 2.923798 -0.014889 -0.010366 Rho 0.5971808E-02 |GRAD(Rho)| 0.4411433E-17 GRAD(Rho)x -0.1529910E-17 GRAD(Rho)y -0.4127843E-17 GRAD(Rho)z -0.2846552E-18 Laplacian 0.2389015E-01 (-1/4)Del**2(Rho)) -0.5972538E-02 Diamond 0.8185112E-03 Metallicity 0.5669837E+00 Ellipticity 0.1809160E+01 Gb(Abramov) 0.4546081E-02 Vb(Abramov) -0.3119623E-02 Hb(Abramov) 0.1426457E-02 Ex_ueg -0.8001895E-03 Ec_ueg -0.1889704E-03 Delta_ex -0.1311141E-02 Delta_ec 0.8975683E-03 Delta_et -0.5083764E-02 Pxc 0.4234469E+01 Qxc -0.1460771E+01 3,-1 175 3 -1 -1.840874 2.837963 -0.568714 Rho 0.1546264E+00 |GRAD(Rho)| 0.2052839E-15 GRAD(Rho)x 0.5277354E-16 GRAD(Rho)y 0.1774839E-15 GRAD(Rho)z -0.8863353E-16 Laplacian 0.6340596E+00 (-1/4)Del**2(Rho)) -0.1585149E+00 Diamond 0.1325907E+01 Metallicity 0.4841231E+01 Ellipticity 0.1112354E-01 Gb(Abramov) 0.2335778E+00 Vb(Abramov) -0.3086407E+00 Hb(Abramov) -0.7506290E-01 Ex_ueg -0.6129568E-01 Ec_ueg -0.8740324E-02 Delta_ex -0.6853875E-01 Delta_ec 0.1585064E-01 Delta_et -0.2116016E+00 Pxc 0.7012976E+01 Qxc -0.4324037E+01 3,-1 176 3 -1 -2.030025 3.026549 0.845023 Rho 0.1441030E+00 |GRAD(Rho)| 0.2615047E-15 GRAD(Rho)x 0.1496741E-15 GRAD(Rho)y 0.1004784E-15 GRAD(Rho)z -0.1894372E-15 Laplacian 0.5657865E+00 (-1/4)Del**2(Rho)) -0.1414466E+00 Diamond 0.1090500E+01 Metallicity 0.4824094E+01 Ellipticity 0.2072061E-01 Gb(Abramov) 0.2080230E+00 Vb(Abramov) -0.2745995E+00 Hb(Abramov) -0.6657642E-01 Ex_ueg -0.5579764E-01 Ec_ueg -0.8067097E-02 Delta_ex -0.6014313E-01 Delta_ec 0.1445804E-01 Delta_et -0.1912806E+00 Pxc 0.6916694E+01 Qxc -0.4159840E+01 3,-1 177 3 -1 0.024172 -0.018407 2.950910 Rho 0.4921179E-02 |GRAD(Rho)| 0.2070356E-16 GRAD(Rho)x 0.1571417E-16 GRAD(Rho)y 0.1347039E-16 GRAD(Rho)z 0.5010178E-18 Laplacian 0.1917922E-01 (-1/4)Del**2(Rho)) -0.4794806E-02 Diamond 0.4819980E-03 Metallicity 0.5115610E+00 Ellipticity 0.1021377E+02 Gb(Abramov) 0.3605343E-02 Vb(Abramov) -0.2415881E-02 Hb(Abramov) 0.1189463E-02 Ex_ueg -0.6182213E-03 Ec_ueg -0.1435224E-03 Delta_ex -0.9925674E-03 Delta_ec 0.6787671E-03 Delta_et -0.3638419E-02 Pxc 0.4307490E+01 Qxc -0.1462309E+01 3,-1 178 3 -1 0.883600 -3.036304 1.993023 Rho 0.1125512E+00 |GRAD(Rho)| 0.6256634E-15 GRAD(Rho)x -0.4328948E-15 GRAD(Rho)y 0.4514821E-15 GRAD(Rho)z -0.1485357E-16 Laplacian 0.4632452E+00 (-1/4)Del**2(Rho)) -0.1158113E+00 Diamond 0.6859573E+00 Metallicity 0.3902883E+01 Ellipticity 0.7724269E-02 Gb(Abramov) 0.1525405E+00 Vb(Abramov) -0.1892697E+00 Hb(Abramov) -0.3672922E-01 Ex_ueg -0.4013454E-01 Ec_ueg -0.6091435E-02 Delta_ex -0.4673007E-01 Delta_ec 0.1314195E-01 Delta_et -0.1678149E+00 Pxc 0.6588684E+01 Qxc -0.3555794E+01 3,-1 179 3 -1 2.032602 -0.851501 3.022113 Rho 0.1548340E+00 |GRAD(Rho)| 0.5595541E-09 GRAD(Rho)x -0.2871670E-09 GRAD(Rho)y -0.4118268E-09 GRAD(Rho)z 0.2470518E-09 Laplacian 0.6021504E+00 (-1/4)Del**2(Rho)) -0.1505376E+00 Diamond 0.1266082E+01 Metallicity 0.5109191E+01 Ellipticity 0.3010813E-01 Gb(Abramov) 0.2285460E+00 Vb(Abramov) -0.3065543E+00 Hb(Abramov) -0.7800836E-01 Ex_ueg -0.6140545E-01 Ec_ueg -0.8753675E-02 Delta_ex -0.6515762E-01 Delta_ec 0.1513090E-01 Delta_et -0.2022310E+00 Pxc 0.7014819E+01 Qxc -0.4306262E+01 3,-1 180 3 -1 2.779321 0.548091 1.798997 Rho 0.1379151E+00 |GRAD(Rho)| 0.2343469E-15 GRAD(Rho)x -0.3992575E-16 GRAD(Rho)y 0.1727134E-15 GRAD(Rho)z -0.1532791E-15 Laplacian 0.5757369E+00 (-1/4)Del**2(Rho)) -0.1439342E+00 Diamond 0.1051545E+01 Metallicity 0.4406313E+01 Ellipticity 0.9819114E-02 Gb(Abramov) 0.2016594E+00 Vb(Abramov) -0.2593845E+00 Hb(Abramov) -0.5772513E-01 Ex_ueg -0.5262604E-01 Ec_ueg -0.7674451E-02 Delta_ex -0.6053643E-01 Delta_ec 0.1484823E-01 Delta_et -0.1951171E+00 Pxc 0.6857303E+01 Qxc -0.4077012E+01 3,-1 181 3 -1 3.014735 0.846326 -1.990504 Rho 0.1490233E+00 |GRAD(Rho)| 0.8670807E-12 GRAD(Rho)x -0.3136039E-12 GRAD(Rho)y -0.6363321E-12 GRAD(Rho)z -0.4985609E-12 Laplacian 0.5809573E+00 (-1/4)Del**2(Rho)) -0.1452393E+00 Diamond 0.1170023E+01 Metallicity 0.4968505E+01 Ellipticity 0.4484393E-01 Gb(Abramov) 0.2170966E+00 Vb(Abramov) -0.2889539E+00 Hb(Abramov) -0.7185728E-01 Ex_ueg -0.5835219E-01 Ec_ueg -0.8381018E-02 Delta_ex -0.6230851E-01 Delta_ec 0.1479850E-01 Delta_et -0.1968961E+00 Pxc 0.6962422E+01 Qxc -0.4210461E+01 3,-1 182 3 -1 3.243645 0.072103 3.192963 Rho 0.2388346E+00 |GRAD(Rho)| 0.2266840E-10 GRAD(Rho)x 0.1656080E-10 GRAD(Rho)y 0.4182087E-11 GRAD(Rho)z 0.1490324E-10 Laplacian 0.8747905E+00 (-1/4)Del**2(Rho)) -0.2186976E+00 Diamond 0.3069232E+01 Metallicity 0.7242210E+01 Ellipticity 0.1709459E-02 Gb(Abramov) 0.4097741E+00 Vb(Abramov) -0.6008505E+00 Hb(Abramov) -0.1910765E+00 Ex_ueg -0.1094413E+00 Ec_ueg -0.1435859E-01 Delta_ex -0.1055230E+00 Delta_ec 0.1928981E-01 Delta_et -0.2668763E+00 Pxc 0.7622011E+01 Qxc -0.5470399E+01 3,-1 183 3 -1 -3.019828 -2.026065 -0.844356 Rho 0.1564982E+00 |GRAD(Rho)| 0.3231285E-13 GRAD(Rho)x -0.2824339E-13 GRAD(Rho)y -0.1473130E-13 GRAD(Rho)z 0.5424020E-14 Laplacian 0.6173921E+00 (-1/4)Del**2(Rho)) -0.1543480E+00 Diamond 0.1310006E+01 Metallicity 0.5072645E+01 Ellipticity 0.3309938E-01 Gb(Abramov) 0.2333908E+00 Vb(Abramov) -0.3124336E+00 Hb(Abramov) -0.7904278E-01 Ex_ueg -0.6228703E-01 Ec_ueg -0.8860783E-02 Delta_ex -0.6693751E-01 Delta_ec 0.1538994E-01 Delta_et -0.2057818E+00 Pxc 0.7029517E+01 Qxc -0.4349434E+01 3,-1 184 3 -1 -3.246270 3.228142 -0.063384 Rho 0.2385492E+00 |GRAD(Rho)| 0.1722712E-15 GRAD(Rho)x -0.4803016E-16 GRAD(Rho)y -0.1652866E-15 GRAD(Rho)z 0.7128629E-17 Laplacian 0.8682315E+00 (-1/4)Del**2(Rho)) -0.2170579E+00 Diamond 0.3047218E+01 Metallicity 0.7282392E+01 Ellipticity 0.2279982E-02 Gb(Abramov) 0.4081554E+00 Vb(Abramov) -0.5992529E+00 Hb(Abramov) -0.1910975E+00 Ex_ueg -0.1092670E+00 Ec_ueg -0.1433888E-01 Delta_ex -0.1047280E+00 Delta_ec 0.1920350E-01 Delta_et -0.2658978E+00 Pxc 0.7620329E+01 Qxc -0.5453587E+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 81 126 111 117 146 178 138 101 147 104 106 114 137 141 122 125 143 150 132 123 142 149 124 109 131 153 163 152 171 161 169 160 164 166 170 165 172 89 79 175 81 176 184 69 82 58 183 87 72 93 75 95 83 91 64 97 68 94 76 98 67 154 180 156 168 179 182 155 167 128 181 157 173 134 133 135 120 66 174 121 177 116 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 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 28 2.420660 2.004597 1.990282 2.032536 2.031522 1.782675 2.380319 1.941005 1.961239 1.898972 1.945498 1.743446 2.438980 1.953939 2.012383 2.044260 2.060925 1.783558 2.429537 2.025630 2.019405 2.022100 1.997392 1.780999 2.396879 1.945821 1.937748 1.936313 1.909529 1.744476 2.406541 1.956030 1.893468 1.998091 1.896707 1.745198 2.431318 1.910663 1.904116 1.983081 1.941310 1.745957 2.413639 1.929441 1.919471 1.908685 1.978500 1.745235 2.452409 2.002384 1.963146 2.044017 2.047686 1.784293 2.409898 1.971586 1.908038 1.948654 1.913846 1.744431 2.394392 1.947101 1.891309 1.992193 1.913349 1.745374 2.397429 1.948901 1.958482 1.927405 1.901707 1.743720 1.702995 1.700672 1.701824 1.699675 3.294953 3.214236 3.346746 3.343918 3.265864 2.422870 2.004863 1.990552 2.032865 2.031848 1.782677 2.382162 1.941456 1.961671 1.899463 1.946117 1.743455 2.441015 1.954131 2.012664 2.044579 2.061258 1.783563 2.431592 2.025834 2.019675 2.022437 1.997780 1.781003 2.398608 1.946236 1.938177 1.936906 1.910039 1.744484 2.408343 1.956443 1.893765 1.998715 1.897178 1.745208 2.432844 1.910995 1.904429 1.983672 1.941873 1.745965 2.415261 1.929868 1.919821 1.909212 1.979088 1.745244 2.454389 2.002652 1.963331 2.044332 2.048002 1.784298 2.411773 1.971999 1.908384 1.949289 1.914344 1.744439 2.396131 1.947518 1.891601 1.992804 1.913864 1.745383 2.399225 1.949331 1.958908 1.927990 1.902215 1.743728 1.702999 1.700679 1.701827 1.699679 3.300868 3.218277 3.353697 3.351671 3.271254 27 28 27 25 27 21 30 25 27 28 27 22 27 26 26 25 27 22 27 25 24 25 27 22 27 25 25 28 24 23 27 26 26 27 25 24 28 27 27 26 29 24 30 27 27 28 28 22 32 26 29 28 28 25 30 27 28 27 29 24 27 29 26 27 28 25 27 25 25 28 25 23 22 22 20 25 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 Ta W Ta Ta W W W W Ta 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 O As 2.2579 2.4672 2.2481 2.2556 2.4691 2.4641 2.4571 2.4628 2.2486 2.4602 2.4654 2.4669 -1.1284 -1.1239 -1.1240 -1.1195 -0.9690 -0.9663 -0.9845 -0.9695 -0.9667 -0.9753 -1.0127 -0.9805 -0.9837 -0.9827 -0.9771 -0.9661 -0.9795 -0.9951 -0.9775 -0.9841 -0.9937 -0.9868 -0.9908 -0.9854 -0.9771 -1.0022 -0.9896 -0.9897 -0.9148 -0.8092 -0.9188 -0.9102 -0.8142 -0.8179 -0.8231 -0.8186 -0.9217 -0.8154 -0.8182 -0.8111 2.5518 2.0965 2.0949 2.1018 2.0975 2.0922 2.0974 2.1019 2.0969 2.1004 2.0987 2.0971 2.0939 1.9358 1.9370 1.9367 1.9375 1.9299 1.9304 1.9287 1.9302 1.9301 1.9303 1.9249 1.9291 1.9290 1.9289 1.9300 1.9304 1.9402 1.9387 1.9402 1.9393 1.9389 1.9393 1.9383 1.9396 1.9399 1.9369 1.9391 1.9397 1.9455 1.9628 1.9453 1.9461 1.9620 1.9623 1.9619 1.9619 1.9449 1.9625 1.9621 1.9625 0.8186 6.0664 6.0904 6.0714 6.0683 6.0895 6.0928 6.0982 6.0942 6.0711 6.0947 6.0923 6.0905 5.1542 5.1485 5.1491 5.1439 5.0102 5.0068 5.0285 5.0107 5.0077 5.0174 5.0627 5.0241 5.0274 5.0266 5.0193 5.0068 5.0089 5.0279 5.0066 5.0149 5.0259 5.0183 5.0231 5.0165 5.0066 5.0369 5.0213 5.0211 4.9413 4.8119 4.9457 4.9359 4.8178 4.8214 4.8271 4.8224 4.9491 4.8186 4.8219 4.8140 1.0888 2.5451 3.3181 2.5448 2.5447 3.3197 3.3164 3.3135 3.3167 2.5459 3.3171 3.3157 3.3193 0.0384 0.0384 0.0382 0.0381 0.0289 0.0291 0.0272 0.0286 0.0289 0.0276 0.0250 0.0273 0.0273 0.0271 0.0277 0.0289 0.0304 0.0285 0.0307 0.0299 0.0289 0.0292 0.0293 0.0293 0.0307 0.0284 0.0292 0.0289 0.0279 0.0346 0.0278 0.0282 0.0344 0.0343 0.0341 0.0343 0.0277 0.0344 0.0342 0.0345 10.5408 14.0341 14.0293 14.0339 14.0339 14.0295 14.0294 14.0293 14.0294 14.0340 14.0293 14.0294 14.0294 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 Ta W Ta Ta W W W W Ta 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 O As 2.369977 2.509086 2.366644 2.371422 2.507599 2.504608 2.503419 2.505406 2.366022 2.506291 2.505335 2.508065 -1.097821 -1.097107 -1.097698 -1.097755 -0.979977 -0.976127 -1.001324 -0.981986 -0.976475 -0.991010 -1.033513 -0.996361 -1.000736 -0.998750 -0.990810 -0.976886 -0.966579 -0.987782 -0.964481 -0.970997 -0.984720 -0.979476 -0.982934 -0.978061 -0.964478 -0.993311 -0.981971 -0.982103 -0.989547 -0.848440 -0.994534 -0.983523 -0.854351 -0.858125 -0.864248 -0.859414 -0.998088 -0.855288 -0.858671 -0.850530 2.322115 1.850037 1.935231 1.849484 1.855112 1.931035 1.934324 1.933703 1.933013 1.846798 1.935860 1.933258 1.933510 -0.737343 -0.737151 -0.738228 -0.737848 -0.734162 -0.723440 -0.764196 -0.726437 -0.730576 -0.762667 -0.795504 -0.762539 -0.769063 -0.760176 -0.762779 -0.729409 -0.803164 -0.830679 -0.801272 -0.801310 -0.828687 -0.826369 -0.825668 -0.825861 -0.798781 -0.830093 -0.828383 -0.826770 -0.916215 -0.756290 -0.923478 -0.909862 -0.762506 -0.765779 -0.774826 -0.768461 -0.927966 -0.764056 -0.766750 -0.758280 1.721661 1.962833 2.043442 1.964113 1.968329 2.037657 2.041499 2.045365 2.042334 1.961218 2.045180 2.041236 2.040432 -0.802893 -0.805316 -0.805528 -0.809079 -0.817215 -0.807158 -0.845745 -0.810518 -0.814223 -0.840914 -0.884904 -0.843635 -0.848755 -0.842029 -0.842115 -0.811518 -0.837078 -0.861752 -0.833327 -0.838171 -0.858814 -0.853227 -0.854076 -0.851413 -0.831596 -0.866231 -0.856903 -0.854737 -0.893108 -0.722113 -0.898895 -0.885364 -0.729589 -0.732316 -0.738972 -0.734249 -0.903998 -0.729302 -0.732931 -0.725020 1.661086 4.29189622 -3.87621863 0.33555821 5.79293046 17.87153213 0.72972812 -16.61789894 -3.51499505 17.05340757 -14.35653709 -396.2948 429.2806 -30.4347 -424.2834 -57.3163 -479.0486 Jun19-2024 22:50:05 Nodes: 1 Procs: 1 Jun19-2024 22:50:09 Nodes: 1 Procs: 1 0 Jun19-2024 22:50:14 Nodes: 1 Procs: 1 Jun19-2024 22:50:16 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun19-2024 22:50:20 Nodes: 1 Procs: 1 Jun19-2024 22:50:22 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun19-2024 22:50:24 Nodes: 1 Procs: 1 Jun19-2024 22:50:27 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Jun19-2024 22:50:32 Nodes: 1 Procs: 5 *** (NO TITLE) *** -7 -17.44718357 -17.58417949 -17.59522009 -17.59998587 -17.60124788 -17.60267277 -17.60331178 -17.60403878 -17.60435710 -17.60451629 -17.60459845 -17.60463905 -17.60467604 -17.60469511 -17.60471385 GEOMETRY CONVERGED