ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:04:55 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.50 0.06 2.83 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 22:04:55 Nodes: 1 Procs: 1 Jun19-2024 22:04:58 Nodes: 1 Procs: 1 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:05:01 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.71 0.07 3.41 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 22:04:55 Nodes: 1 Procs: 1 Jun19-2024 22:04:58 Nodes: 1 Procs: 1 0 Jun19-2024 22:05:01 Nodes: 1 Procs: 1 Jun19-2024 22:05:04 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:05:09 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.99 0.06 1.55 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 22:04:55 Nodes: 1 Procs: 1 Jun19-2024 22:04:58 Nodes: 1 Procs: 1 0 Jun19-2024 22:05:01 Nodes: 1 Procs: 1 Jun19-2024 22:05:04 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun19-2024 22:05:09 Nodes: 1 Procs: 1 Jun19-2024 22:05:10 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:05:13 Arsenic (TZP, 3p frozen) c1-23 c1-23 c1-23 c1-23 c1-23 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.69 0.08 3.42 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 22:04:55 Nodes: 1 Procs: 1 Jun19-2024 22:04:58 Nodes: 1 Procs: 1 0 Jun19-2024 22:05:01 Nodes: 1 Procs: 1 Jun19-2024 22:05:04 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun19-2024 22:05:09 Nodes: 1 Procs: 1 Jun19-2024 22:05:10 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun19-2024 22:05:13 Nodes: 1 Procs: 1 Jun19-2024 22:05:16 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:05:21 Arsenic (TZP, 3p frozen) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP 2709.5698000000057 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-3.496252 2.254095 -0.073913 Rho 0.3188992E+03 3,-3 33 3 -3 1.564491 1.431752 3.494246 Rho 0.3188796E+03 3,-3 34 3 -3 1.511232 -1.312541 -3.567941 Rho 0.3188911E+03 3,-3 35 3 -3 -1.545650 3.585603 1.369765 Rho 0.3188496E+03 3,-3 36 3 -3 -1.922533 -3.655540 -1.739884 Rho 0.3191884E+03 3,-3 37 3 -3 -1.946402 -3.630290 1.635034 Rho 0.3191679E+03 3,-3 38 3 -3 -1.544160 3.523395 -1.431856 Rho 0.3188783E+03 3,-3 39 3 -3 1.646605 -1.322239 3.516478 Rho 0.3188633E+03 3,-3 40 3 -3 1.505038 1.377066 -3.495948 Rho 0.3188894E+03 3,-3 41 3 -3 -0.151443 -0.055953 5.401809 Rho 0.3190608E+03 3,-3 42 3 -3 4.096278 -2.626965 -2.594964 Rho 0.3190052E+03 3,-3 43 3 -3 -0.255489 0.031205 -5.284474 Rho 0.3191808E+03 3,-3 44 3 -3 0.246318 5.419843 -0.050340 Rho 0.3190435E+03 3,-3 45 3 -3 4.071136 -2.610313 2.574659 Rho 0.3191224E+03 3,-3 46 3 -3 3.760242 2.919553 -2.549873 Rho 0.3191605E+03 3,-3 47 3 -3 -3.771410 2.490825 -2.894139 Rho 0.3191507E+03 3,-3 48 3 -3 -3.994144 -2.263995 2.826445 Rho 0.3191275E+03 3,-3 49 3 -3 -3.941634 -2.183499 -2.832420 Rho 0.3191424E+03 3,-3 50 3 -3 -3.902677 2.526198 2.841961 Rho 0.3190329E+03 3,-3 51 3 -3 3.806212 2.894378 2.528458 Rho 0.3191676E+03 3,-3 52 3 +1 -0.634002 -0.862122 1.557915 Rho 0.8513362E-02 |GRAD(Rho)| 0.1375704E-15 GRAD(Rho)x 0.7095548E-16 GRAD(Rho)y -0.1132778E-15 GRAD(Rho)z -0.3254342E-16 Laplacian 0.3215523E-01 (-1/4)Del**2(Rho)) -0.8038807E-02 Diamond 0.8544843E-03 Metallicity 0.7606708E+00 Ellipticity -0.1486948E+01 Gb(Abramov) 0.6378352E-02 Vb(Abramov) -0.4717898E-02 Hb(Abramov) 0.1660455E-02 Ex_ueg -0.1283866E-02 Ec_ueg -0.3011054E-03 Delta_ex -0.1467849E-02 Delta_ec 0.4571742E-03 Delta_et -0.3112810E-02 Pxc 0.4263844E+01 Qxc -0.3210699E+01 3,+1 53 3 +1 2.096538 0.037183 2.897587 Rho 0.1155703E-01 |GRAD(Rho)| 0.1837455E-13 GRAD(Rho)x 0.1560833E-13 GRAD(Rho)y -0.5291876E-14 GRAD(Rho)z -0.8124052E-14 Laplacian 0.5214290E-01 (-1/4)Del**2(Rho)) -0.1303572E-01 Diamond 0.1645521E-02 Metallicity 0.7807198E+00 Ellipticity -0.1177170E+01 Gb(Abramov) 0.1038669E-01 Vb(Abramov) -0.7737657E-02 Hb(Abramov) 0.2649033E-02 Ex_ueg -0.1929805E-02 Ec_ueg -0.4391588E-03 Delta_ex -0.2434834E-02 Delta_ec 0.4930005E-03 Delta_et -0.3806794E-02 Pxc 0.4394322E+01 Qxc -0.4938806E+01 3,+1 54 3 -1 -1.806730 -1.685047 0.857624 Rho 0.4808161E-01 |GRAD(Rho)| 0.1283685E-12 GRAD(Rho)x 0.1091229E-12 GRAD(Rho)y 0.2983446E-13 GRAD(Rho)z 0.6066767E-13 Laplacian 0.1879373E+00 (-1/4)Del**2(Rho)) -0.4698432E-01 Diamond 0.9126937E-01 Metallicity 0.2331124E+01 Ellipticity 0.1192883E-01 Gb(Abramov) 0.4957726E-01 Vb(Abramov) -0.5217019E-01 Hb(Abramov) -0.2592936E-02 Ex_ueg -0.1291290E-01 Ec_ueg -0.2309110E-02 Delta_ex -0.1536055E-01 Delta_ec 0.5677098E-02 Delta_et -0.5927265E-01 Pxc 0.5592154E+01 Qxc -0.2705704E+01 3,-1 55 3 +1 -1.681897 -0.024283 -0.758291 Rho 0.9674183E-02 |GRAD(Rho)| 0.1035352E-14 GRAD(Rho)x 0.4338630E-15 GRAD(Rho)y 0.8950809E-15 GRAD(Rho)z 0.2873084E-15 Laplacian 0.3685915E-01 (-1/4)Del**2(Rho)) -0.9214787E-02 Diamond 0.1211091E-02 Metallicity 0.8211548E+00 Ellipticity -0.1594052E+01 Gb(Abramov) 0.7404319E-02 Vb(Abramov) -0.5593851E-02 Hb(Abramov) 0.1810468E-02 Ex_ueg -0.1522430E-02 Ec_ueg -0.3532947E-03 Delta_ex -0.1755449E-02 Delta_ec 0.5550523E-03 Delta_et -0.3881451E-02 Pxc 0.4309236E+01 Qxc -0.3162673E+01 3,+1 56 3 -1 -1.791726 -1.699799 -0.844952 Rho 0.5623656E-01 |GRAD(Rho)| 0.1815719E-12 GRAD(Rho)x 0.5194235E-13 GRAD(Rho)y 0.1492354E-12 GRAD(Rho)z -0.8943783E-13 Laplacian 0.2225621E+00 (-1/4)Del**2(Rho)) -0.5564054E-01 Diamond 0.1337986E+00 Metallicity 0.2555798E+01 Ellipticity 0.1975792E-01 Gb(Abramov) 0.6079468E-01 Vb(Abramov) -0.6594883E-01 Hb(Abramov) -0.5154146E-02 Ex_ueg -0.1591268E-01 Ec_ueg -0.2762401E-02 Delta_ex -0.1892490E-01 Delta_ec 0.6719406E-02 Delta_et -0.7307843E-01 Pxc 0.5760453E+01 Qxc -0.2816454E+01 3,-1 57 3 +1 1.697194 0.755297 0.011716 Rho 0.6331347E-02 |GRAD(Rho)| 0.9419394E-11 GRAD(Rho)x 0.6599455E-11 GRAD(Rho)y 0.6442007E-11 GRAD(Rho)z -0.1916438E-11 Laplacian 0.2413448E-01 (-1/4)Del**2(Rho)) -0.6033621E-02 Diamond 0.4442613E-03 Metallicity 0.6186837E+00 Ellipticity -0.1395522E+01 Gb(Abramov) 0.4644564E-02 Vb(Abramov) -0.3255508E-02 Hb(Abramov) 0.1389056E-02 Ex_ueg -0.8650606E-03 Ec_ueg -0.2046485E-03 Delta_ex -0.1033910E-02 Delta_ec 0.3618826E-03 Delta_et -0.2264917E-02 Pxc 0.4227057E+01 Qxc -0.2857032E+01 3,+1 58 3 -1 -0.187505 -3.440926 1.652144 Rho 0.2942283E-02 |GRAD(Rho)| 0.5205755E-17 GRAD(Rho)x 0.3296592E-17 GRAD(Rho)y -0.6670900E-18 GRAD(Rho)z 0.3973331E-17 Laplacian 0.1013227E-01 (-1/4)Del**2(Rho)) -0.2533068E-02 Diamond 0.1864172E-03 Metallicity 0.4108788E+00 Ellipticity 0.1264482E+00 Gb(Abramov) 0.1862176E-02 Vb(Abramov) -0.1191284E-02 Hb(Abramov) 0.6708920E-03 Ex_ueg -0.3113850E-03 Ec_ueg -0.5946488E-04 Delta_ex -0.5893215E-03 Delta_ec 0.5558987E-03 Delta_et -0.2473986E-02 Pxc 0.5236452E+01 Qxc -0.1060124E+01 3,-1 59 3 +1 -2.929642 0.408297 -0.014383 Rho 0.6517158E-02 |GRAD(Rho)| 0.7135786E-15 GRAD(Rho)x -0.5979847E-16 GRAD(Rho)y 0.7094861E-15 GRAD(Rho)z -0.4741263E-16 Laplacian 0.2648916E-01 (-1/4)Del**2(Rho)) -0.6622291E-02 Diamond 0.7262262E-03 Metallicity 0.5915280E+00 Ellipticity -0.2069089E+01 Gb(Abramov) 0.5067739E-02 Vb(Abramov) -0.3513187E-02 Hb(Abramov) 0.1554552E-02 Ex_ueg -0.8990752E-03 Ec_ueg -0.2127754E-03 Delta_ex -0.1285693E-02 Delta_ec 0.6523181E-03 Delta_et -0.3905917E-02 Pxc 0.4225466E+01 Qxc -0.1970960E+01 3,+1 60 3 -1 -2.025559 2.748189 -1.551523 Rho 0.1378394E+00 |GRAD(Rho)| 0.6072494E-12 GRAD(Rho)x -0.4223097E-12 GRAD(Rho)y -0.3218374E-12 GRAD(Rho)z -0.2946644E-12 Laplacian 0.5419641E+00 (-1/4)Del**2(Rho)) -0.1354910E+00 Diamond 0.9843089E+00 Metallicity 0.4676616E+01 Ellipticity 0.2292762E-01 Gb(Abramov) 0.1959340E+00 Vb(Abramov) -0.2563769E+00 Hb(Abramov) -0.6044292E-01 Ex_ueg -0.5258756E-01 Ec_ueg -0.7669667E-02 Delta_ex -0.5692311E-01 Delta_ec 0.1388155E-01 Delta_et -0.1821994E+00 Pxc 0.6856564E+01 Qxc -0.4100632E+01 3,-1 61 3 -1 -2.948425 0.129883 -0.022287 Rho 0.6619446E-02 |GRAD(Rho)| 0.6980390E-14 GRAD(Rho)x -0.2059595E-14 GRAD(Rho)y 0.6656558E-14 GRAD(Rho)z -0.4173053E-15 Laplacian 0.2571660E-01 (-1/4)Del**2(Rho)) -0.6429151E-02 Diamond 0.9905797E-03 Metallicity 0.6253200E+00 Ellipticity 0.1102154E+01 Gb(Abramov) 0.4956147E-02 Vb(Abramov) -0.3483143E-02 Hb(Abramov) 0.1473004E-02 Ex_ueg -0.9179392E-03 Ec_ueg -0.2172563E-03 Delta_ex -0.1425239E-02 Delta_ec 0.9418534E-03 Delta_et -0.5512195E-02 Pxc 0.4225144E+01 Qxc -0.1513228E+01 3,-1 62 3 +3 -1.141899 0.005712 -1.586196 Rho 0.5528520E-02 |GRAD(Rho)| 0.1389792E-12 GRAD(Rho)x 0.1774475E-13 GRAD(Rho)y 0.2105014E-14 GRAD(Rho)z -0.1378256E-12 Laplacian 0.2176423E-01 (-1/4)Del**2(Rho)) -0.5441058E-02 Diamond 0.1707370E-03 Metallicity 0.5472906E+00 Ellipticity -0.2402133E+00 Gb(Abramov) 0.4123679E-02 Vb(Abramov) -0.2806299E-02 Hb(Abramov) 0.1317379E-02 Ex_ueg -0.7219884E-03 Ec_ueg -0.1697276E-03 Delta_ex -0.7702755E-03 Delta_ec 0.9050262E-04 Delta_et -0.7440618E-03 Pxc 0.4253807E+01 Qxc -0.8511085E+01 3,+3 63 3 +1 -0.551431 0.768642 -1.538214 Rho 0.8880216E-02 |GRAD(Rho)| 0.1564257E-12 GRAD(Rho)x 0.3201061E-13 GRAD(Rho)y -0.1162039E-13 GRAD(Rho)z 0.1526738E-12 Laplacian 0.3455702E-01 (-1/4)Del**2(Rho)) -0.8639255E-02 Diamond 0.9556335E-03 Metallicity 0.7593630E+00 Ellipticity -0.1447404E+01 Gb(Abramov) 0.6852892E-02 Vb(Abramov) -0.5066529E-02 Hb(Abramov) 0.1786363E-02 Ex_ueg -0.1358156E-02 Ec_ueg -0.3175351E-03 Delta_ex -0.1587062E-02 Delta_ec 0.4781996E-03 Delta_et -0.3301996E-02 Pxc 0.4277185E+01 Qxc -0.3318828E+01 3,+1 64 3 -1 -2.801965 0.886211 1.659050 Rho 0.1433909E+00 |GRAD(Rho)| 0.4190903E-14 GRAD(Rho)x -0.2400579E-14 GRAD(Rho)y 0.2641360E-14 GRAD(Rho)z 0.2196384E-14 Laplacian 0.6032310E+00 (-1/4)Del**2(Rho)) -0.1508077E+00 Diamond 0.1174434E+01 Metallicity 0.4487440E+01 Ellipticity 0.1578237E-01 Gb(Abramov) 0.2133286E+00 Vb(Abramov) -0.2758495E+00 Hb(Abramov) -0.6252087E-01 Ex_ueg -0.5543027E-01 Ec_ueg -0.8021785E-02 Delta_ex -0.6424324E-01 Delta_ec 0.1578612E-01 Delta_et -0.2094637E+00 Pxc 0.6909967E+01 Qxc -0.4069604E+01 3,-1 65 3 -1 -2.789001 0.921155 -1.651711 Rho 0.1772639E+00 |GRAD(Rho)| 0.5259485E-15 GRAD(Rho)x -0.9585025E-16 GRAD(Rho)y 0.5087077E-15 GRAD(Rho)z -0.9301099E-16 Laplacian 0.7303636E+00 (-1/4)Del**2(Rho)) -0.1825909E+00 Diamond 0.1785818E+01 Metallicity 0.5277656E+01 Ellipticity 0.1975957E-01 Gb(Abramov) 0.2823359E+00 Vb(Abramov) -0.3820810E+00 Hb(Abramov) -0.9974503E-01 Ex_ueg -0.7354368E-01 Ec_ueg -0.1021108E-01 Delta_ex -0.8157466E-01 Delta_ec 0.1743146E-01 Delta_et -0.2359476E+00 Pxc 0.7202341E+01 Qxc -0.4679738E+01 3,-1 66 3 +1 -0.590720 0.780608 1.613572 Rho 0.7556916E-02 |GRAD(Rho)| 0.4940470E-17 GRAD(Rho)x -0.1952202E-17 GRAD(Rho)y -0.2139726E-17 GRAD(Rho)z -0.4002340E-17 Laplacian 0.2753204E-01 (-1/4)Del**2(Rho)) -0.6883010E-02 Diamond 0.5851754E-03 Metallicity 0.7283650E+00 Ellipticity -0.1408199E+01 Gb(Abramov) 0.5424230E-02 Vb(Abramov) -0.3965451E-02 Hb(Abramov) 0.1458779E-02 Ex_ueg -0.1095245E-02 Ec_ueg -0.2585541E-03 Delta_ex -0.1200011E-02 Delta_ec 0.3561869E-03 Delta_et -0.2380885E-02 Pxc 0.4236036E+01 Qxc -0.3369050E+01 3,+1 67 3 -1 -2.806208 -0.918414 1.654691 Rho 0.1111479E+00 |GRAD(Rho)| 0.4084869E-15 GRAD(Rho)x 0.5822504E-17 GRAD(Rho)y -0.4041093E-15 GRAD(Rho)z 0.5935753E-16 Laplacian 0.4716879E+00 (-1/4)Del**2(Rho)) -0.1179220E+00 Diamond 0.6618919E+00 Metallicity 0.3753709E+01 Ellipticity 0.6753073E-02 Gb(Abramov) 0.1523888E+00 Vb(Abramov) -0.1868556E+00 Hb(Abramov) -0.3446681E-01 Ex_ueg -0.3946876E-01 Ec_ueg -0.6005165E-02 Delta_ex -0.4705464E-01 Delta_ec 0.1272695E-01 Delta_et -0.1611601E+00 Pxc 0.6572469E+01 Qxc -0.3697245E+01 3,-1 68 3 -1 -2.775433 -0.902645 -1.652221 Rho 0.8660864E-01 |GRAD(Rho)| 0.1343692E-15 GRAD(Rho)x -0.4168164E-16 GRAD(Rho)y 0.1268618E-15 GRAD(Rho)z -0.1496030E-16 Laplacian 0.3660146E+00 (-1/4)Del**2(Rho)) -0.9150365E-01 Diamond 0.3834126E+00 Metallicity 0.3191906E+01 Ellipticity 0.7319904E-02 Gb(Abramov) 0.1096809E+00 Vb(Abramov) -0.1278582E+00 Hb(Abramov) -0.1817729E-01 Ex_ueg -0.2830088E-01 Ec_ueg -0.4521264E-02 Delta_ex -0.3452185E-01 Delta_ec 0.1055638E-01 Delta_et -0.1273123E+00 Pxc 0.6259507E+01 Qxc -0.3270236E+01 3,-1 69 3 +1 -2.992481 -0.389950 -0.033786 Rho 0.6052708E-02 |GRAD(Rho)| 0.1234740E-16 GRAD(Rho)x 0.1839812E-18 GRAD(Rho)y -0.6486810E-17 GRAD(Rho)z 0.1050456E-16 Laplacian 0.2481563E-01 (-1/4)Del**2(Rho)) -0.6203908E-02 Diamond 0.5168416E-03 Metallicity 0.5582183E+00 Ellipticity -0.1462697E+01 Gb(Abramov) 0.4713128E-02 Vb(Abramov) -0.3222348E-02 Hb(Abramov) 0.1490780E-02 Ex_ueg -0.8146756E-03 Ec_ueg -0.1924927E-03 Delta_ex -0.1114234E-02 Delta_ec 0.4839995E-03 Delta_et -0.2900581E-02 Pxc 0.4232242E+01 Qxc -0.2302139E+01 3,+1 70 3 +3 -2.300815 -0.032403 -0.020839 Rho 0.5335469E-02 |GRAD(Rho)| 0.2622999E-15 GRAD(Rho)x 0.1992362E-15 GRAD(Rho)y 0.1685709E-15 GRAD(Rho)z -0.2626860E-16 Laplacian 0.2177022E-01 (-1/4)Del**2(Rho)) -0.5442555E-02 Diamond 0.2179222E-03 Metallicity 0.5156694E+00 Ellipticity -0.5263058E+00 Gb(Abramov) 0.4096130E-02 Vb(Abramov) -0.2749705E-02 Hb(Abramov) 0.1346425E-02 Ex_ueg -0.6885708E-03 Ec_ueg -0.1613779E-03 Delta_ex -0.8099180E-03 Delta_ec 0.1745625E-03 Delta_et -0.1171671E-02 Pxc 0.4266823E+01 Qxc -0.4639701E+01 3,+3 71 3 +1 -1.682339 -0.021794 0.739791 Rho 0.9847096E-02 |GRAD(Rho)| 0.1417617E-16 GRAD(Rho)x -0.1204560E-16 GRAD(Rho)y 0.4626313E-17 GRAD(Rho)z 0.5870646E-17 Laplacian 0.3663964E-01 (-1/4)Del**2(Rho)) -0.9159911E-02 Diamond 0.1196886E-02 Metallicity 0.8508288E+00 Ellipticity -0.1594303E+01 Gb(Abramov) 0.7405527E-02 Vb(Abramov) -0.5651142E-02 Hb(Abramov) 0.1754384E-02 Ex_ueg -0.1558820E-02 Ec_ueg -0.3611185E-03 Delta_ex -0.1739130E-02 Delta_ec 0.5272762E-03 Delta_et -0.3721935E-02 Pxc 0.4316644E+01 Qxc -0.3298328E+01 3,+1 72 3 +1 -1.743446 0.015263 -2.458502 Rho 0.1205699E-01 |GRAD(Rho)| 0.1308989E-14 GRAD(Rho)x -0.3213565E-15 GRAD(Rho)y 0.1248737E-14 GRAD(Rho)z 0.2254735E-15 Laplacian 0.5945133E-01 (-1/4)Del**2(Rho)) -0.1486283E-01 Diamond 0.2367992E-02 Metallicity 0.7348238E+00 Ellipticity -0.1265295E+01 Gb(Abramov) 0.1172882E-01 Vb(Abramov) -0.8594799E-02 Hb(Abramov) 0.3134017E-02 Ex_ueg -0.2041912E-02 Ec_ueg -0.4622006E-03 Delta_ex -0.2917403E-02 Delta_ec 0.7564181E-03 Delta_et -0.5690147E-02 Pxc 0.4417805E+01 Qxc -0.3856866E+01 3,+1 73 3 -1 -1.820652 -1.621418 -2.334089 Rho 0.1250087E+00 |GRAD(Rho)| 0.1864852E-12 GRAD(Rho)x 0.1447591E-12 GRAD(Rho)y 0.7642526E-13 GRAD(Rho)z -0.8933490E-13 Laplacian 0.5151203E+00 (-1/4)Del**2(Rho)) -0.1287801E+00 Diamond 0.8429300E+00 Metallicity 0.4180918E+01 Ellipticity 0.1419300E-01 Gb(Abramov) 0.1755899E+00 Vb(Abramov) -0.2223997E+00 Hb(Abramov) -0.4680980E-01 Ex_ueg -0.4616421E-01 Ec_ueg -0.6863476E-02 Delta_ex -0.5297920E-01 Delta_ec 0.1375752E-01 Delta_et -0.1782418E+00 Pxc 0.6726069E+01 Qxc -0.3850926E+01 3,-1 74 3 +1 -2.274962 -1.793543 0.209108 Rho 0.2947404E-01 |GRAD(Rho)| 0.1866250E-13 GRAD(Rho)x -0.8050683E-14 GRAD(Rho)y -0.3843941E-14 GRAD(Rho)z 0.1639206E-13 Laplacian 0.1182304E+00 (-1/4)Del**2(Rho)) -0.2955760E-01 Diamond 0.1880690E-01 Metallicity 0.1639143E+01 Ellipticity -0.3509263E+01 Gb(Abramov) 0.2777992E-01 Vb(Abramov) -0.2600224E-01 Hb(Abramov) 0.1777679E-02 Ex_ueg -0.6724158E-02 Ec_ueg -0.1316509E-02 Delta_ex -0.7633944E-02 Delta_ec 0.1914014E-02 Delta_et -0.1758931E-01 Pxc 0.5107565E+01 Qxc -0.3988447E+01 3,+1 75 3 -1 -1.859876 -1.642007 2.398036 Rho 0.1448270E+00 |GRAD(Rho)| 0.1424677E-14 GRAD(Rho)x 0.1136068E-14 GRAD(Rho)y 0.8470533E-15 GRAD(Rho)z 0.1468145E-15 Laplacian 0.5831316E+00 (-1/4)Del**2(Rho)) -0.1457829E+00 Diamond 0.1135326E+01 Metallicity 0.4719858E+01 Ellipticity 0.2093206E-01 Gb(Abramov) 0.2118677E+00 Vb(Abramov) -0.2779525E+00 Hb(Abramov) -0.6608480E-01 Ex_ueg -0.5617171E-01 Ec_ueg -0.8113192E-02 Delta_ex -0.6211110E-01 Delta_ec 0.1496881E-01 Delta_et -0.1983706E+00 Pxc 0.6923503E+01 Qxc -0.4149369E+01 3,-1 76 3 -1 -1.808101 1.588305 -2.340586 Rho 0.1232789E+00 |GRAD(Rho)| 0.1200859E-12 GRAD(Rho)x -0.8967278E-13 GRAD(Rho)y 0.3455150E-13 GRAD(Rho)z 0.7201116E-13 Laplacian 0.5069224E+00 (-1/4)Del**2(Rho)) -0.1267306E+00 Diamond 0.8140053E+00 Metallicity 0.4151002E+01 Ellipticity 0.9868874E-02 Gb(Abramov) 0.1721636E+00 Vb(Abramov) -0.2175965E+00 Hb(Abramov) -0.4543296E-01 Ex_ueg -0.4531445E-01 Ec_ueg -0.6755627E-02 Delta_ex -0.5194018E-01 Delta_ec 0.1354298E-01 Delta_et -0.1749773E+00 Pxc 0.6707661E+01 Qxc -0.3835209E+01 3,-1 77 3 +1 -2.225396 1.778710 0.243256 Rho 0.2409913E-01 |GRAD(Rho)| 0.3622751E-16 GRAD(Rho)x 0.3455351E-16 GRAD(Rho)y -0.9610002E-17 GRAD(Rho)z 0.5112218E-17 Laplacian 0.8912124E-01 (-1/4)Del**2(Rho)) -0.2228031E-01 Diamond 0.9567184E-02 Metallicity 0.1554655E+01 Ellipticity -0.2428718E+01 Gb(Abramov) 0.2062657E-01 Vb(Abramov) -0.1897284E-01 Hb(Abramov) 0.1653736E-02 Ex_ueg -0.5141070E-02 Ec_ueg -0.1043464E-02 Delta_ex -0.5316100E-02 Delta_ec 0.1203880E-02 Delta_et -0.1061101E-01 Pxc 0.4926924E+01 Qxc -0.4415804E+01 3,+1 78 3 -1 -1.748397 1.596728 0.869720 Rho 0.4230432E-01 |GRAD(Rho)| 0.5664279E-16 GRAD(Rho)x -0.3288648E-16 GRAD(Rho)y -0.3233167E-16 GRAD(Rho)z -0.3288690E-16 Laplacian 0.1790436E+00 (-1/4)Del**2(Rho)) -0.4476089E-01 Diamond 0.7763662E-01 Metallicity 0.1976798E+01 Ellipticity 0.3303161E-01 Gb(Abramov) 0.4458780E-01 Vb(Abramov) -0.4441471E-01 Hb(Abramov) 0.1730903E-03 Ex_ueg -0.1088674E-01 Ec_ueg -0.1994123E-02 Delta_ex -0.1442048E-01 Delta_ec 0.5853003E-02 Delta_et -0.5912912E-01 Pxc 0.5459414E+01 Qxc -0.2463774E+01 3,-1 79 3 -1 -1.840002 1.607651 2.452772 Rho 0.1277943E+00 |GRAD(Rho)| 0.5178883E-15 GRAD(Rho)x 0.4098555E-15 GRAD(Rho)y -0.6736284E-16 GRAD(Rho)z 0.3093364E-15 Laplacian 0.5364067E+00 (-1/4)Del**2(Rho)) -0.1341017E+00 Diamond 0.9233379E+00 Metallicity 0.4165220E+01 Ellipticity 0.1640803E-01 Gb(Abramov) 0.1824949E+00 Vb(Abramov) -0.2308882E+00 Hb(Abramov) -0.4839326E-01 Ex_ueg -0.4754084E-01 Ec_ueg -0.7037573E-02 Delta_ex -0.5573231E-01 Delta_ec 0.1473644E-01 Delta_et -0.1925068E+00 Pxc 0.6755289E+01 Qxc -0.3781939E+01 3,-1 80 3 +1 -2.035473 2.904566 -0.005493 Rho 0.1170746E-01 |GRAD(Rho)| 0.1151168E-14 GRAD(Rho)x 0.6494182E-15 GRAD(Rho)y -0.9504941E-15 GRAD(Rho)z 0.2384790E-17 Laplacian 0.4914298E-01 (-1/4)Del**2(Rho)) -0.1228575E-01 Diamond 0.1347840E-02 Metallicity 0.8464273E+00 Ellipticity -0.1103364E+01 Gb(Abramov) 0.9923662E-02 Vb(Abramov) -0.7561579E-02 Hb(Abramov) 0.2362084E-02 Ex_ueg -0.1963370E-02 Ec_ueg -0.4460814E-03 Delta_ex -0.2233946E-02 Delta_ec 0.3415182E-03 Delta_et -0.2776081E-02 Pxc 0.4401372E+01 Qxc -0.6541223E+01 3,+1 81 3 +1 -1.104339 2.525022 -0.592273 Rho 0.2506355E-01 |GRAD(Rho)| 0.7138391E-15 GRAD(Rho)x 0.3903592E-15 GRAD(Rho)y 0.5573393E-15 GRAD(Rho)z 0.2157749E-15 Laplacian 0.9447260E-01 (-1/4)Del**2(Rho)) -0.2361815E-01 Diamond 0.1169040E-01 Metallicity 0.1565711E+01 Ellipticity -0.3189948E+01 Gb(Abramov) 0.2190863E-01 Vb(Abramov) -0.2019912E-01 Hb(Abramov) 0.1709517E-02 Ex_ueg -0.5417204E-02 Ec_ueg -0.1091914E-02 Delta_ex -0.5802948E-02 Delta_ec 0.1466147E-02 Delta_et -0.1298152E-01 Pxc 0.4961198E+01 Qxc -0.3957957E+01 3,+1 82 3 +3 -1.955803 2.785396 0.000453 Rho 0.1167493E-01 |GRAD(Rho)| 0.1293607E-12 GRAD(Rho)x 0.1157435E-12 GRAD(Rho)y 0.5776008E-13 GRAD(Rho)z 0.1186123E-14 Laplacian 0.4844964E-01 (-1/4)Del**2(Rho)) -0.1211241E-01 Diamond 0.1058177E-02 Metallicity 0.8545678E+00 Ellipticity -0.8530507E+00 Gb(Abramov) 0.9800086E-02 Vb(Abramov) -0.7487762E-02 Hb(Abramov) 0.2312324E-02 Ex_ueg -0.1956099E-02 Ec_ueg -0.4445836E-03 Delta_ex -0.2121102E-02 Delta_ec 0.1945917E-03 Delta_et -0.1787873E-02 Pxc 0.4399846E+01 Qxc -0.1090027E+02 3,+3 83 3 -1 -2.027181 2.777312 1.548993 Rho 0.1141026E+00 |GRAD(Rho)| 0.4456633E-15 GRAD(Rho)x 0.2671813E-15 GRAD(Rho)y 0.3420929E-15 GRAD(Rho)z -0.1010070E-15 Laplacian 0.4654312E+00 (-1/4)Del**2(Rho)) -0.1163578E+00 Diamond 0.6922394E+00 Metallicity 0.3974204E+01 Ellipticity 0.3890523E-02 Gb(Abramov) 0.1546435E+00 Vb(Abramov) -0.1929291E+00 Hb(Abramov) -0.3828566E-01 Ex_ueg -0.4087386E-01 Ec_ueg -0.6186984E-02 Delta_ex -0.4698083E-01 Delta_ec 0.1294807E-01 Delta_et -0.1654563E+00 Pxc 0.6606428E+01 Qxc -0.3628404E+01 3,-1 84 3 -1 -2.219810 -2.894006 -1.725242 Rho 0.2215948E+00 |GRAD(Rho)| 0.1341738E-12 GRAD(Rho)x -0.1235318E-12 GRAD(Rho)y -0.3434406E-13 GRAD(Rho)z 0.3953462E-13 Laplacian 0.8640490E+00 (-1/4)Del**2(Rho)) -0.2160123E+00 Diamond 0.2740706E+01 Metallicity 0.6471536E+01 Ellipticity 0.7602582E-02 Gb(Abramov) 0.3769967E+00 Vb(Abramov) -0.5379811E+00 Hb(Abramov) -0.1609844E+00 Ex_ueg -0.9903708E-01 Ec_ueg -0.1317610E-01 Delta_ex -0.1020415E+00 Delta_ec 0.1916131E-01 Delta_et -0.2629830E+00 Pxc 0.7516417E+01 Qxc -0.5325395E+01 3,-1 85 3 -1 -2.243262 -2.862440 1.690163 Rho 0.2137315E+00 |GRAD(Rho)| 0.4368404E-13 GRAD(Rho)x -0.3842984E-13 GRAD(Rho)y 0.2062077E-13 GRAD(Rho)z 0.2495339E-14 Laplacian 0.8540230E+00 (-1/4)Del**2(Rho)) -0.2135058E+00 Diamond 0.2581362E+01 Metallicity 0.6164880E+01 Ellipticity 0.1194327E-01 Gb(Abramov) 0.3617100E+00 Vb(Abramov) -0.5099143E+00 Hb(Abramov) -0.1482043E+00 Ex_ueg -0.9437925E-01 Ec_ueg -0.1264218E-01 Delta_ex -0.9984126E-01 Delta_ec 0.1899916E-01 Delta_et -0.2597427E+00 Pxc 0.7465424E+01 Qxc -0.5255035E+01 3,-1 86 3 +3 -1.111379 0.015718 1.649908 Rho 0.5154047E-02 |GRAD(Rho)| 0.4834763E-17 GRAD(Rho)x -0.7767242E-18 GRAD(Rho)y 0.1564151E-18 GRAD(Rho)z -0.4769399E-17 Laplacian 0.1878780E-01 (-1/4)Del**2(Rho)) -0.4696950E-02 Diamond 0.1289775E-03 Metallicity 0.5640503E+00 Ellipticity -0.3272242E+00 Gb(Abramov) 0.3572853E-02 Vb(Abramov) -0.2448756E-02 Hb(Abramov) 0.1124097E-02 Ex_ueg -0.6575310E-03 Ec_ueg -0.1535481E-03 Delta_ex -0.6476519E-03 Delta_ec 0.7035221E-04 Delta_et -0.5955850E-03 Pxc 0.4282248E+01 Qxc -0.9205851E+01 3,+3 87 3 +1 -1.773899 0.006252 2.518353 Rho 0.1112846E-01 |GRAD(Rho)| 0.2474378E-16 GRAD(Rho)x 0.3340445E-17 GRAD(Rho)y -0.2180651E-16 GRAD(Rho)z -0.1120590E-16 Laplacian 0.5044839E-01 (-1/4)Del**2(Rho)) -0.1261210E-01 Diamond 0.1698292E-02 Metallicity 0.7576889E+00 Ellipticity -0.1254861E+01 Gb(Abramov) 0.1000074E-01 Vb(Abramov) -0.7389381E-02 Hb(Abramov) 0.2611358E-02 Ex_ueg -0.1834982E-02 Ec_ueg -0.4194866E-03 Delta_ex -0.2391223E-02 Delta_ec 0.5836740E-03 Delta_et -0.4353103E-02 Pxc 0.4374352E+01 Qxc -0.4096847E+01 3,+1 88 3 +1 0.211730 1.967646 -2.246547 Rho 0.6264284E-02 |GRAD(Rho)| 0.1091211E-16 GRAD(Rho)x 0.8237519E-17 GRAD(Rho)y 0.3274310E-17 GRAD(Rho)z 0.6363666E-17 Laplacian 0.2600076E-01 (-1/4)Del**2(Rho)) -0.6500190E-02 Diamond 0.7448248E-03 Metallicity 0.5641737E+00 Ellipticity -0.2433845E+01 Gb(Abramov) 0.4944666E-02 Vb(Abramov) -0.3389142E-02 Hb(Abramov) 0.1555524E-02 Ex_ueg -0.8528650E-03 Ec_ueg -0.2017194E-03 Delta_ex -0.1298723E-02 Delta_ec 0.7250561E-03 Delta_et -0.4249483E-02 Pxc 0.4227978E+01 Qxc -0.1791203E+01 3,+1 89 3 -1 0.042634 2.084407 -2.123465 Rho 0.6326555E-02 |GRAD(Rho)| 0.2089211E-13 GRAD(Rho)x -0.1416802E-13 GRAD(Rho)y 0.6518801E-14 GRAD(Rho)z 0.1390153E-13 Laplacian 0.2506942E-01 (-1/4)Del**2(Rho)) -0.6267354E-02 Diamond 0.9218105E-03 Metallicity 0.5948595E+00 Ellipticity 0.1679876E+01 Gb(Abramov) 0.4799602E-02 Vb(Abramov) -0.3331850E-02 Hb(Abramov) 0.1467752E-02 Ex_ueg -0.8641877E-03 Ec_ueg -0.2044391E-03 Delta_ex -0.1386425E-02 Delta_ec 0.9341291E-03 Delta_et -0.5387095E-02 Pxc 0.4227116E+01 Qxc -0.1484190E+01 3,-1 90 3 -1 -1.758464 1.605208 -0.835108 Rho 0.4592323E-01 |GRAD(Rho)| 0.4868264E-16 GRAD(Rho)x -0.3974575E-16 GRAD(Rho)y 0.1949637E-16 GRAD(Rho)z -0.2025256E-16 Laplacian 0.1816475E+00 (-1/4)Del**2(Rho)) -0.4541187E-01 Diamond 0.8094821E-01 Metallicity 0.2234110E+01 Ellipticity 0.2079643E-01 Gb(Abramov) 0.4718377E-01 Vb(Abramov) -0.4895566E-01 Hb(Abramov) -0.1771896E-02 Ex_ueg -0.1214586E-01 Ec_ueg -0.2190796E-02 Delta_ex -0.1458393E-01 Delta_ec 0.5322737E-02 Delta_et -0.5486644E-01 Pxc 0.5544040E+01 Qxc -0.2739931E+01 3,-1 91 3 +1 -0.194517 -2.733338 -2.008523 Rho 0.2398799E-02 |GRAD(Rho)| 0.1580043E-17 GRAD(Rho)x 0.1252888E-17 GRAD(Rho)y 0.5654424E-18 GRAD(Rho)z 0.7791560E-18 Laplacian 0.8797336E-02 (-1/4)Del**2(Rho)) -0.2199334E-02 Diamond 0.6417290E-04 Metallicity 0.3367068E+00 Ellipticity -0.1462141E+01 Gb(Abramov) 0.1589644E-02 Vb(Abramov) -0.9799549E-03 Hb(Abramov) 0.6096896E-03 Ex_ueg -0.2371612E-03 Ec_ueg -0.3674961E-04 Delta_ex -0.3519396E-03 Delta_ec 0.2222122E-03 Delta_et -0.9889383E-03 Pxc 0.6453434E+01 Qxc -0.1583799E+01 3,+1 92 3 +1 -0.200019 -2.742505 1.976736 Rho 0.2227759E-02 |GRAD(Rho)| 0.7694392E-11 GRAD(Rho)x 0.7215974E-11 GRAD(Rho)y -0.2327294E-11 GRAD(Rho)z -0.1310378E-11 Laplacian 0.8416909E-02 (-1/4)Del**2(Rho)) -0.2104227E-02 Diamond 0.5970728E-04 Metallicity 0.3111054E+00 Ellipticity -0.1480756E+01 Gb(Abramov) 0.1511924E-02 Vb(Abramov) -0.9196213E-03 Hb(Abramov) 0.5923030E-03 Ex_ueg -0.2148866E-03 Ec_ueg -0.2963507E-04 Delta_ex -0.3433386E-03 Delta_ec 0.2325958E-03 Delta_et -0.1002222E-02 Pxc 0.7251092E+01 Qxc -0.1476117E+01 3,+1 93 3 +1 -0.225484 2.286425 -1.946534 Rho 0.6118761E-02 |GRAD(Rho)| 0.6944819E-17 GRAD(Rho)x -0.4726768E-17 GRAD(Rho)y -0.1087882E-17 GRAD(Rho)z -0.4970381E-17 Laplacian 0.2497239E-01 (-1/4)Del**2(Rho)) -0.6243098E-02 Diamond 0.6191805E-03 Metallicity 0.5648401E+00 Ellipticity -0.1852454E+01 Gb(Abramov) 0.4749791E-02 Vb(Abramov) -0.3256483E-02 Hb(Abramov) 0.1493307E-02 Ex_ueg -0.8265511E-03 Ec_ueg -0.1953709E-03 Delta_ex -0.1188884E-02 Delta_ec 0.6028035E-03 Delta_et -0.3550109E-02 Pxc 0.4230678E+01 Qxc -0.1972258E+01 3,+1 94 3 +1 -1.350054 2.371603 0.755943 Rho 0.2479121E-01 |GRAD(Rho)| 0.3380973E-15 GRAD(Rho)x -0.2341957E-15 GRAD(Rho)y 0.6145108E-16 GRAD(Rho)z 0.2359786E-15 Laplacian 0.9106975E-01 (-1/4)Del**2(Rho)) -0.2276744E-01 Diamond 0.1204081E-01 Metallicity 0.1594906E+01 Ellipticity -0.6427864E+01 Gb(Abramov) 0.2123028E-01 Vb(Abramov) -0.1969312E-01 Hb(Abramov) 0.1537159E-02 Ex_ueg -0.5338861E-02 Ec_ueg -0.1078207E-02 Delta_ex -0.5680657E-02 Delta_ec 0.1597665E-02 Delta_et -0.1406153E-01 Pxc 0.4951608E+01 Qxc -0.3555600E+01 3,+1 95 3 +1 -0.602725 -0.836804 -1.523977 Rho 0.9677739E-02 |GRAD(Rho)| 0.9539364E-17 GRAD(Rho)x -0.6558993E-17 GRAD(Rho)y -0.5416683E-17 GRAD(Rho)z -0.4317248E-17 Laplacian 0.3771663E-01 (-1/4)Del**2(Rho)) -0.9429159E-02 Diamond 0.1204575E-02 Metallicity 0.8029776E+00 Ellipticity -0.1518614E+01 Gb(Abramov) 0.7548006E-02 Vb(Abramov) -0.5666854E-02 Hb(Abramov) 0.1881152E-02 Ex_ueg -0.1523177E-02 Ec_ueg -0.3534555E-03 Delta_ex -0.1782861E-02 Delta_ec 0.5436952E-03 Delta_et -0.3820096E-02 Pxc 0.4309388E+01 Qxc -0.3279155E+01 3,+1 96 3 +1 1.656195 -0.812583 -0.004597 Rho 0.8070311E-02 |GRAD(Rho)| 0.3709611E-13 GRAD(Rho)x -0.1064002E-13 GRAD(Rho)y -0.2956216E-13 GRAD(Rho)z 0.1972284E-13 Laplacian 0.3221183E-01 (-1/4)Del**2(Rho)) -0.8052958E-02 Diamond 0.8069334E-03 Metallicity 0.6946214E+00 Ellipticity -0.1417678E+01 Gb(Abramov) 0.6300931E-02 Vb(Abramov) -0.4548905E-02 Hb(Abramov) 0.1752026E-02 Ex_ueg -0.1195562E-02 Ec_ueg -0.2813430E-03 Delta_ex -0.1456188E-02 Delta_ec 0.4676450E-03 Delta_et -0.3132509E-02 Pxc 0.4249481E+01 Qxc -0.3113874E+01 3,+1 97 3 -1 -0.882197 3.600836 0.724871 Rho 0.1329641E+00 |GRAD(Rho)| 0.1337853E-12 GRAD(Rho)x 0.9593877E-13 GRAD(Rho)y 0.4286312E-13 GRAD(Rho)z -0.8280705E-13 Laplacian 0.5370017E+00 (-1/4)Del**2(Rho)) -0.1342504E+00 Diamond 0.9580085E+00 Metallicity 0.4444894E+01 Ellipticity 0.1858536E-01 Gb(Abramov) 0.1889551E+00 Vb(Abramov) -0.2436598E+00 Hb(Abramov) -0.5470469E-01 Ex_ueg -0.5012229E-01 Ec_ueg -0.7362060E-02 Delta_ex -0.5619131E-01 Delta_ec 0.1437658E-01 Delta_et -0.1886346E+00 Pxc 0.6808188E+01 Qxc -0.3908532E+01 3,-1 98 3 +3 0.009216 1.626804 1.677172 Rho 0.4017004E-02 |GRAD(Rho)| 0.1676226E-17 GRAD(Rho)x 0.1616776E-17 GRAD(Rho)y 0.1083256E-18 GRAD(Rho)z 0.4289940E-18 Laplacian 0.1578372E-01 (-1/4)Del**2(Rho)) -0.3945930E-02 Diamond 0.1073745E-03 Metallicity 0.4431739E+00 Ellipticity -0.2124989E+00 Gb(Abramov) 0.2922076E-02 Vb(Abramov) -0.1898221E-02 Hb(Abramov) 0.1023855E-02 Ex_ueg -0.4716155E-03 Ec_ueg -0.1048589E-03 Delta_ex -0.5452929E-03 Delta_ec 0.1264777E-03 Delta_et -0.7956397E-03 Pxc 0.4497621E+01 Qxc -0.4311375E+01 3,+3 99 3 -1 -0.545371 2.456824 0.003313 Rho 0.4239973E-01 |GRAD(Rho)| 0.1820629E-14 GRAD(Rho)x 0.5872282E-15 GRAD(Rho)y 0.1723209E-14 GRAD(Rho)z 0.2011238E-16 Laplacian 0.1813134E+00 (-1/4)Del**2(Rho)) -0.4532834E-01 Diamond 0.7923797E-01 Metallicity 0.1959394E+01 Ellipticity 0.2171198E-01 Gb(Abramov) 0.4502157E-01 Vb(Abramov) -0.4471481E-01 Hb(Abramov) 0.3067644E-03 Ex_ueg -0.1091949E-01 Ec_ueg -0.1999280E-02 Delta_ex -0.1463152E-01 Delta_ec 0.5963194E-02 Delta_et -0.6028453E-01 Pxc 0.5461714E+01 Qxc -0.2453638E+01 3,-1 100 3 +1 -0.105925 2.208072 2.065159 Rho 0.4890030E-02 |GRAD(Rho)| 0.1073433E-15 GRAD(Rho)x -0.7530228E-16 GRAD(Rho)y 0.5681467E-16 GRAD(Rho)z -0.5122746E-16 Laplacian 0.1871680E-01 (-1/4)Del**2(Rho)) -0.4679199E-02 Diamond 0.4211432E-03 Metallicity 0.5186816E+00 Ellipticity -0.4405555E+01 Gb(Abramov) 0.3523968E-02 Vb(Abramov) -0.2368738E-02 Hb(Abramov) 0.1155231E-02 Ex_ueg -0.6130093E-03 Ec_ueg -0.1421834E-03 Delta_ex -0.9242319E-03 Delta_ec 0.5851442E-03 Delta_et -0.3158382E-02 Pxc 0.4311398E+01 Qxc -0.1579494E+01 3,+1 101 3 -1 -0.200136 -3.513198 -1.704817 Rho 0.3376884E-02 |GRAD(Rho)| 0.1240984E-16 GRAD(Rho)x -0.1179743E-16 GRAD(Rho)y 0.3834505E-17 GRAD(Rho)z -0.3480405E-18 Laplacian 0.1131997E-01 (-1/4)Del**2(Rho)) -0.2829993E-02 Diamond 0.2377555E-03 Metallicity 0.4626951E+00 Ellipticity 0.1137203E+00 Gb(Abramov) 0.2104899E-02 Vb(Abramov) -0.1379805E-02 Hb(Abramov) 0.7250936E-03 Ex_ueg -0.3741737E-03 Ec_ueg -0.7774650E-04 Delta_ex -0.6513090E-03 Delta_ec 0.5856137E-03 Delta_et -0.2730400E-02 Pxc 0.4812741E+01 Qxc -0.1112182E+01 3,-1 102 3 -1 -0.523591 0.611309 -0.000275 Rho 0.1740105E+00 |GRAD(Rho)| 0.1531462E-12 GRAD(Rho)x 0.7939829E-14 GRAD(Rho)y -0.3063522E-14 GRAD(Rho)z 0.1529096E-12 Laplacian 0.4402815E+00 (-1/4)Del**2(Rho)) -0.1100704E+00 Diamond 0.1085208E+01 Metallicity 0.8488712E+01 Ellipticity 0.3835481E-02 Gb(Abramov) 0.2291062E+00 Vb(Abramov) -0.3481420E+00 Hb(Abramov) -0.1190358E+00 Ex_ueg -0.7174951E-01 Ec_ueg -0.9997860E-02 Delta_ex -0.4921088E-01 Delta_ec 0.1103165E-01 Delta_et -0.1504027E+00 Pxc 0.7176487E+01 Qxc -0.4460883E+01 3,-1 103 3 -1 -0.584704 0.720463 3.314019 Rho 0.1314998E+00 |GRAD(Rho)| 0.7360411E-14 GRAD(Rho)x -0.1235123E-14 GRAD(Rho)y 0.2493340E-14 GRAD(Rho)z -0.6814204E-14 Laplacian 0.5564930E+00 (-1/4)Del**2(Rho)) -0.1391233E+00 Diamond 0.9823043E+00 Metallicity 0.4210774E+01 Ellipticity 0.1079188E-01 Gb(Abramov) 0.1903849E+00 Vb(Abramov) -0.2416466E+00 Hb(Abramov) -0.5126168E-01 Ex_ueg -0.4938767E-01 Ec_ueg -0.7269974E-02 Delta_ex -0.5810748E-01 Delta_ec 0.1499367E-01 Delta_et -0.1964765E+00 Pxc 0.6793376E+01 Qxc -0.3875468E+01 3,-1 104 3 -1 -0.540860 0.698960 -3.203527 Rho 0.1447717E+00 |GRAD(Rho)| 0.1994462E-14 GRAD(Rho)x 0.1297248E-14 GRAD(Rho)y -0.1365078E-14 GRAD(Rho)z -0.6569520E-15 Laplacian 0.6067069E+00 (-1/4)Del**2(Rho)) -0.1516767E+00 Diamond 0.1166594E+01 Metallicity 0.4533571E+01 Ellipticity 0.1731296E-01 Gb(Abramov) 0.2157240E+00 Vb(Abramov) -0.2797713E+00 Hb(Abramov) -0.6404728E-01 Ex_ueg -0.5614314E-01 Ec_ueg -0.8109673E-02 Delta_ex -0.6446898E-01 Delta_ec 0.1531269E-01 Delta_et -0.2023429E+00 Pxc 0.6922984E+01 Qxc -0.4210166E+01 3,-1 105 3 -1 -0.878736 3.567376 -0.755071 Rho 0.1182061E+00 |GRAD(Rho)| 0.8746991E-16 GRAD(Rho)x 0.5659535E-16 GRAD(Rho)y -0.3008322E-16 GRAD(Rho)z 0.5952270E-16 Laplacian 0.4811030E+00 (-1/4)Del**2(Rho)) -0.1202757E+00 Diamond 0.7533279E+00 Metallicity 0.4077945E+01 Ellipticity 0.1747225E-01 Gb(Abramov) 0.1619301E+00 Vb(Abramov) -0.2035845E+00 Hb(Abramov) -0.4165439E-01 Ex_ueg -0.4284545E-01 Ec_ueg -0.6440539E-02 Delta_ex -0.4906114E-01 Delta_ec 0.1344037E-01 Delta_et -0.1731223E+00 Pxc 0.6652464E+01 Qxc -0.3650281E+01 3,-1 106 3 -1 0.862876 -0.698316 -3.544646 Rho 0.1555735E+00 |GRAD(Rho)| 0.3254128E-12 GRAD(Rho)x -0.2355530E-12 GRAD(Rho)y 0.2241151E-12 GRAD(Rho)z -0.1344257E-13 Laplacian 0.6158521E+00 (-1/4)Del**2(Rho)) -0.1539630E+00 Diamond 0.1290293E+01 Metallicity 0.5035348E+01 Ellipticity 0.5856887E-01 Gb(Abramov) 0.2318516E+00 Vb(Abramov) -0.3097401E+00 Hb(Abramov) -0.7788856E-01 Ex_ueg -0.6179679E-01 Ec_ueg -0.8801248E-02 Delta_ex -0.6660459E-01 Delta_ec 0.1525291E-01 Delta_et -0.2034943E+00 Pxc 0.7021367E+01 Qxc -0.4366681E+01 3,-1 107 3 +1 0.520363 1.505925 -0.842812 Rho 0.7654643E-02 |GRAD(Rho)| 0.3558055E-14 GRAD(Rho)x -0.2853887E-14 GRAD(Rho)y -0.1463775E-14 GRAD(Rho)z 0.1540274E-14 Laplacian 0.2965553E-01 (-1/4)Del**2(Rho)) -0.7413882E-02 Diamond 0.6830964E-03 Metallicity 0.6908479E+00 Ellipticity -0.1416682E+01 Gb(Abramov) 0.5796232E-02 Vb(Abramov) -0.4178582E-02 Hb(Abramov) 0.1617650E-02 Ex_ueg -0.1114171E-02 Ec_ueg -0.2628828E-03 Delta_ex -0.1318714E-02 Delta_ec 0.4228020E-03 Delta_et -0.2799651E-02 Pxc 0.4238278E+01 Qxc -0.3118987E+01 3,+1 108 3 +1 0.541575 1.524621 0.841650 Rho 0.7245885E-02 |GRAD(Rho)| 0.4816815E-17 GRAD(Rho)x -0.1711809E-17 GRAD(Rho)y -0.3321155E-17 GRAD(Rho)z -0.3039959E-17 Laplacian 0.2765846E-01 (-1/4)Del**2(Rho)) -0.6914614E-02 Diamond 0.5919969E-03 Metallicity 0.6759859E+00 Ellipticity -0.1412629E+01 Gb(Abramov) 0.5388773E-02 Vb(Abramov) -0.3862932E-02 Hb(Abramov) 0.1525841E-02 Ex_ueg -0.1035556E-02 Ec_ueg -0.2448069E-03 Delta_ex -0.1213609E-02 Delta_ec 0.3950543E-03 Delta_et -0.2578197E-02 Pxc 0.4230094E+01 Qxc -0.3072007E+01 3,+1 109 3 -1 -0.600011 -0.721935 3.263571 Rho 0.1178680E+00 |GRAD(Rho)| 0.1133155E-13 GRAD(Rho)x 0.5875414E-14 GRAD(Rho)y 0.8507978E-14 GRAD(Rho)z 0.4636584E-14 Laplacian 0.5084409E+00 (-1/4)Del**2(Rho)) -0.1271102E+00 Diamond 0.7927255E+00 Metallicity 0.3840307E+01 Ellipticity 0.9773737E-02 Gb(Abramov) 0.1660972E+00 Vb(Abramov) -0.2050841E+00 Hb(Abramov) -0.3898697E-01 Ex_ueg -0.4268215E-01 Ec_ueg -0.6419605E-02 Delta_ex -0.5180473E-01 Delta_ec 0.1419693E-01 Delta_et -0.1827458E+00 Pxc 0.6648719E+01 Qxc -0.3649009E+01 3,-1 110 3 -1 -0.032214 -0.033460 4.570969 Rho 0.2008846E+00 |GRAD(Rho)| 0.1333168E-14 GRAD(Rho)x -0.1284780E-15 GRAD(Rho)y -0.2973763E-16 GRAD(Rho)z 0.1326630E-14 Laplacian 0.7665853E+00 (-1/4)Del**2(Rho)) -0.1916463E+00 Diamond 0.2193616E+01 Metallicity 0.6193896E+01 Ellipticity 0.5523659E-02 Gb(Abramov) 0.3256038E+00 Vb(Abramov) -0.4595612E+00 Hb(Abramov) -0.1339574E+00 Ex_ueg -0.8689218E-01 Ec_ueg -0.1177724E-01 Delta_ex -0.8848803E-01 Delta_ec 0.1787230E-01 Delta_et -0.2452783E+00 Pxc 0.7377976E+01 Qxc -0.4951126E+01 3,-1 111 3 -1 -0.081395 0.015032 -4.487780 Rho 0.2244673E+00 |GRAD(Rho)| 0.8842480E-13 GRAD(Rho)x 0.1896050E-13 GRAD(Rho)y -0.1658421E-14 GRAD(Rho)z 0.8635215E-13 Laplacian 0.8412333E+00 (-1/4)Del**2(Rho)) -0.2103083E+00 Diamond 0.2740135E+01 Metallicity 0.6791283E+01 Ellipticity 0.4463084E-02 Gb(Abramov) 0.3782494E+00 Vb(Abramov) -0.5461905E+00 Hb(Abramov) -0.1679411E+00 Ex_ueg -0.1007525E+00 Ec_ueg -0.1337199E-01 Delta_ex -0.9985541E-01 Delta_ec 0.1889898E-01 Delta_et -0.2608271E+00 Pxc 0.7534590E+01 Qxc -0.5283640E+01 3,-1 112 3 +1 2.067906 -0.013519 -2.863372 Rho 0.1125289E-01 |GRAD(Rho)| 0.7128985E-16 GRAD(Rho)x 0.5522930E-17 GRAD(Rho)y -0.6440606E-16 GRAD(Rho)z 0.3005993E-16 Laplacian 0.5098423E-01 (-1/4)Del**2(Rho)) -0.1274606E-01 Diamond 0.1537243E-02 Metallicity 0.7637488E+00 Ellipticity -0.1140066E+01 Gb(Abramov) 0.1011984E-01 Vb(Abramov) -0.7493615E-02 Hb(Abramov) 0.2626222E-02 Ex_ueg -0.1862389E-02 Ec_ueg -0.4251904E-03 Delta_ex -0.2359104E-02 Delta_ec 0.4743680E-03 Delta_et -0.3650082E-02 Pxc 0.4380129E+01 Qxc -0.4973152E+01 3,+1 113 3 -1 0.401146 -0.098977 0.663475 Rho 0.1775542E+00 |GRAD(Rho)| 0.3560539E-15 GRAD(Rho)x 0.1942890E-15 GRAD(Rho)y 0.1448426E-18 GRAD(Rho)z 0.2983724E-15 Laplacian 0.4519974E+00 (-1/4)Del**2(Rho)) -0.1129994E+00 Diamond 0.1146888E+01 Metallicity 0.8551235E+01 Ellipticity 0.6516963E-02 Gb(Abramov) 0.2363802E+00 Vb(Abramov) -0.3597611E+00 Hb(Abramov) -0.1233809E+00 Ex_ueg -0.7370433E-01 Ec_ueg -0.1023014E-01 Delta_ex -0.5081913E-01 Delta_ec 0.1134457E-01 Delta_et -0.1552581E+00 Pxc 0.7204627E+01 Qxc -0.4479600E+01 3,-1 114 3 -1 0.070123 4.596388 -0.027296 Rho 0.1982991E+00 |GRAD(Rho)| 0.6370749E-14 GRAD(Rho)x 0.1035250E-14 GRAD(Rho)y 0.4930301E-14 GRAD(Rho)z 0.3899594E-14 Laplacian 0.7538349E+00 (-1/4)Del**2(Rho)) -0.1884587E+00 Diamond 0.2125509E+01 Metallicity 0.6164127E+01 Ellipticity 0.3162358E-02 Gb(Abramov) 0.3192531E+00 Vb(Abramov) -0.4500474E+00 Hb(Abramov) -0.1307943E+00 Ex_ueg -0.8540424E-01 Ec_ueg -0.1160427E-01 Delta_ex -0.8674053E-01 Delta_ec 0.1765839E-01 Delta_et -0.2421615E+00 Pxc 0.7359723E+01 Qxc -0.4912143E+01 3,-1 115 3 +3 0.033299 1.570589 -1.581347 Rho 0.4764884E-02 |GRAD(Rho)| 0.4567449E-14 GRAD(Rho)x -0.1502162E-14 GRAD(Rho)y -0.1325900E-15 GRAD(Rho)z 0.4311325E-14 Laplacian 0.1953950E-01 (-1/4)Del**2(Rho)) -0.4884876E-02 Diamond 0.1566311E-03 Metallicity 0.4758319E+00 Ellipticity -0.3179560E+00 Gb(Abramov) 0.3643981E-02 Vb(Abramov) -0.2403085E-02 Hb(Abramov) 0.1240895E-02 Ex_ueg -0.5921816E-03 Ec_ueg -0.1368089E-03 Delta_ex -0.6947278E-03 Delta_ec 0.1371432E-03 Delta_et -0.9283850E-03 Pxc 0.4328531E+01 Qxc -0.5065711E+01 3,+3 116 3 +3 1.133840 1.495993 0.014090 Rho 0.4203452E-02 |GRAD(Rho)| 0.7811237E-16 GRAD(Rho)x 0.1041453E-16 GRAD(Rho)y 0.7731515E-16 GRAD(Rho)z 0.3930293E-17 Laplacian 0.1609577E-01 (-1/4)Del**2(Rho)) -0.4023943E-02 Diamond 0.9602266E-04 Metallicity 0.4687179E+00 Ellipticity -0.1530400E+00 Gb(Abramov) 0.2996978E-02 Vb(Abramov) -0.1970012E-02 Hb(Abramov) 0.1026965E-02 Ex_ueg -0.5010255E-03 Ec_ueg -0.1127968E-03 Delta_ex -0.5387122E-03 Delta_ec 0.8629317E-04 Delta_et -0.6174627E-03 Pxc 0.4441842E+01 Qxc -0.6242814E+01 3,+3 117 3 -1 0.521890 -0.047853 -2.415316 Rho 0.5433625E-01 |GRAD(Rho)| 0.1947932E-15 GRAD(Rho)x 0.7261783E-16 GRAD(Rho)y -0.1013141E-16 GRAD(Rho)z 0.1804671E-15 Laplacian 0.2162341E+00 (-1/4)Del**2(Rho)) -0.5405852E-01 Diamond 0.1222282E+00 Metallicity 0.2484116E+01 Ellipticity 0.1877129E-01 Gb(Abramov) 0.5842028E-01 Vb(Abramov) -0.6278205E-01 Hb(Abramov) -0.4361764E-02 Ex_ueg -0.1519980E-01 Ec_ueg -0.2655931E-02 Delta_ex -0.1815697E-01 Delta_ec 0.6403864E-02 Delta_et -0.6898727E-01 Pxc 0.5722965E+01 Qxc -0.2835314E+01 3,-1 118 3 +1 1.135350 -0.630633 2.506432 Rho 0.2726720E-01 |GRAD(Rho)| 0.3158687E-16 GRAD(Rho)x 0.2049830E-16 GRAD(Rho)y -0.4811898E-17 GRAD(Rho)z 0.2354561E-16 Laplacian 0.1075678E+00 (-1/4)Del**2(Rho)) -0.2689194E-01 Diamond 0.1689641E-01 Metallicity 0.1582457E+01 Ellipticity -0.7818720E+01 Gb(Abramov) 0.2502052E-01 Vb(Abramov) -0.2314909E-01 Hb(Abramov) 0.1871422E-02 Ex_ueg -0.6061393E-02 Ec_ueg -0.1203528E-02 Delta_ex -0.6948231E-02 Delta_ec 0.2005179E-02 Delta_et -0.1804704E-01 Pxc 0.5036354E+01 Qxc -0.3465143E+01 3,+1 119 3 +3 2.351209 0.046370 0.005650 Rho 0.3690869E-02 |GRAD(Rho)| 0.4729816E-17 GRAD(Rho)x -0.2479369E-17 GRAD(Rho)y 0.2753328E-17 GRAD(Rho)z 0.2939910E-17 Laplacian 0.1506284E-01 (-1/4)Del**2(Rho)) -0.3765710E-02 Diamond 0.1014306E-03 Metallicity 0.4032621E+00 Ellipticity -0.2350008E+00 Gb(Abramov) 0.2763568E-02 Vb(Abramov) -0.1761426E-02 Hb(Abramov) 0.1002142E-02 Ex_ueg -0.4212661E-03 Ec_ueg -0.9101801E-04 Delta_ex -0.5232304E-03 Delta_ec 0.1457377E-03 Delta_et -0.8581441E-03 Pxc 0.4628382E+01 Qxc -0.3590219E+01 3,+3 120 3 +1 1.239154 0.670683 2.392920 Rho 0.2332589E-01 |GRAD(Rho)| 0.1178126E-14 GRAD(Rho)x 0.2165491E-15 GRAD(Rho)y 0.4643020E-15 GRAD(Rho)z 0.1060901E-14 Laplacian 0.8798922E-01 (-1/4)Del**2(Rho)) -0.2199730E-01 Diamond 0.1132304E-01 Metallicity 0.1491354E+01 Ellipticity -0.7803370E+01 Gb(Abramov) 0.2013250E-01 Vb(Abramov) -0.1826769E-01 Hb(Abramov) 0.1864806E-02 Ex_ueg -0.4922315E-02 Ec_ueg -0.1004800E-02 Delta_ex -0.5474988E-02 Delta_ec 0.1676447E-02 Delta_et -0.1449705E-01 Pxc 0.4898799E+01 Qxc -0.3265828E+01 3,+1 121 3 +1 1.401857 0.764772 -2.254214 Rho 0.2455437E-01 |GRAD(Rho)| 0.3240052E-15 GRAD(Rho)x 0.2332400E-15 GRAD(Rho)y 0.2209756E-15 GRAD(Rho)z -0.4181187E-16 Laplacian 0.9214155E-01 (-1/4)Del**2(Rho)) -0.2303539E-01 Diamond 0.1071121E-01 Metallicity 0.1551335E+01 Ellipticity -0.2790257E+01 Gb(Abramov) 0.2131286E-01 Vb(Abramov) -0.1959033E-01 Hb(Abramov) 0.1722528E-02 Ex_ueg -0.5270965E-02 Ec_ueg -0.1066304E-02 Delta_ex -0.5586990E-02 Delta_ec 0.1355987E-02 Delta_et -0.1196769E-01 Pxc 0.4943212E+01 Qxc -0.4120239E+01 3,+1 122 3 -1 1.748494 0.815690 -1.602846 Rho 0.3431343E-01 |GRAD(Rho)| 0.2087360E-16 GRAD(Rho)x 0.2078344E-16 GRAD(Rho)y -0.5566065E-18 GRAD(Rho)z 0.1856432E-17 Laplacian 0.1311092E+00 (-1/4)Del**2(Rho)) -0.3277731E-01 Diamond 0.3817442E-01 Metallicity 0.1904379E+01 Ellipticity 0.7649607E-01 Gb(Abramov) 0.3225494E-01 Vb(Abramov) -0.3173258E-01 Hb(Abramov) 0.5223642E-03 Ex_ueg -0.8235132E-02 Ec_ueg -0.1568170E-02 Delta_ex -0.9710471E-02 Delta_ec 0.3705101E-02 Delta_et -0.3531320E-01 Pxc 0.5251427E+01 Qxc -0.2620838E+01 3,-1 123 3 +1 2.214548 -0.400644 -1.753173 Rho 0.2095816E-01 |GRAD(Rho)| 0.2296695E-16 GRAD(Rho)x 0.9044240E-17 GRAD(Rho)y -0.2052381E-16 GRAD(Rho)z -0.4945251E-17 Laplacian 0.7690208E-01 (-1/4)Del**2(Rho)) -0.1922552E-01 Diamond 0.6270147E-02 Metallicity 0.1427568E+01 Ellipticity -0.1920553E+01 Gb(Abramov) 0.1739130E-01 Vb(Abramov) -0.1555709E-01 Hb(Abramov) 0.1834217E-02 Ex_ueg -0.4267653E-02 Ec_ueg -0.8874499E-03 Delta_ex -0.4341339E-02 Delta_ec 0.9072425E-03 Delta_et -0.7803242E-02 Pxc 0.4808895E+01 Qxc -0.4785202E+01 3,+1 124 3 -1 1.734037 0.813971 1.623763 Rho 0.3289858E-01 |GRAD(Rho)| 0.3923377E-16 GRAD(Rho)x 0.2394933E-16 GRAD(Rho)y 0.3093206E-16 GRAD(Rho)z 0.2987644E-17 Laplacian 0.1243429E+00 (-1/4)Del**2(Rho)) -0.3108574E-01 Diamond 0.3393361E-01 Metallicity 0.1871920E+01 Ellipticity 0.6072568E-01 Gb(Abramov) 0.3042216E-01 Vb(Abramov) -0.2975859E-01 Hb(Abramov) 0.6635753E-03 Ex_ueg -0.7785527E-02 Ec_ueg -0.1494066E-02 Delta_ex -0.9094755E-02 Delta_ec 0.3480529E-02 Delta_et -0.3279541E-01 Pxc 0.5210966E+01 Qxc -0.2613038E+01 3,-1 125 3 -1 0.856146 0.725601 -3.505298 Rho 0.1383396E+00 |GRAD(Rho)| 0.1708279E-14 GRAD(Rho)x -0.9917468E-15 GRAD(Rho)y 0.1273951E-14 GRAD(Rho)z -0.5583040E-15 Laplacian 0.5385216E+00 (-1/4)Del**2(Rho)) -0.1346304E+00 Diamond 0.9882534E+00 Metallicity 0.4735009E+01 Ellipticity 0.5059354E-01 Gb(Abramov) 0.1959996E+00 Vb(Abramov) -0.2573689E+00 Hb(Abramov) -0.6136923E-01 Ex_ueg -0.5284214E-01 Ec_ueg -0.7701311E-02 Delta_ex -0.5667730E-01 Delta_ec 0.1389871E-01 Delta_et -0.1827673E+00 Pxc 0.6861447E+01 Qxc -0.4077883E+01 3,-1 126 3 +1 2.190879 -0.286673 1.732669 Rho 0.2239128E-01 |GRAD(Rho)| 0.5155607E-13 GRAD(Rho)x -0.1254224E-13 GRAD(Rho)y -0.4973346E-13 GRAD(Rho)z -0.5225236E-14 Laplacian 0.8483755E-01 (-1/4)Del**2(Rho)) -0.2120939E-01 Diamond 0.8962402E-02 Metallicity 0.1444852E+01 Ellipticity -0.2732606E+01 Gb(Abramov) 0.1924700E-01 Vb(Abramov) -0.1728460E-01 Hb(Abramov) 0.1962393E-02 Ex_ueg -0.4661120E-02 Ec_ueg -0.9582879E-03 Delta_ex -0.5051957E-02 Delta_ec 0.1311109E-02 Delta_et -0.1130227E-01 Pxc 0.4864008E+01 Qxc -0.3853192E+01 3,+1 127 3 -1 1.729076 -0.975944 1.614791 Rho 0.3764768E-01 |GRAD(Rho)| 0.5418641E-16 GRAD(Rho)x -0.2202286E-16 GRAD(Rho)y 0.4846574E-16 GRAD(Rho)z -0.1011103E-16 Laplacian 0.1429704E+00 (-1/4)Del**2(Rho)) -0.3574261E-01 Diamond 0.4836395E-01 Metallicity 0.2038280E+01 Ellipticity 0.8941149E-01 Gb(Abramov) 0.3597065E-01 Vb(Abramov) -0.3619869E-01 Hb(Abramov) -0.2280394E-03 Ex_ueg -0.9319000E-02 Ec_ueg -0.1744424E-02 Delta_ex -0.1090744E-01 Delta_ec 0.4165661E-02 Delta_et -0.4071825E-01 Pxc 0.5342163E+01 Qxc -0.2618417E+01 3,-1 128 3 +1 1.489572 -0.931682 -2.226460 Rho 0.2495454E-01 |GRAD(Rho)| 0.6036186E-16 GRAD(Rho)x 0.3256502E-16 GRAD(Rho)y -0.4912382E-16 GRAD(Rho)z -0.1303551E-16 Laplacian 0.9595140E-01 (-1/4)Del**2(Rho)) -0.2398785E-01 Diamond 0.9951190E-02 Metallicity 0.1530421E+01 Ellipticity -0.1961551E+01 Gb(Abramov) 0.2211049E-01 Vb(Abramov) -0.2023312E-01 Hb(Abramov) 0.1877363E-02 Ex_ueg -0.5385810E-02 Ec_ueg -0.1086425E-02 Delta_ex -0.5685313E-02 Delta_ec 0.1129300E-02 Delta_et -0.1008046E-01 Pxc 0.4957368E+01 Qxc -0.5034369E+01 3,+1 129 3 -1 1.719301 -0.997399 -1.594856 Rho 0.3640202E-01 |GRAD(Rho)| 0.1194676E-13 GRAD(Rho)x 0.8236528E-14 GRAD(Rho)y -0.3216269E-14 GRAD(Rho)z -0.8033697E-14 Laplacian 0.1518673E+00 (-1/4)Del**2(Rho)) -0.3796682E-01 Diamond 0.5433433E-01 Metallicity 0.1814226E+01 Ellipticity 0.1640612E-01 Gb(Abramov) 0.3679128E-01 Vb(Abramov) -0.3561574E-01 Hb(Abramov) 0.1175543E-02 Ex_ueg -0.8910163E-02 Ec_ueg -0.1678318E-02 Delta_ex -0.1183618E-01 Delta_ec 0.5043696E-02 Delta_et -0.4888849E-01 Pxc 0.5308983E+01 Qxc -0.2346727E+01 3,-1 130 3 +1 1.346088 -0.783265 2.346865 Rho 0.2733004E-01 |GRAD(Rho)| 0.1329134E-14 GRAD(Rho)x 0.8533487E-15 GRAD(Rho)y -0.9150476E-15 GRAD(Rho)z 0.4484204E-15 Laplacian 0.1091472E+00 (-1/4)Del**2(Rho)) -0.2728679E-01 Diamond 0.1810123E-01 Metallicity 0.1565554E+01 Ellipticity -0.2932699E+02 Gb(Abramov) 0.2531101E-01 Vb(Abramov) -0.2333524E-01 Hb(Abramov) 0.1975775E-02 Ex_ueg -0.6080026E-02 Ec_ueg -0.1206729E-02 Delta_ex -0.7141573E-02 Delta_ec 0.2189996E-02 Delta_et -0.1969828E-01 Pxc 0.5038436E+01 Qxc -0.3260998E+01 3,+1 131 3 -1 1.832755 2.369997 -1.590070 Rho 0.1483631E+00 |GRAD(Rho)| 0.2748381E-13 GRAD(Rho)x 0.2379916E-13 GRAD(Rho)y -0.2737068E-14 GRAD(Rho)z 0.1347102E-13 Laplacian 0.6211430E+00 (-1/4)Del**2(Rho)) -0.1552857E+00 Diamond 0.1230322E+01 Metallicity 0.4612802E+01 Ellipticity 0.1097181E-01 Gb(Abramov) 0.2229076E+00 Vb(Abramov) -0.2905294E+00 Hb(Abramov) -0.6762182E-01 Ex_ueg -0.5800779E-01 Ec_ueg -0.8338812E-02 Delta_ex -0.6640463E-01 Delta_ec 0.1558723E-01 Delta_et -0.2066888E+00 Pxc 0.6956361E+01 Qxc -0.4260195E+01 3,-1 132 3 +1 1.787894 2.533021 -0.012187 Rho 0.1204693E-01 |GRAD(Rho)| 0.1349247E-16 GRAD(Rho)x -0.1197376E-16 GRAD(Rho)y 0.6141771E-17 GRAD(Rho)z 0.9769375E-18 Laplacian 0.5850697E-01 (-1/4)Del**2(Rho)) -0.1462674E-01 Diamond 0.2275262E-02 Metallicity 0.7456458E+00 Ellipticity -0.1249506E+01 Gb(Abramov) 0.1156889E-01 Vb(Abramov) -0.8511037E-02 Hb(Abramov) 0.3057853E-02 Ex_ueg -0.2039639E-02 Ec_ueg -0.4617357E-03 Delta_ex -0.2855350E-02 Delta_ec 0.7174838E-03 Delta_et -0.5417230E-02 Pxc 0.4417331E+01 Qxc -0.3979672E+01 3,+1 133 3 -1 1.850890 2.394120 1.590918 Rho 0.1455796E+00 |GRAD(Rho)| 0.4377296E-09 GRAD(Rho)x -0.3165785E-09 GRAD(Rho)y 0.2683307E-09 GRAD(Rho)z -0.1392260E-09 Laplacian 0.6058886E+00 (-1/4)Del**2(Rho)) -0.1514722E+00 Diamond 0.1173786E+01 Metallicity 0.4581996E+01 Ellipticity 0.1132162E-01 Gb(Abramov) 0.2166556E+00 Vb(Abramov) -0.2818390E+00 Hb(Abramov) -0.6518342E-01 Ex_ueg -0.5656128E-01 Ec_ueg -0.8161150E-02 Delta_ex -0.6447991E-01 Delta_ec 0.1528860E-01 Delta_et -0.2022229E+00 Pxc 0.6930553E+01 Qxc -0.4217516E+01 3,-1 134 3 -1 2.029854 -2.635167 1.774821 Rho 0.2263077E+00 |GRAD(Rho)| 0.6429402E-14 GRAD(Rho)x 0.1373359E-14 GRAD(Rho)y -0.4878097E-14 GRAD(Rho)z -0.3956674E-14 Laplacian 0.8704102E+00 (-1/4)Del**2(Rho)) -0.2176025E+00 Diamond 0.2848676E+01 Metallicity 0.6653571E+01 Ellipticity 0.2582686E-02 Gb(Abramov) 0.3863740E+00 Vb(Abramov) -0.5551455E+00 Hb(Abramov) -0.1687715E+00 Ex_ueg -0.1018554E+00 Ec_ueg -0.1349774E-01 Delta_ex -0.1034544E+00 Delta_ec 0.1935959E-01 Delta_et -0.2666804E+00 Pxc 0.7546109E+01 Qxc -0.5343833E+01 3,-1 135 3 -1 2.814841 -1.757223 0.918548 Rho 0.1521798E+00 |GRAD(Rho)| 0.4268913E-14 GRAD(Rho)x -0.6729372E-15 GRAD(Rho)y -0.2948691E-15 GRAD(Rho)z 0.4205214E-14 Laplacian 0.6177133E+00 (-1/4)Del**2(Rho)) -0.1544283E+00 Diamond 0.1271034E+01 Metallicity 0.4838987E+01 Ellipticity 0.9914313E-02 Gb(Abramov) 0.2274983E+00 Vb(Abramov) -0.3005683E+00 Hb(Abramov) -0.7307001E-01 Ex_ueg -0.6000595E-01 Ec_ueg -0.8583197E-02 Delta_ex -0.6654667E-01 Delta_ec 0.1557051E-01 Delta_et -0.2075784E+00 Pxc 0.6991096E+01 Qxc -0.4273890E+01 3,-1 136 3 -1 2.014601 -2.705964 -1.764211 Rho 0.2025982E+00 |GRAD(Rho)| 0.1273380E-13 GRAD(Rho)x -0.1174923E-13 GRAD(Rho)y 0.1138412E-16 GRAD(Rho)z 0.4909715E-14 Laplacian 0.7881247E+00 (-1/4)Del**2(Rho)) -0.1970312E+00 Diamond 0.2270309E+01 Metallicity 0.6110513E+01 Ellipticity 0.7726432E-02 Gb(Abramov) 0.3320143E+00 Vb(Abramov) -0.4669975E+00 Hb(Abramov) -0.1349832E+00 Ex_ueg -0.8788186E-01 Ec_ueg -0.1189208E-01 Delta_ex -0.9111822E-01 Delta_ec 0.1823529E-01 Delta_et -0.2500859E+00 Pxc 0.7389950E+01 Qxc -0.4996807E+01 3,-1 137 3 +3 1.972726 -0.024652 -2.713622 Rho 0.1119030E-01 |GRAD(Rho)| 0.4565154E-14 GRAD(Rho)x -0.2670764E-14 GRAD(Rho)y -0.6276386E-15 GRAD(Rho)z 0.3648797E-14 Laplacian 0.5033997E-01 (-1/4)Del**2(Rho)) -0.1258499E-01 Diamond 0.1168459E-02 Metallicity 0.7663659E+00 Ellipticity -0.7821385E+00 Gb(Abramov) 0.9997447E-02 Vb(Abramov) -0.7409901E-02 Hb(Abramov) 0.2587546E-02 Ex_ueg -0.1848590E-02 Ec_ueg -0.4223205E-03 Delta_ex -0.2218610E-02 Delta_ec 0.2771098E-03 Delta_et -0.2342055E-02 Pxc 0.4377220E+01 Qxc -0.8006247E+01 3,+3 138 3 -1 2.011351 1.546766 -2.722584 Rho 0.1263655E+00 |GRAD(Rho)| 0.8954466E-16 GRAD(Rho)x 0.8146424E-16 GRAD(Rho)y 0.1657813E-16 GRAD(Rho)z 0.3327145E-16 Laplacian 0.4893704E+00 (-1/4)Del**2(Rho)) -0.1223426E+00 Diamond 0.8094003E+00 Metallicity 0.4480810E+01 Ellipticity 0.2842262E-01 Gb(Abramov) 0.1729274E+00 Vb(Abramov) -0.2235122E+00 Hb(Abramov) -0.5058479E-01 Ex_ueg -0.4683349E-01 Ec_ueg -0.6948212E-02 Delta_ex -0.5043805E-01 Delta_ec 0.1299520E-01 Delta_et -0.1685991E+00 Pxc 0.6740367E+01 Qxc -0.3881284E+01 3,-1 139 3 -1 2.034893 1.577024 2.747231 Rho 0.1549984E+00 |GRAD(Rho)| 0.1866912E-15 GRAD(Rho)x 0.1742313E-15 GRAD(Rho)y 0.1492811E-16 GRAD(Rho)z 0.6537739E-16 Laplacian 0.6006315E+00 (-1/4)Del**2(Rho)) -0.1501579E+00 Diamond 0.1264508E+01 Metallicity 0.5131180E+01 Ellipticity 0.3085279E-01 Gb(Abramov) 0.2285197E+00 Vb(Abramov) -0.3068816E+00 Hb(Abramov) -0.7836188E-01 Ex_ueg -0.6149240E-01 Ec_ueg -0.8764249E-02 Delta_ex -0.6501038E-01 Delta_ec 0.1508886E-01 Delta_et -0.2016980E+00 Pxc 0.7016277E+01 Qxc -0.4308500E+01 3,-1 140 3 -1 3.025535 -0.830814 -2.021953 Rho 0.6372257E-01 |GRAD(Rho)| 0.1831776E-15 GRAD(Rho)x 0.6198502E-16 GRAD(Rho)y 0.1723644E-15 GRAD(Rho)z -0.1541600E-17 Laplacian 0.2687882E+00 (-1/4)Del**2(Rho)) -0.6719705E-01 Diamond 0.1987855E+00 Metallicity 0.2606304E+01 Ellipticity 0.4241417E-02 Gb(Abramov) 0.7398736E-01 Vb(Abramov) -0.8077767E-01 Hb(Abramov) -0.6790311E-02 Ex_ueg -0.1879791E-01 Ec_ueg -0.3186382E-02 Delta_ex -0.2382090E-01 Delta_ec 0.8512688E-02 Delta_et -0.9578013E-01 Pxc 0.5899452E+01 Qxc -0.2798281E+01 3,-1 141 3 +3 1.937477 0.022357 2.680300 Rho 0.1133590E-01 |GRAD(Rho)| 0.5567793E-13 GRAD(Rho)x -0.4900046E-13 GRAD(Rho)y -0.1304050E-14 GRAD(Rho)z 0.2640618E-13 Laplacian 0.5057575E-01 (-1/4)Del**2(Rho)) -0.1264394E-01 Diamond 0.1056226E-02 Metallicity 0.7794070E+00 Ellipticity -0.6600389E+00 Gb(Abramov) 0.1007175E-01 Vb(Abramov) -0.7499570E-02 Hb(Abramov) 0.2572184E-02 Ex_ueg -0.1880730E-02 Ec_ueg -0.4289993E-03 Delta_ex -0.2193959E-02 Delta_ec 0.2010321E-03 Delta_et -0.1846766E-02 Pxc 0.4383993E+01 Qxc -0.1091348E+02 3,+3 142 3 -1 2.801713 -1.778397 -0.853763 Rho 0.1133247E+00 |GRAD(Rho)| 0.3768759E-14 GRAD(Rho)x -0.4785906E-15 GRAD(Rho)y -0.4564593E-15 GRAD(Rho)z -0.3710275E-14 Laplacian 0.4885456E+00 (-1/4)Del**2(Rho)) -0.1221364E+00 Diamond 0.7307879E+00 Metallicity 0.3743249E+01 Ellipticity 0.4966291E-02 Gb(Abramov) 0.1576221E+00 Vb(Abramov) -0.1931078E+00 Hb(Abramov) -0.3548569E-01 Ex_ueg -0.4050273E-01 Ec_ueg -0.6139052E-02 Delta_ex -0.4938132E-01 Delta_ec 0.1387400E-01 Delta_et -0.1774451E+00 Pxc 0.6597554E+01 Qxc -0.3559270E+01 3,-1 143 3 -1 2.006388 -1.587830 -2.762306 Rho 0.1004316E+00 |GRAD(Rho)| 0.1777964E-14 GRAD(Rho)x -0.1199744E-14 GRAD(Rho)y -0.1192721E-14 GRAD(Rho)z -0.5469800E-15 Laplacian 0.4110842E+00 (-1/4)Del**2(Rho)) -0.1027711E+00 Diamond 0.5336171E+00 Metallicity 0.3637473E+01 Ellipticity 0.1634130E-01 Gb(Abramov) 0.1308185E+00 Vb(Abramov) -0.1588660E+00 Hb(Abramov) -0.2804747E-01 Ex_ueg -0.3447828E-01 Ec_ueg -0.5351205E-02 Delta_ex -0.4043613E-01 Delta_ec 0.1204969E-01 Delta_et -0.1505452E+00 Pxc 0.6443088E+01 Qxc -0.3355781E+01 3,-1 144 3 -1 2.082056 -1.568474 2.750599 Rho 0.1420350E+00 |GRAD(Rho)| 0.3716944E-13 GRAD(Rho)x 0.1998987E-13 GRAD(Rho)y -0.1237221E-13 GRAD(Rho)z -0.2879064E-13 Laplacian 0.5397542E+00 (-1/4)Del**2(Rho)) -0.1349386E+00 Diamond 0.1031132E+01 Metallicity 0.4936389E+01 Ellipticity 0.1775911E-01 Gb(Abramov) 0.2009772E+00 Vb(Abramov) -0.2670159E+00 Hb(Abramov) -0.6603867E-01 Ex_ueg -0.5473253E-01 Ec_ueg -0.7935604E-02 Delta_ex -0.5726691E-01 Delta_ec 0.1400850E-01 Delta_et -0.1852971E+00 Pxc 0.6897084E+01 Qxc -0.4088012E+01 3,-1 145 3 -1 3.033124 -0.821825 2.003168 Rho 0.7749245E-01 |GRAD(Rho)| 0.2534964E-12 GRAD(Rho)x 0.3255828E-13 GRAD(Rho)y -0.2513243E-12 GRAD(Rho)z 0.6041358E-14 Laplacian 0.3086869E+00 (-1/4)Del**2(Rho)) -0.7717171E-01 Diamond 0.2784577E+00 Metallicity 0.3144324E+01 Ellipticity 0.1101021E-01 Gb(Abramov) 0.9188996E-01 Vb(Abramov) -0.1066082E+00 Hb(Abramov) -0.1471824E-01 Ex_ueg -0.2440043E-01 Ec_ueg -0.3983185E-02 Delta_ex -0.2829092E-01 Delta_ec 0.8932702E-02 Delta_et -0.1049733E+00 Pxc 0.6125860E+01 Qxc -0.3167118E+01 3,-1 146 3 -1 3.247236 2.372805 2.247176 Rho 0.2249327E+00 |GRAD(Rho)| 0.4754975E-15 GRAD(Rho)x 0.4433845E-15 GRAD(Rho)y 0.1683224E-15 GRAD(Rho)z -0.3428789E-16 Laplacian 0.8155843E+00 (-1/4)Del**2(Rho)) -0.2038961E+00 Diamond 0.2682719E+01 Metallicity 0.7029082E+01 Ellipticity 0.6528399E-02 Gb(Abramov) 0.3747978E+00 Vb(Abramov) -0.5456994E+00 Hb(Abramov) -0.1709017E+00 Ex_ueg -0.1010311E+00 Ec_ueg -0.1340378E-01 Delta_ex -0.9697604E-01 Delta_ec 0.1851391E-01 Delta_et -0.2563627E+00 Pxc 0.7537512E+01 Qxc -0.5238008E+01 3,-1 147 3 -1 2.835907 1.747265 0.891701 Rho 0.1237819E+00 |GRAD(Rho)| 0.2022731E-15 GRAD(Rho)x 0.1092808E-15 GRAD(Rho)y 0.3080722E-16 GRAD(Rho)z -0.1674008E-15 Laplacian 0.5143514E+00 (-1/4)Del**2(Rho)) -0.1285879E+00 Diamond 0.8265267E+00 Metallicity 0.4118907E+01 Ellipticity 0.1129929E-01 Gb(Abramov) 0.1739988E+00 Vb(Abramov) -0.2194097E+00 Hb(Abramov) -0.4541094E-01 Ex_ueg -0.4556115E-01 Ec_ueg -0.6786968E-02 Delta_ex -0.5270819E-01 Delta_ec 0.1364879E-01 Delta_et -0.1763302E+00 Pxc 0.6713035E+01 Qxc -0.3861747E+01 3,-1 148 3 -1 2.842083 1.745392 -0.880878 Rho 0.1453126E+00 |GRAD(Rho)| 0.5567160E-13 GRAD(Rho)x 0.1241026E-13 GRAD(Rho)y -0.3952949E-13 GRAD(Rho)z -0.3718510E-13 Laplacian 0.5970659E+00 (-1/4)Del**2(Rho)) -0.1492665E+00 Diamond 0.1163312E+01 Metallicity 0.4635497E+01 Ellipticity 0.1828267E-01 Gb(Abramov) 0.2148317E+00 Vb(Abramov) -0.2803969E+00 Hb(Abramov) -0.6556523E-01 Ex_ueg -0.5642299E-01 Ec_ueg -0.8144131E-02 Delta_ex -0.6360760E-01 Delta_ec 0.1524289E-01 Delta_et -0.2019454E+00 Pxc 0.6928055E+01 Qxc -0.4172935E+01 3,-1 149 3 -1 3.385901 -2.295837 -2.265608 Rho 0.1905022E+00 |GRAD(Rho)| 0.1533573E-14 GRAD(Rho)x -0.1405126E-15 GRAD(Rho)y -0.1513411E-14 GRAD(Rho)z -0.2041824E-15 Laplacian 0.7137025E+00 (-1/4)Del**2(Rho)) -0.1784256E+00 Diamond 0.1933290E+01 Metallicity 0.6089701E+01 Ellipticity 0.2352259E-01 Gb(Abramov) 0.3000435E+00 Vb(Abramov) -0.4216614E+00 Hb(Abramov) -0.1216179E+00 Ex_ueg -0.8095650E-01 Ec_ueg -0.1108495E-01 Delta_ex -0.8140184E-01 Delta_ec 0.1710327E-01 Delta_et -0.2343905E+00 Pxc 0.7303281E+01 Qxc -0.4759430E+01 3,-1 150 3 -1 3.389370 -2.271784 2.266185 Rho 0.2173796E+00 |GRAD(Rho)| 0.6044135E-12 GRAD(Rho)x -0.5013644E-12 GRAD(Rho)y 0.2512311E-12 GRAD(Rho)z -0.2254604E-12 Laplacian 0.7913480E+00 (-1/4)Del**2(Rho)) -0.1978370E+00 Diamond 0.2501883E+01 Metallicity 0.6843482E+01 Ellipticity 0.1324407E-01 Gb(Abramov) 0.3575403E+00 Vb(Abramov) -0.5172436E+00 Hb(Abramov) -0.1597033E+00 Ex_ueg -0.9653324E-01 Ec_ueg -0.1288947E-01 Delta_ex -0.9328977E-01 Delta_ec 0.1817878E-01 Delta_et -0.2513724E+00 Pxc 0.7489313E+01 Qxc -0.5131795E+01 3,-1 151 3 -1 3.049184 0.887598 -2.023169 Rho 0.1827371E+00 |GRAD(Rho)| 0.7095739E-13 GRAD(Rho)x 0.4956848E-13 GRAD(Rho)y -0.3068292E-13 GRAD(Rho)z 0.4045337E-13 Laplacian 0.7145921E+00 (-1/4)Del**2(Rho)) -0.1786480E+00 Diamond 0.1816896E+01 Metallicity 0.5674566E+01 Ellipticity 0.3594386E-01 Gb(Abramov) 0.2880570E+00 Vb(Abramov) -0.3974660E+00 Hb(Abramov) -0.1094090E+00 Ex_ueg -0.7658679E-01 Ec_ueg -0.1057116E-01 Delta_ex -0.8046400E-01 Delta_ec 0.1698134E-01 Delta_et -0.2307477E+00 Pxc 0.7244883E+01 Qxc -0.4738377E+01 3,-1 152 3 -1 3.042389 0.878496 2.009377 Rho 0.1755977E+00 |GRAD(Rho)| 0.4768779E-13 GRAD(Rho)x 0.4439390E-13 GRAD(Rho)y -0.1487970E-13 GRAD(Rho)z 0.9049917E-14 Laplacian 0.6897660E+00 (-1/4)Del**2(Rho)) -0.1724415E+00 Diamond 0.1674176E+01 Metallicity 0.5501015E+01 Ellipticity 0.4466382E-01 Gb(Abramov) 0.2730615E+00 Vb(Abramov) -0.3736816E+00 Hb(Abramov) -0.1006200E+00 Ex_ueg -0.7262345E-01 Ec_ueg -0.1010181E-01 Delta_ex -0.7691088E-01 Delta_ec 0.1659937E-01 Delta_et -0.2247466E+00 Pxc 0.7189154E+01 Qxc -0.4633361E+01 3,-1 153 3 -1 3.227188 2.384655 -2.240641 Rho 0.2235066E+00 |GRAD(Rho)| 0.7571005E-15 GRAD(Rho)x -0.6524729E-15 GRAD(Rho)y -0.1215391E-15 GRAD(Rho)z 0.3642919E-15 Laplacian 0.8125589E+00 (-1/4)Del**2(Rho)) -0.2031397E+00 Diamond 0.2650371E+01 Metallicity 0.6980859E+01 Ellipticity 0.1003170E-01 Gb(Abramov) 0.3717748E+00 Vb(Abramov) -0.5404098E+00 Hb(Abramov) -0.1686350E+00 Ex_ueg -0.1001780E+00 Ec_ueg -0.1330643E-01 Delta_ex -0.9644555E-01 Delta_ec 0.1845767E-01 Delta_et -0.2554097E+00 Pxc 0.7528539E+01 Qxc -0.5225229E+01 3,-1 154 3 +1 3.020643 0.036145 -0.150304 Rho 0.4450380E-02 |GRAD(Rho)| 0.3565606E-13 GRAD(Rho)x 0.4754272E-14 GRAD(Rho)y 0.2626619E-13 GRAD(Rho)z -0.2363978E-13 Laplacian 0.1759870E-01 (-1/4)Del**2(Rho)) -0.4399676E-02 Diamond 0.3604593E-03 Metallicity 0.4714775E+00 Ellipticity -0.3385603E+01 Gb(Abramov) 0.3278842E-02 Vb(Abramov) -0.2158008E-02 Hb(Abramov) 0.1120834E-02 Ex_ueg -0.5406479E-03 Ec_ueg -0.1233376E-03 Delta_ex -0.8660298E-03 Delta_ec 0.5725727E-03 Delta_et -0.2995036E-02 Pxc 0.4383479E+01 Qxc -0.1512524E+01 3,+1 155 3 -1 -3.059689 -2.070989 -0.808826 Rho 0.1486837E+00 |GRAD(Rho)| 0.2195315E-15 GRAD(Rho)x 0.5674443E-16 GRAD(Rho)y -0.1661963E-15 GRAD(Rho)z -0.1317306E-15 Laplacian 0.5662217E+00 (-1/4)Del**2(Rho)) -0.1415554E+00 Diamond 0.1145660E+01 Metallicity 0.5078462E+01 Ellipticity 0.6008674E-01 Gb(Abramov) 0.2141843E+00 Vb(Abramov) -0.2868131E+00 Hb(Abramov) -0.7262885E-01 Ex_ueg -0.5817498E-01 Ec_ueg -0.8359305E-02 Delta_ex -0.6077911E-01 Delta_ec 0.1458305E-01 Delta_et -0.1943119E+00 Pxc 0.6959307E+01 Qxc -0.4167790E+01 3,-1 156 3 -1 -3.066140 -2.053459 0.807343 Rho 0.1164209E+00 |GRAD(Rho)| 0.5240946E-15 GRAD(Rho)x -0.2112161E-15 GRAD(Rho)y -0.1434196E-16 GRAD(Rho)z -0.4794342E-15 Laplacian 0.4432024E+00 (-1/4)Del**2(Rho)) -0.1108006E+00 Diamond 0.6692389E+00 Metallicity 0.4315810E+01 Ellipticity 0.2982443E-01 Gb(Abramov) 0.1535661E+00 Vb(Abramov) -0.1963317E+00 Hb(Abramov) -0.4276553E-01 Ex_ueg -0.4198486E-01 Ec_ueg -0.6330083E-02 Delta_ex -0.4486466E-01 Delta_ec 0.1212151E-01 Delta_et -0.1552390E+00 Pxc 0.6632593E+01 Qxc -0.3701245E+01 3,-1 157 3 -1 -3.310637 -2.100611 -2.313088 Rho 0.2179827E+00 |GRAD(Rho)| 0.1044872E-14 GRAD(Rho)x 0.7058698E-15 GRAD(Rho)y 0.1109884E-15 GRAD(Rho)z 0.7623568E-15 Laplacian 0.8146522E+00 (-1/4)Del**2(Rho)) -0.2036631E+00 Diamond 0.2570418E+01 Metallicity 0.6678479E+01 Ellipticity 0.2134809E-01 Gb(Abramov) 0.3624686E+00 Vb(Abramov) -0.5212742E+00 Hb(Abramov) -0.1588056E+00 Ex_ueg -0.9689047E-01 Ec_ueg -0.1293041E-01 Delta_ex -0.9602251E-01 Delta_ec 0.1855106E-01 Delta_et -0.2559920E+00 Pxc 0.7493223E+01 Qxc -0.5176119E+01 3,-1 158 3 -1 -3.349331 -2.128546 2.334582 Rho 0.2171170E+00 |GRAD(Rho)| 0.2552220E-12 GRAD(Rho)x 0.1996705E-12 GRAD(Rho)y 0.4484674E-13 GRAD(Rho)z -0.1525081E-12 Laplacian 0.8015386E+00 (-1/4)Del**2(Rho)) -0.2003847E+00 Diamond 0.2524545E+01 Metallicity 0.6742872E+01 Ellipticity 0.2196532E-01 Gb(Abramov) 0.3587845E+00 Vb(Abramov) -0.5171843E+00 Hb(Abramov) -0.1583998E+00 Ex_ueg -0.9637773E-01 Ec_ueg -0.1287164E-01 Delta_ex -0.9442594E-01 Delta_ec 0.1835536E-01 Delta_et -0.2535494E+00 Pxc 0.7487606E+01 Qxc -0.5144326E+01 3,-1 159 3 -1 -3.062553 2.080297 -0.829222 Rho 0.1602443E+00 |GRAD(Rho)| 0.2158758E-14 GRAD(Rho)x 0.7096374E-15 GRAD(Rho)y -0.2982030E-15 GRAD(Rho)z -0.2016860E-14 Laplacian 0.6176133E+00 (-1/4)Del**2(Rho)) -0.1544033E+00 Diamond 0.1353539E+01 Metallicity 0.5274735E+01 Ellipticity 0.3731788E-01 Gb(Abramov) 0.2386750E+00 Vb(Abramov) -0.3229467E+00 Hb(Abramov) -0.8427167E-01 Ex_ueg -0.6428284E-01 Ec_ueg -0.9102487E-02 Delta_ex -0.6740369E-01 Delta_ec 0.1538978E-01 Delta_et -0.2066226E+00 Pxc 0.7062118E+01 Qxc -0.4379769E+01 3,-1 160 3 -1 -3.052519 2.074492 0.792922 Rho 0.9743306E-01 |GRAD(Rho)| 0.2264920E-15 GRAD(Rho)x -0.1076409E-15 GRAD(Rho)y 0.4103875E-16 GRAD(Rho)z -0.1950073E-15 Laplacian 0.4046562E+00 (-1/4)Del**2(Rho)) -0.1011640E+00 Diamond 0.5038927E+00 Metallicity 0.3513211E+01 Ellipticity 0.1105000E-01 Gb(Abramov) 0.1266778E+00 Vb(Abramov) -0.1521916E+00 Hb(Abramov) -0.2551376E-01 Ex_ueg -0.3311262E-01 Ec_ueg -0.5169820E-02 Delta_ex -0.3948332E-01 Delta_ec 0.1185935E-01 Delta_et -0.1471496E+00 Pxc 0.6404985E+01 Qxc -0.3329299E+01 3,-1 161 3 -1 -3.289956 2.229243 2.342396 Rho 0.1962904E+00 |GRAD(Rho)| 0.1575798E-15 GRAD(Rho)x 0.1574804E-15 GRAD(Rho)y -0.4770490E-17 GRAD(Rho)z 0.2927346E-17 Laplacian 0.7463297E+00 (-1/4)Del**2(Rho)) -0.1865824E+00 Diamond 0.2079103E+01 Metallicity 0.6121353E+01 Ellipticity 0.3643271E-02 Gb(Abramov) 0.3147444E+00 Vb(Abramov) -0.4429064E+00 Hb(Abramov) -0.1281620E+00 Ex_ueg -0.8425268E-01 Ec_ueg -0.1147015E-01 Delta_ex -0.8565672E-01 Delta_ec 0.1753547E-01 Delta_et -0.2402861E+00 Pxc 0.7345385E+01 Qxc -0.4884768E+01 3,-1 162 3 -1 -3.229139 2.215324 -2.346536 Rho 0.2213731E+00 |GRAD(Rho)| 0.4079404E-14 GRAD(Rho)x 0.3018419E-14 GRAD(Rho)y 0.1560682E-14 GRAD(Rho)z 0.2257201E-14 Laplacian 0.8194790E+00 (-1/4)Del**2(Rho)) -0.2048697E+00 Diamond 0.2630510E+01 Metallicity 0.6812139E+01 Ellipticity 0.5377909E-02 Gb(Abramov) 0.3691800E+00 Vb(Abramov) -0.5334903E+00 Hb(Abramov) -0.1643103E+00 Ex_ueg -0.9890500E-01 Ec_ueg -0.1316100E-01 Delta_ex -0.9695619E-01 Delta_ec 0.1854127E-01 Delta_et -0.2559348E+00 Pxc 0.7515005E+01 Qxc -0.5229209E+01 3,-1 163 3 -1 -0.561323 -0.686045 -3.198637 Rho 0.1424234E+00 |GRAD(Rho)| 0.3486921E-13 GRAD(Rho)x -0.2571714E-14 GRAD(Rho)y -0.9294554E-14 GRAD(Rho)z 0.3350910E-13 Laplacian 0.5959394E+00 (-1/4)Del**2(Rho)) -0.1489848E+00 Diamond 0.1127224E+01 Metallicity 0.4491383E+01 Ellipticity 0.1691985E-01 Gb(Abramov) 0.2108479E+00 Vb(Abramov) -0.2727110E+00 Hb(Abramov) -0.6186306E-01 Ex_ueg -0.5493220E-01 Ec_ueg -0.7960282E-02 Delta_ex -0.6311020E-01 Delta_ec 0.1517087E-01 Delta_et -0.2001499E+00 Pxc 0.6900785E+01 Qxc -0.4159959E+01 3,-1 164 3 -1 -0.576152 -0.762622 -0.009416 Rho 0.1844685E+00 |GRAD(Rho)| 0.2228085E-14 GRAD(Rho)x 0.1137979E-14 GRAD(Rho)y 0.1915135E-14 GRAD(Rho)z -0.4033232E-16 Laplacian 0.4804236E+00 (-1/4)Del**2(Rho)) -0.1201059E+00 Diamond 0.1259018E+01 Metallicity 0.8574181E+01 Ellipticity 0.2780881E-01 Gb(Abramov) 0.2517055E+00 Vb(Abramov) -0.3833052E+00 Hb(Abramov) -0.1315996E+00 Ex_ueg -0.7755588E-01 Ec_ueg -0.1068542E-01 Delta_ex -0.5440393E-01 Delta_ec 0.1170642E-01 Delta_et -0.1602128E+00 Pxc 0.7258100E+01 Qxc -0.4647360E+01 3,-1 165 3 -1 0.499414 -0.051540 2.438753 Rho 0.4752350E-01 |GRAD(Rho)| 0.2871211E-13 GRAD(Rho)x -0.6431031E-14 GRAD(Rho)y -0.4730065E-14 GRAD(Rho)z 0.2757995E-13 Laplacian 0.2003716E+00 (-1/4)Del**2(Rho)) -0.5009289E-01 Diamond 0.1018302E+00 Metallicity 0.2144328E+01 Ellipticity 0.1649269E-01 Gb(Abramov) 0.5129785E-01 Vb(Abramov) -0.5250282E-01 Hb(Abramov) -0.1204967E-02 Ex_ueg -0.1271344E-01 Ec_ueg -0.2278447E-02 Delta_ex -0.1660828E-01 Delta_ec 0.6551757E-02 Delta_et -0.6831337E-01 Pxc 0.5579871E+01 Qxc -0.2534935E+01 3,-1 166 3 -1 0.578452 3.276181 0.695650 Rho 0.1185375E+00 |GRAD(Rho)| 0.5209845E-11 GRAD(Rho)x -0.2615404E-12 GRAD(Rho)y 0.5125457E-11 GRAD(Rho)z -0.8965326E-12 Laplacian 0.5086097E+00 (-1/4)Del**2(Rho)) -0.1271524E+00 Diamond 0.8042964E+00 Metallicity 0.3875444E+01 Ellipticity 0.1352659E-01 Gb(Abramov) 0.1668970E+00 Vb(Abramov) -0.2066415E+00 Hb(Abramov) -0.3974454E-01 Ex_ueg -0.4300571E-01 Ec_ueg -0.6461071E-02 Delta_ex -0.5197149E-01 Delta_ec 0.1432658E-01 Delta_et -0.1848290E+00 Pxc 0.6656127E+01 Qxc -0.3627628E+01 3,-1 167 3 -1 0.556587 3.253534 -0.712769 Rho 0.1164326E+00 |GRAD(Rho)| 0.2335835E-12 GRAD(Rho)x 0.1385945E-12 GRAD(Rho)y -0.1251604E-12 GRAD(Rho)z -0.1403129E-12 Laplacian 0.5013236E+00 (-1/4)Del**2(Rho)) -0.1253309E+00 Diamond 0.7754744E+00 Metallicity 0.3816097E+01 Ellipticity 0.1578412E-01 Gb(Abramov) 0.1632664E+00 Vb(Abramov) -0.2012019E+00 Hb(Abramov) -0.3793552E-01 Ex_ueg -0.4199052E-01 Ec_ueg -0.6330810E-02 Delta_ex -0.5100605E-01 Delta_ec 0.1416903E-01 Delta_et -0.1821736E+00 Pxc 0.6632725E+01 Qxc -0.3599827E+01 3,-1 168 3 -1 0.918973 -0.700187 3.546238 Rho 0.1131498E+00 |GRAD(Rho)| 0.3307952E-15 GRAD(Rho)x -0.2236709E-15 GRAD(Rho)y 0.2348653E-15 GRAD(Rho)z -0.6507754E-16 Laplacian 0.4702573E+00 (-1/4)Del**2(Rho)) -0.1175643E+00 Diamond 0.6956522E+00 Metallicity 0.3878829E+01 Ellipticity 0.3905479E-01 Gb(Abramov) 0.1543782E+00 Vb(Abramov) -0.1911921E+00 Hb(Abramov) -0.3681389E-01 Ex_ueg -0.4041943E-01 Ec_ueg -0.6128285E-02 Delta_ex -0.4742168E-01 Delta_ec 0.1319162E-01 Delta_et -0.1684280E+00 Pxc 0.6595553E+01 Qxc -0.3594834E+01 3,-1 169 3 -1 0.408739 -0.095154 -0.666057 Rho 0.1758786E+00 |GRAD(Rho)| 0.1141233E-13 GRAD(Rho)x -0.6848688E-14 GRAD(Rho)y -0.1192622E-15 GRAD(Rho)z 0.9128115E-14 Laplacian 0.4465433E+00 (-1/4)Del**2(Rho)) -0.1116358E+00 Diamond 0.1121236E+01 Metallicity 0.8519968E+01 Ellipticity 0.1367071E-02 Gb(Abramov) 0.2329462E+00 Vb(Abramov) -0.3542565E+00 Hb(Abramov) -0.1213104E+00 Ex_ueg -0.7277839E-01 Ec_ueg -0.1012022E-01 Delta_ex -0.5009543E-01 Delta_ec 0.1124969E-01 Delta_et -0.1538281E+00 Pxc 0.7191385E+01 Qxc -0.4453049E+01 3,-1 170 3 -1 0.875010 0.748304 3.535322 Rho 0.1061092E+00 |GRAD(Rho)| 0.3637170E-13 GRAD(Rho)x 0.3499731E-13 GRAD(Rho)y -0.7168528E-14 GRAD(Rho)z 0.6833814E-14 Laplacian 0.4364277E+00 (-1/4)Del**2(Rho)) -0.1091069E+00 Diamond 0.6018292E+00 Metallicity 0.3755109E+01 Ellipticity 0.1548346E-01 Gb(Abramov) 0.1410227E+00 Vb(Abramov) -0.1729384E+00 Hb(Abramov) -0.3191576E-01 Ex_ueg -0.3710130E-01 Ec_ueg -0.5696588E-02 Delta_ex -0.4342195E-01 Delta_ec 0.1254084E-01 Delta_et -0.1583092E+00 Pxc 0.6512898E+01 Qxc -0.3462443E+01 3,-1 171 3 -1 1.299042 -0.749137 2.384703 Rho 0.2733222E-01 |GRAD(Rho)| 0.5221035E-16 GRAD(Rho)x -0.1299982E-16 GRAD(Rho)y 0.3246813E-16 GRAD(Rho)z -0.3876526E-16 Laplacian 0.1106935E+00 (-1/4)Del**2(Rho)) -0.2767337E-01 Diamond 0.1896059E-01 Metallicity 0.1543889E+01 Ellipticity 0.3498845E+02 Gb(Abramov) 0.2556968E-01 Vb(Abramov) -0.2346599E-01 Hb(Abramov) 0.2103690E-02 Ex_ueg -0.6080672E-02 Ec_ueg -0.1206840E-02 Delta_ex -0.7300845E-02 Delta_ec 0.2324475E-02 Delta_et -0.2089379E-01 Pxc 0.5038508E+01 Qxc -0.3140857E+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 75 165 103 109 170 168 110 113 164 169 102 117 163 104 106 125 111 99 166 167 97 105 114 127 135 134 145 144 150 122 148 131 151 138 153 90 65 76 159 60 162 54 67 75 156 85 158 56 68 73 155 84 157 78 64 79 160 83 161 124 147 133 152 139 146 129 142 136 140 143 149 171 61 101 89 58 1 1 1 1 1 1 2 2 2 2 3 3 3 3 3 3 4 4 4 4 4 4 5 5 5 5 5 5 6 6 6 6 6 6 7 7 7 7 7 7 8 8 8 8 8 8 9 9 9 9 9 9 10 10 10 10 10 10 11 11 11 11 11 11 12 12 12 12 12 12 13 17 21 25 28 13 24 26 33 39 41 13 14 15 16 15 23 25 34 40 43 16 22 27 35 38 44 13 18 28 29 39 45 15 20 27 31 40 46 16 19 25 32 38 47 14 17 26 30 37 48 14 19 23 30 36 49 16 17 24 32 35 50 13 20 22 29 33 51 15 18 21 31 34 42 39 19 36 27 37 2.381712 1.964999 2.002648 2.054054 2.030141 1.811174 1.720348 1.702391 1.724423 1.728136 2.336215 1.933535 1.929100 1.910594 1.957100 1.768305 2.422591 2.002180 2.009765 1.969857 2.014443 1.816097 2.487756 1.910776 1.765280 2.191209 1.949523 1.781670 2.530646 1.927080 1.921565 1.849522 1.993043 1.770597 2.405664 1.851501 1.993500 1.900397 1.960171 1.773914 2.382073 2.037616 1.930101 2.026657 1.786443 1.781949 2.316292 2.134831 1.984999 1.929172 1.772706 1.780166 2.428995 1.931459 1.975617 2.088123 2.030234 1.820104 2.550954 1.989674 1.928644 1.863642 1.912087 1.768172 2.485886 2.015833 1.807802 2.263800 2.075813 1.832477 2.563863 3.175894 3.473009 3.191494 3.515398 2.384005 1.965205 2.003001 2.054304 2.030425 1.811182 1.720378 1.702469 1.724457 1.728144 2.337916 1.934008 1.929628 1.911071 1.957623 1.768313 2.424779 2.002450 2.010036 1.970106 2.014736 1.816104 2.489371 1.911094 1.765316 2.191626 1.950028 1.781697 2.532071 1.927531 1.921962 1.849880 1.993528 1.770602 2.407308 1.851860 1.993845 1.900758 1.960661 1.773927 2.384372 2.037852 1.930416 2.027121 1.786533 1.781967 2.318655 2.135184 1.985429 1.929726 1.772739 1.780184 2.430697 1.931715 1.975757 2.088362 2.030475 1.820114 2.552409 1.990116 1.929062 1.864083 1.912495 1.768175 2.488202 2.016138 1.807835 2.264052 2.076061 1.832489 2.569746 3.183363 3.473588 3.193677 3.516078 29 28 30 27 25 28 23 24 24 21 28 27 26 27 25 23 31 26 27 28 28 25 29 25 24 26 25 23 29 25 26 24 27 24 30 25 26 25 27 24 31 26 27 25 26 24 30 28 27 26 25 24 30 27 27 25 27 27 29 27 26 23 25 23 29 25 23 26 25 27 29 35 37 37 37 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 Ta As W Ta W W W W W Ta W Ta O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O 2.1565 2.4158 2.3960 2.1657 2.2881 2.3607 2.3750 2.3030 2.3339 2.1287 2.3596 1.9999 -1.0901 -1.0118 -1.1018 -1.0991 -1.0084 -1.0169 -0.9519 -0.9863 -0.9462 -0.9968 -0.9865 -1.0257 -0.9733 -1.0103 -0.9914 -0.8374 -0.9848 -1.0231 -0.9736 -1.0155 -1.0143 -1.0150 -1.0592 -0.8667 -0.8824 -1.0337 -1.0415 -1.0070 -0.9804 -1.0216 -0.8841 -0.9941 -0.9248 -0.8994 -0.9052 -0.9192 -0.9070 -1.0024 -0.8936 2.1204 0.8646 2.1129 2.1146 2.1514 2.1194 2.1140 2.1500 2.1419 2.1245 2.1216 2.1553 1.9396 1.9475 1.9387 1.9325 1.9247 1.9253 1.9342 1.9258 1.9354 1.9246 1.9266 1.9207 1.9274 1.9237 1.9256 1.9522 1.9368 1.9323 1.9392 1.9329 1.9309 1.9324 1.9255 1.9456 1.9428 1.9298 1.9291 1.9319 1.9346 1.9288 1.9497 1.9324 1.9449 1.9484 1.9468 1.9428 1.9442 1.9317 1.9494 6.0940 1.1794 6.1029 6.0792 6.1263 6.1103 6.1009 6.1208 6.1029 6.0905 6.1132 6.1070 5.1160 5.0283 5.1278 5.1321 5.0593 5.0655 4.9887 5.0324 4.9852 5.0463 5.0321 5.0807 5.0179 5.0607 5.0395 4.8531 5.0204 5.0617 5.0072 5.0547 5.0556 5.0553 5.1097 4.8913 4.9115 5.0776 5.0862 5.0461 5.0216 5.0706 4.9039 5.0380 4.9511 4.9207 4.9288 4.9477 4.9338 5.0475 4.9136 2.5943 10.5402 3.3582 2.6054 3.4055 3.3799 3.3800 3.3967 3.3921 2.6213 3.3761 2.7053 0.0345 0.0360 0.0353 0.0345 0.0244 0.0261 0.0290 0.0281 0.0255 0.0259 0.0278 0.0243 0.0281 0.0260 0.0262 0.0320 0.0277 0.0291 0.0272 0.0278 0.0279 0.0273 0.0240 0.0297 0.0281 0.0263 0.0263 0.0290 0.0242 0.0222 0.0305 0.0237 0.0288 0.0303 0.0296 0.0287 0.0290 0.0232 0.0306 14.0348 0.0000 14.0300 14.0351 14.0287 14.0297 14.0301 14.0294 14.0292 14.0350 14.0296 14.0325 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 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5.44216909 -24.42201005 28.15186978 29.18074113 18.88377855 -16.88302586 5.53823150 -356.6167 412.5214 51.2316 -431.1678 -143.7679 -467.7993 Jun19-2024 22:04:55 Nodes: 1 Procs: 1 Jun19-2024 22:04:58 Nodes: 1 Procs: 1 0 Jun19-2024 22:05:01 Nodes: 1 Procs: 1 Jun19-2024 22:05:04 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun19-2024 22:05:09 Nodes: 1 Procs: 1 Jun19-2024 22:05:10 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun19-2024 22:05:13 Nodes: 1 Procs: 1 Jun19-2024 22:05:16 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Jun19-2024 22:05:21 Nodes: 1 Procs: 5 *** (NO TITLE) *** -11 -16.71742527 -17.02952636 -17.06965356 -17.01220437 -17.10899808 -17.15779413 -17.17287630 -17.17762523 -17.18451239 -17.18697943 -17.18895082 -17.18988350 -17.19060070 -17.19109179 -17.19125716 -17.19132226 -17.19132055 -17.19131091 -17.19131004 GEOMETRY CONVERGED