ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:06:50 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.50 0.05 3.67 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 Jun20-2024 06:06:50 Nodes: 1 Procs: 1 Jun20-2024 06:06:54 Nodes: 1 Procs: 1 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:06:58 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.68 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 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 Jun20-2024 06:06:50 Nodes: 1 Procs: 1 Jun20-2024 06:06:54 Nodes: 1 Procs: 1 0 Jun20-2024 06:06:58 Nodes: 1 Procs: 1 Jun20-2024 06:07:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:07:06 Arsenic (TZP, 3p frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.00 0.04 1.58 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 Jun20-2024 06:06:50 Nodes: 1 Procs: 1 Jun20-2024 06:06:54 Nodes: 1 Procs: 1 0 Jun20-2024 06:06:58 Nodes: 1 Procs: 1 Jun20-2024 06:07:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 06:07:06 Nodes: 1 Procs: 1 Jun20-2024 06:07:08 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:07:10 Arsenic (TZP, 3p frozen) c5-25 c5-25 c5-25 c5-25 c5-25 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.67 0.07 3.46 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 Jun20-2024 06:06:50 Nodes: 1 Procs: 1 Jun20-2024 06:06:54 Nodes: 1 Procs: 1 0 Jun20-2024 06:06:58 Nodes: 1 Procs: 1 Jun20-2024 06:07:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 06:07:06 Nodes: 1 Procs: 1 Jun20-2024 06:07:08 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun20-2024 06:07:10 Nodes: 1 Procs: 1 Jun20-2024 06:07:13 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:07:19 Arsenic (TZP, 3p frozen) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP 2706.6777000000056 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PW92 == Not Default == Restricted Restricted Point Charge Nuclei Frozen Orbital(s) 3 1 1.93000 78.39000 conjugate-gradient 1000 1.0E-08 0.00000 t21.Ta ADF 2019.304 Jun20-2024 06:07:01 1 1 Tantalum TZP 4d t21.As ADF 2019.304 Jun20-2024 06:06:54 1 1 Arsenic TZP 3p t21.W ADF 2019.304 Jun20-2024 06:07:13 1 1 Tungsten TZP 4d t21.O ADF 2019.304 Jun20-2024 06:07:08 1 1 Oxygen TZP 1s 1 1 -16.79562571 0.34847476 0.00100000 F 0.09384092 0.00066667 F 0.34847476 0.09384092 0.29991189 0.01000000 F 0.06459411 0.00666667 F Cartesian 2706.6777000000056 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-2.485891 -3.856587 2.608915 -2.849698 -3.980546 -2.188139 2.874469 -4.097839 -2.309538 -2.866199 -3.755160 2.581825 2.866196 3.748066 2.965679 2.502548 1 3 -3 0.126391 -0.035022 3.576919 Rho 0.3882646E+07 3,-3 2 3 -3 0.068534 -0.032144 -3.603593 Rho 0.3882647E+07 3,-3 3 3 -3 2.582313 -1.923606 1.907131 Rho 0.3882647E+07 3,-3 4 3 -3 -2.593788 1.848421 -1.764547 Rho 0.3882647E+07 3,-3 5 3 -3 -2.630488 -2.072623 -1.782086 Rho 0.3882647E+07 3,-3 6 3 -3 -0.082010 -0.125357 0.014839 Rho 0.4276096E+05 3,-3 7 3 -3 -0.117542 3.636936 0.006594 Rho 0.4361415E+07 3,-3 8 3 -3 2.590314 1.755027 -1.907063 Rho 0.4361415E+07 3,-3 9 3 -3 -2.605848 -2.056360 1.740549 Rho 0.4361415E+07 3,-3 10 3 -3 -2.586579 1.864785 1.729627 Rho 0.4361415E+07 3,-3 11 3 -3 2.597138 1.751419 1.911002 Rho 0.4361415E+07 3,-3 12 3 -3 2.593541 -1.865573 -1.901686 Rho 0.4361416E+07 3,-3 13 3 -3 0.977674 -0.105587 1.377922 Rho 0.3190123E+03 3,-3 14 3 -3 -1.106129 -1.481159 0.029588 Rho 0.3190848E+03 3,-3 15 3 -3 0.935029 -0.115903 -1.381671 Rho 0.3190410E+03 3,-3 16 3 -3 -0.983042 1.360980 0.002519 Rho 0.3190088E+03 3,-3 17 3 -3 -3.095522 0.117132 1.618030 Rho 0.3190034E+03 3,-3 18 3 -3 3.009870 -1.629756 -0.061227 Rho 0.3188023E+03 3,-3 19 3 -3 -3.102639 0.056174 -1.625230 Rho 0.3189086E+03 3,-3 20 3 -3 3.018025 1.728563 0.011005 Rho 0.3188411E+03 3,-3 21 3 -3 1.578875 -3.293546 -1.685806 Rho 0.3192220E+03 3,-3 22 3 -3 1.124696 2.937737 1.316114 Rho 0.3188709E+03 3,-3 23 3 -3 -1.203985 -1.374612 -3.042681 Rho 0.3187909E+03 3,-3 24 3 -3 -1.157905 1.393794 2.906204 Rho 0.3188544E+03 3,-3 25 3 -3 -1.159976 1.401176 -3.055978 Rho 0.3188051E+03 3,-3 26 3 -3 -1.226697 -1.315804 2.894039 Rho 0.3188023E+03 3,-3 27 3 -3 1.152393 2.973384 -1.294756 Rho 0.3188586E+03 3,-3 28 3 -3 1.628770 -3.441713 1.659957 Rho 0.3190802E+03 3,-3 29 3 -3 3.518609 0.183606 2.143628 Rho 0.3190357E+03 3,-3 30 3 -3 -3.539687 -2.189268 0.082683 Rho 0.3188553E+03 3,-3 31 3 -3 3.502686 0.157495 -2.103913 Rho 0.3189982E+03 3,-3 32 3 -3 -3.436365 2.316247 0.056875 Rho 0.3188793E+03 3,-3 33 3 -3 1.544427 1.442701 3.490440 Rho 0.3188746E+03 3,-3 34 3 -3 1.680298 -1.294023 -3.518694 Rho 0.3188595E+03 3,-3 35 3 -3 -1.475492 3.564607 1.361135 Rho 0.3189144E+03 3,-3 36 3 -3 -1.992822 -3.790129 -1.736580 Rho 0.3190205E+03 3,-3 37 3 -3 -1.978907 -3.714367 1.805889 Rho 0.3191587E+03 3,-3 38 3 -3 -1.448472 3.600801 -1.332569 Rho 0.3189290E+03 3,-3 39 3 -3 1.590394 -1.352912 3.581379 Rho 0.3188241E+03 3,-3 40 3 -3 1.566142 1.452288 -3.462590 Rho 0.3189096E+03 3,-3 41 3 -3 -0.254252 0.013584 5.354573 Rho 0.3190423E+03 3,-3 42 3 -3 4.096425 -2.574238 -2.557769 Rho 0.3191062E+03 3,-3 43 3 -3 -0.134013 -0.022718 -5.413160 Rho 0.3190321E+03 3,-3 44 3 -3 0.289441 5.363501 0.046045 Rho 0.3191462E+03 3,-3 45 3 -3 4.164978 -2.585924 2.565487 Rho 0.3189896E+03 3,-3 46 3 -3 3.776464 2.938043 -2.485891 Rho 0.3191511E+03 3,-3 47 3 -3 -3.856587 2.608915 -2.849698 Rho 0.3190089E+03 3,-3 48 3 -3 -3.980546 -2.188139 2.874469 Rho 0.3191092E+03 3,-3 49 3 -3 -4.097839 -2.309538 -2.866199 Rho 0.3189848E+03 3,-3 50 3 -3 -3.755160 2.581825 2.866196 Rho 0.3191259E+03 3,-3 51 3 -3 3.748066 2.965679 2.502548 Rho 0.3191434E+03 3,-3 52 3 +1 -2.198288 1.781327 -0.256284 Rho 0.2471883E-01 |GRAD(Rho)| 0.1601685E-16 GRAD(Rho)x 0.4185493E-17 GRAD(Rho)y -0.1020832E-16 GRAD(Rho)z 0.1161083E-16 Laplacian 0.9220059E-01 (-1/4)Del**2(Rho)) -0.2305015E-01 Diamond 0.1047739E-01 Metallicity 0.1567687E+01 Ellipticity -0.2572222E+01 Gb(Abramov) 0.2138933E-01 Vb(Abramov) -0.1972852E-01 Hb(Abramov) 0.1660815E-02 Ex_ueg -0.5318088E-02 Ec_ueg -0.1074568E-02 Delta_ex -0.5563265E-02 Delta_ec 0.1289940E-02 Delta_et -0.1142093E-01 Pxc 0.4949048E+01 Qxc -0.4312808E+01 3,+1 53 3 -1 -1.753411 1.569313 -0.866346 Rho 0.4119324E-01 |GRAD(Rho)| 0.1281918E-12 GRAD(Rho)x 0.7614112E-13 GRAD(Rho)y 0.9421844E-13 GRAD(Rho)z 0.4193524E-13 Laplacian 0.1729731E+00 (-1/4)Del**2(Rho)) -0.4324328E-01 Diamond 0.7272186E-01 Metallicity 0.1957392E+01 Ellipticity 0.1434400E-01 Gb(Abramov) 0.4293619E-01 Vb(Abramov) -0.4262911E-01 Hb(Abramov) 0.3070874E-03 Ex_ueg -0.1050718E-01 Ec_ueg -0.1934188E-02 Delta_ex -0.1386274E-01 Delta_ec 0.5693307E-02 Delta_et -0.5710275E-01 Pxc 0.5432347E+01 Qxc -0.2434919E+01 3,-1 54 3 +1 -3.103983 -0.383757 0.014437 Rho 0.5250390E-02 |GRAD(Rho)| 0.4305902E-17 GRAD(Rho)x -0.1456257E-17 GRAD(Rho)y -0.2765944E-17 GRAD(Rho)z -0.2961361E-17 Laplacian 0.2046362E-01 (-1/4)Del**2(Rho)) -0.5115905E-02 Diamond 0.3427553E-03 Metallicity 0.5340928E+00 Ellipticity -0.1443736E+01 Gb(Abramov) 0.3865998E-02 Vb(Abramov) -0.2616091E-02 Hb(Abramov) 0.1249907E-02 Ex_ueg -0.6739699E-03 Ec_ueg -0.1577040E-03 Delta_ex -0.8819341E-03 Delta_ec 0.3851970E-03 Delta_et -0.2227045E-02 Pxc 0.4273639E+01 Qxc -0.2289567E+01 3,+1 55 3 +1 -1.287817 2.383955 0.725797 Rho 0.2532490E-01 |GRAD(Rho)| 0.1103330E-13 GRAD(Rho)x -0.6251545E-14 GRAD(Rho)y -0.1557580E-15 GRAD(Rho)z 0.9089975E-14 Laplacian 0.9848182E-01 (-1/4)Del**2(Rho)) -0.2462045E-01 Diamond 0.1334954E-01 Metallicity 0.1528164E+01 Ellipticity -0.4205765E+01 Gb(Abramov) 0.2268432E-01 Vb(Abramov) -0.2074818E-01 Hb(Abramov) 0.1936135E-02 Ex_ueg -0.5492652E-02 Ec_ueg -0.1105086E-02 Delta_ex -0.6171633E-02 Delta_ec 0.1716561E-02 Delta_et -0.1519018E-01 Pxc 0.4970337E+01 Qxc -0.3595347E+01 3,+1 56 3 +1 -1.746867 -0.038693 0.775836 Rho 0.8480991E-02 |GRAD(Rho)| 0.1026237E-16 GRAD(Rho)x -0.6867677E-17 GRAD(Rho)y -0.2858095E-17 GRAD(Rho)z 0.7069840E-17 Laplacian 0.3224316E-01 (-1/4)Del**2(Rho)) -0.8060790E-02 Diamond 0.8872045E-03 Metallicity 0.7537949E+00 Ellipticity -0.1528860E+01 Gb(Abramov) 0.6386557E-02 Vb(Abramov) -0.4712324E-02 Hb(Abramov) 0.1674233E-02 Ex_ueg -0.1277362E-02 Ec_ueg -0.2996585E-03 Delta_ex -0.1486431E-02 Delta_ec 0.4869608E-03 Delta_et -0.3289321E-02 Pxc 0.4262725E+01 Qxc -0.3052466E+01 3,+1 57 3 -1 -2.848128 -0.915132 1.674439 Rho 0.6821814E-01 |GRAD(Rho)| 0.8247191E-13 GRAD(Rho)x -0.3102320E-13 GRAD(Rho)y -0.6568297E-13 GRAD(Rho)z 0.3905029E-13 Laplacian 0.2803974E+00 (-1/4)Del**2(Rho)) -0.7009936E-01 Diamond 0.2176149E+00 Metallicity 0.2799017E+01 Ellipticity 0.1402518E-01 Gb(Abramov) 0.7943446E-01 Vb(Abramov) -0.8876956E-01 Hb(Abramov) -0.9335099E-02 Ex_ueg -0.2058661E-01 Ec_ueg -0.3444244E-02 Delta_ex -0.2500196E-01 Delta_ec 0.8373680E-02 Delta_et -0.9557901E-01 Pxc 0.5977106E+01 Qxc -0.2985780E+01 3,-1 58 3 -1 -2.872380 -0.951023 -1.696851 Rho 0.7586355E-01 |GRAD(Rho)| 0.1578313E-15 GRAD(Rho)x -0.1205836E-16 GRAD(Rho)y 0.1524693E-15 GRAD(Rho)z 0.3896690E-16 Laplacian 0.3276509E+00 (-1/4)Del**2(Rho)) -0.8191273E-01 Diamond 0.3019072E+00 Metallicity 0.2859282E+01 Ellipticity 0.7357169E-02 Gb(Abramov) 0.9364376E-01 Vb(Abramov) -0.1053748E+00 Hb(Abramov) -0.1173102E-01 Ex_ueg -0.2371898E-01 Ec_ueg -0.3887883E-02 Delta_ex -0.3022804E-01 Delta_ec 0.1013464E-01 Delta_et -0.1189861E+00 Pxc 0.6100743E+01 Qxc -0.2982646E+01 3,-1 59 3 +3 -1.209577 0.003218 1.573635 Rho 0.5242091E-02 |GRAD(Rho)| 0.7556773E-17 GRAD(Rho)x 0.6283689E-17 GRAD(Rho)y -0.2814883E-18 GRAD(Rho)z -0.4188178E-17 Laplacian 0.2007403E-01 (-1/4)Del**2(Rho)) -0.5018508E-02 Diamond 0.1463676E-03 Metallicity 0.5430245E+00 Ellipticity -0.3301183E+00 Gb(Abramov) 0.3799868E-02 Vb(Abramov) -0.2581227E-02 Hb(Abramov) 0.1218641E-02 Ex_ueg -0.6725498E-03 Ec_ueg -0.1573458E-03 Delta_ex -0.6999318E-03 Delta_ec 0.8344508E-04 Delta_et -0.6802631E-03 Pxc 0.4274343E+01 Qxc -0.8387934E+01 3,+3 60 3 +1 -1.804703 -0.003975 -2.534883 Rho 0.1048282E-01 |GRAD(Rho)| 0.6514298E-17 GRAD(Rho)x -0.5047815E-17 GRAD(Rho)y -0.3175558E-17 GRAD(Rho)z 0.2621351E-17 Laplacian 0.4489997E-01 (-1/4)Del**2(Rho)) -0.1122499E-01 Diamond 0.1385617E-02 Metallicity 0.7706027E+00 Ellipticity -0.1294436E+01 Gb(Abramov) 0.8924997E-02 Vb(Abramov) -0.6625001E-02 Hb(Abramov) 0.2299996E-02 Ex_ueg -0.1694425E-02 Ec_ueg -0.3899915E-03 Delta_ex -0.2092278E-02 Delta_ec 0.5152131E-03 Delta_et -0.3792229E-02 Pxc 0.4344775E+01 Qxc -0.4060995E+01 3,+1 61 3 +1 -1.738378 -0.051625 -0.759452 Rho 0.8497371E-02 |GRAD(Rho)| 0.5167997E-17 GRAD(Rho)x -0.4283591E-17 GRAD(Rho)y -0.6782232E-18 GRAD(Rho)z -0.2810525E-17 Laplacian 0.3093156E-01 (-1/4)Del**2(Rho)) -0.7732890E-02 Diamond 0.8312644E-03 Metallicity 0.7882893E+00 Ellipticity -0.1554839E+01 Gb(Abramov) 0.6171219E-02 Vb(Abramov) -0.4609548E-02 Hb(Abramov) 0.1561671E-02 Ex_ueg -0.1280652E-02 Ec_ueg -0.3003906E-03 Delta_ex -0.1416539E-02 Delta_ec 0.4490956E-03 Delta_et -0.3048801E-02 Pxc 0.4263290E+01 Qxc -0.3154204E+01 3,+1 62 3 -1 -2.287984 -2.992705 -1.756892 Rho 0.1894514E+00 |GRAD(Rho)| 0.1057531E-14 GRAD(Rho)x -0.9580552E-15 GRAD(Rho)y -0.4343856E-15 GRAD(Rho)z -0.1086743E-15 Laplacian 0.7522936E+00 (-1/4)Del**2(Rho)) -0.1880734E+00 Diamond 0.1999509E+01 Metallicity 0.5724298E+01 Ellipticity 0.1162564E-01 Gb(Abramov) 0.3048136E+00 Vb(Abramov) -0.4215539E+00 Hb(Abramov) -0.1167402E+00 Ex_ueg -0.8036166E-01 Ec_ueg -0.1101522E-01 Delta_ex -0.8550219E-01 Delta_ec 0.1773143E-01 Delta_et -0.2418405E+00 Pxc 0.7295509E+01 Qxc -0.4822070E+01 3,-1 63 3 -1 -2.266852 -2.949445 1.775802 Rho 0.2210747E+00 |GRAD(Rho)| 0.1604605E-14 GRAD(Rho)x -0.1461179E-14 GRAD(Rho)y 0.6508466E-15 GRAD(Rho)z -0.1269330E-15 Laplacian 0.8444605E+00 (-1/4)Del**2(Rho)) -0.2111151E+00 Diamond 0.2691802E+01 Metallicity 0.6595769E+01 Ellipticity 0.1643052E-02 Gb(Abramov) 0.3728212E+00 Vb(Abramov) -0.5345273E+00 Hb(Abramov) -0.1617061E+00 Ex_ueg -0.9872725E-01 Ec_ueg -0.1314068E-01 Delta_ex -0.9979087E-01 Delta_ec 0.1896008E-01 Delta_et -0.2610855E+00 Pxc 0.7513101E+01 Qxc -0.5263210E+01 3,-1 64 3 -1 -3.097152 -2.129893 -0.796454 Rho 0.9972994E-01 |GRAD(Rho)| 0.2940291E-12 GRAD(Rho)x -0.1225317E-12 GRAD(Rho)y -0.1449016E-13 GRAD(Rho)z 0.2668879E-12 Laplacian 0.4078301E+00 (-1/4)Del**2(Rho)) -0.1019575E+00 Diamond 0.5263794E+00 Metallicity 0.3623902E+01 Ellipticity 0.1841616E-01 Gb(Abramov) 0.1295524E+00 Vb(Abramov) -0.1571472E+00 Hb(Abramov) -0.2759484E-01 Ex_ueg -0.3415748E-01 Ec_ueg -0.5308696E-02 Delta_ex -0.4007624E-01 Delta_ec 0.1201671E-01 Delta_et -0.1499674E+00 Pxc 0.6434251E+01 Qxc -0.3335043E+01 3,-1 65 3 +3 -2.381430 -0.070656 0.010252 Rho 0.4612553E-02 |GRAD(Rho)| 0.6965752E-16 GRAD(Rho)x 0.6949125E-16 GRAD(Rho)y -0.2512213E-17 GRAD(Rho)z 0.4101698E-17 Laplacian 0.1837661E-01 (-1/4)Del**2(Rho)) -0.4594153E-02 Diamond 0.1551562E-03 Metallicity 0.4792734E+00 Ellipticity -0.6569220E+00 Gb(Abramov) 0.3429744E-02 Vb(Abramov) -0.2265336E-02 Hb(Abramov) 0.1164408E-02 Ex_ueg -0.5670746E-03 Ec_ueg -0.1302777E-03 Delta_ex -0.6624855E-03 Delta_ec 0.1552371E-03 Delta_et -0.9954517E-03 Pxc 0.4352815E+01 Qxc -0.4267573E+01 3,+3 66 3 +3 -1.164542 -0.037095 -1.625825 Rho 0.4819745E-02 |GRAD(Rho)| 0.4087148E-14 GRAD(Rho)x 0.2375804E-14 GRAD(Rho)y -0.2050610E-15 GRAD(Rho)z 0.3319380E-14 Laplacian 0.1698805E-01 (-1/4)Del**2(Rho)) -0.4247013E-02 Diamond 0.1069769E-03 Metallicity 0.5578400E+00 Ellipticity -0.3769910E+00 Gb(Abramov) 0.3226201E-02 Vb(Abramov) -0.2205389E-02 Hb(Abramov) 0.1020812E-02 Ex_ueg -0.6012897E-03 Ec_ueg -0.1391639E-03 Delta_ex -0.5752862E-03 Delta_ec 0.6466786E-04 Delta_et -0.5382174E-03 Pxc 0.4320729E+01 Qxc -0.8896014E+01 3,+3 67 3 +1 -1.803789 0.032109 2.456578 Rho 0.1125188E-01 |GRAD(Rho)| 0.6201011E-15 GRAD(Rho)x 0.4960749E-15 GRAD(Rho)y -0.1456881E-15 GRAD(Rho)z 0.3423596E-15 Laplacian 0.5319538E-01 (-1/4)Del**2(Rho)) -0.1329885E-01 Diamond 0.1927825E-02 Metallicity 0.7318933E+00 Ellipticity -0.1285967E+01 Gb(Abramov) 0.1048812E-01 Vb(Abramov) -0.7677394E-02 Hb(Abramov) 0.2810726E-02 Ex_ueg -0.1862167E-02 Ec_ueg -0.4251443E-03 Delta_ex -0.2563411E-02 Delta_ec 0.6771502E-03 Delta_et -0.5008521E-02 Pxc 0.4380082E+01 Qxc -0.3785587E+01 3,+1 68 3 -1 -3.027491 2.091634 -0.799730 Rho 0.1048623E+00 |GRAD(Rho)| 0.7955836E-13 GRAD(Rho)x 0.2113993E-13 GRAD(Rho)y -0.1409203E-13 GRAD(Rho)z -0.7539264E-13 Laplacian 0.4318798E+00 (-1/4)Del**2(Rho)) -0.1079699E+00 Diamond 0.5871122E+00 Metallicity 0.3720626E+01 Ellipticity 0.1819295E-01 Gb(Abramov) 0.1389326E+00 Vb(Abramov) -0.1698953E+00 Hb(Abramov) -0.3096266E-01 Ex_ueg -0.3652114E-01 Ec_ueg -0.5620524E-02 Delta_ex -0.4285142E-01 Delta_ec 0.1244187E-01 Delta_et -0.1566905E+00 Pxc 0.6497818E+01 Qxc -0.3444129E+01 3,-1 69 3 -1 -2.856472 0.887343 -1.687931 Rho 0.1702899E+00 |GRAD(Rho)| 0.8671995E-16 GRAD(Rho)x -0.2344587E-17 GRAD(Rho)y 0.5117434E-16 GRAD(Rho)z 0.6997170E-16 Laplacian 0.6930418E+00 (-1/4)Del**2(Rho)) -0.1732605E+00 Diamond 0.1641439E+01 Metallicity 0.5201979E+01 Ellipticity 0.1733229E-01 Gb(Abramov) 0.2657232E+00 Vb(Abramov) -0.3581859E+00 Hb(Abramov) -0.9246271E-01 Ex_ueg -0.6971137E-01 Ec_ueg -0.9754773E-02 Delta_ex -0.7685291E-01 Delta_ec 0.1711572E-01 Delta_et -0.2318102E+00 Pxc 0.7146385E+01 Qxc -0.4490195E+01 3,-1 70 3 -1 -1.991577 2.750614 1.524264 Rho 0.1061682E+00 |GRAD(Rho)| 0.1050188E-15 GRAD(Rho)x -0.4841640E-16 GRAD(Rho)y 0.9284159E-16 GRAD(Rho)z 0.8077306E-17 Laplacian 0.4170208E+00 (-1/4)Del**2(Rho)) -0.1042552E+00 Diamond 0.5541267E+00 Metallicity 0.3933507E+01 Ellipticity 0.1722795E-01 Gb(Abramov) 0.1378515E+00 Vb(Abramov) -0.1714479E+00 Hb(Abramov) -0.3359635E-01 Ex_ueg -0.3712883E-01 Ec_ueg -0.5700194E-02 Delta_ex -0.4115964E-01 Delta_ec 0.1138040E-01 Delta_et -0.1428980E+00 Pxc 0.6513608E+01 Qxc -0.3616714E+01 3,-1 71 3 -1 -2.845945 0.922752 1.667431 Rho 0.1912068E+00 |GRAD(Rho)| 0.2949812E-15 GRAD(Rho)x 0.2183312E-15 GRAD(Rho)y 0.1940180E-15 GRAD(Rho)z -0.4126067E-16 Laplacian 0.7708757E+00 (-1/4)Del**2(Rho)) -0.1927189E+00 Diamond 0.2062152E+01 Metallicity 0.5672846E+01 Ellipticity 0.2327336E-01 Gb(Abramov) 0.3106901E+00 Vb(Abramov) -0.4286613E+00 Hb(Abramov) -0.1179712E+00 Ex_ueg -0.8135598E-01 Ec_ueg -0.1113174E-01 Delta_ex -0.8775069E-01 Delta_ec 0.1800099E-01 Delta_et -0.2453146E+00 Pxc 0.7308470E+01 Qxc -0.4874769E+01 3,-1 72 3 +1 -0.526446 0.746499 1.567354 Rho 0.8607925E-02 |GRAD(Rho)| 0.1193961E-16 GRAD(Rho)x -0.8705310E-17 GRAD(Rho)y 0.7925009E-17 GRAD(Rho)z 0.1991487E-17 Laplacian 0.3265843E-01 (-1/4)Del**2(Rho)) -0.8164607E-02 Diamond 0.8543558E-03 Metallicity 0.7628667E+00 Ellipticity -0.1448593E+01 Gb(Abramov) 0.6481156E-02 Vb(Abramov) -0.4797705E-02 Hb(Abramov) 0.1683451E-02 Ex_ueg -0.1302916E-02 Ec_ueg -0.3053347E-03 Delta_ex -0.1482986E-02 Delta_ec 0.4429061E-03 Delta_et -0.3041485E-02 Pxc 0.4267172E+01 Qxc -0.3348308E+01 3,+1 73 3 -1 -1.875863 -1.697053 -2.441901 Rho 0.1112522E+00 |GRAD(Rho)| 0.4720877E-16 GRAD(Rho)x -0.4022390E-16 GRAD(Rho)y -0.1771993E-16 GRAD(Rho)z -0.1722526E-16 Laplacian 0.4689018E+00 (-1/4)Del**2(Rho)) -0.1172254E+00 Diamond 0.6864628E+00 Metallicity 0.3781920E+01 Ellipticity 0.2072976E-01 Gb(Abramov) 0.1520398E+00 Vb(Abramov) -0.1868542E+00 Hb(Abramov) -0.3481440E-01 Ex_ueg -0.3951815E-01 Ec_ueg -0.6011572E-02 Delta_ex -0.4719863E-01 Delta_ec 0.1338384E-01 Delta_et -0.1705896E+00 Pxc 0.6573680E+01 Qxc -0.3526538E+01 3,-1 74 3 -1 -1.828421 -1.738692 -0.864098 Rho 0.4024007E-01 |GRAD(Rho)| 0.3679044E-14 GRAD(Rho)x -0.2122361E-14 GRAD(Rho)y -0.1618155E-14 GRAD(Rho)z -0.2532296E-14 Laplacian 0.1688341E+00 (-1/4)Del**2(Rho)) -0.4220853E-01 Diamond 0.7034281E-01 Metallicity 0.1928638E+01 Ellipticity 0.2340246E-01 Gb(Abramov) 0.4170651E-01 Vb(Abramov) -0.4120450E-01 Hb(Abramov) 0.5020124E-03 Ex_ueg -0.1018427E-01 Ec_ueg -0.1882947E-02 Delta_ex -0.1354544E-01 Delta_ec 0.5720448E-02 Delta_et -0.5702419E-01 Pxc 0.5408688E+01 Qxc -0.2367899E+01 3,-1 75 3 +1 -2.286414 -1.835801 -0.345440 Rho 0.2614303E-01 |GRAD(Rho)| 0.5720469E-14 GRAD(Rho)x -0.2290566E-14 GRAD(Rho)y -0.1302839E-14 GRAD(Rho)z -0.5077370E-14 Laplacian 0.1028947E+00 (-1/4)Del**2(Rho)) -0.2572367E-01 Diamond 0.1178288E-01 Metallicity 0.1542221E+01 Ellipticity -0.2051527E+01 Gb(Abramov) 0.2376105E-01 Vb(Abramov) -0.2179842E-01 Hb(Abramov) 0.1962626E-02 Ex_ueg -0.5730505E-02 Ec_ueg -0.1146434E-02 Delta_ex -0.6217707E-02 Delta_ec 0.1284031E-02 Delta_et -0.1155076E-01 Pxc 0.4998546E+01 Qxc -0.4842334E+01 3,+1 76 3 -1 -1.820276 -1.724834 0.870483 Rho 0.5200691E-01 |GRAD(Rho)| 0.3599255E-16 GRAD(Rho)x -0.1466129E-16 GRAD(Rho)y -0.2684480E-16 GRAD(Rho)z 0.1897015E-16 Laplacian 0.2040936E+00 (-1/4)Del**2(Rho)) -0.5102341E-01 Diamond 0.1101165E+00 Metallicity 0.2446539E+01 Ellipticity 0.3695960E-01 Gb(Abramov) 0.5482074E-01 Vb(Abramov) -0.5861806E-01 Hb(Abramov) -0.3797323E-02 Ex_ueg -0.1433727E-01 Ec_ueg -0.2526105E-02 Delta_ex -0.1700665E-01 Delta_ec 0.6150206E-02 Delta_et -0.6554299E-01 Pxc 0.5675643E+01 Qxc -0.2765217E+01 3,-1 77 3 -1 -1.870677 -1.652553 2.343662 Rho 0.1393357E+00 |GRAD(Rho)| 0.2016505E-15 GRAD(Rho)x -0.1854663E-15 GRAD(Rho)y -0.2526191E-16 GRAD(Rho)z -0.7501324E-16 Laplacian 0.5719391E+00 (-1/4)Del**2(Rho)) -0.1429848E+00 Diamond 0.1062496E+01 Metallicity 0.4511983E+01 Ellipticity 0.1366180E-01 Gb(Abramov) 0.2028473E+00 Vb(Abramov) -0.2627098E+00 Hb(Abramov) -0.5986254E-01 Ex_ueg -0.5335006E-01 Ec_ueg -0.7764380E-02 Delta_ex -0.6034170E-01 Delta_ec 0.1481063E-01 Delta_et -0.1951267E+00 Pxc 0.6871130E+01 Qxc -0.4074216E+01 3,-1 78 3 +1 -0.219618 2.291840 1.941362 Rho 0.6336726E-02 |GRAD(Rho)| 0.4062640E-14 GRAD(Rho)x -0.2689265E-14 GRAD(Rho)y 0.2513395E-14 GRAD(Rho)z -0.1719228E-14 Laplacian 0.2648284E-01 (-1/4)Del**2(Rho)) -0.6620709E-02 Diamond 0.7417198E-03 Metallicity 0.5646208E+00 Ellipticity -0.2155636E+01 Gb(Abramov) 0.5036838E-02 Vb(Abramov) -0.3452966E-02 Hb(Abramov) 0.1583871E-02 Ex_ueg -0.8660407E-03 Ec_ueg -0.2048835E-03 Delta_ex -0.1306492E-02 Delta_ec 0.7037312E-03 Delta_et -0.4153842E-02 Pxc 0.4226991E+01 Qxc -0.1856521E+01 3,+1 79 3 -1 -1.987033 2.763539 -1.531332 Rho 0.8641476E-01 |GRAD(Rho)| 0.3915023E-13 GRAD(Rho)x 0.2129010E-13 GRAD(Rho)y -0.1815591E-13 GRAD(Rho)z -0.2738312E-13 Laplacian 0.3620210E+00 (-1/4)Del**2(Rho)) -0.9050526E-01 Diamond 0.3879503E+00 Metallicity 0.3215086E+01 Ellipticity 0.6851844E-02 Gb(Abramov) 0.1088339E+00 Vb(Abramov) -0.1271625E+00 Hb(Abramov) -0.1832861E-01 Ex_ueg -0.2821644E-01 Ec_ueg -0.4509740E-02 Delta_ex -0.3433029E-01 Delta_ec 0.1080780E-01 Delta_et -0.1306220E+00 Pxc 0.6256778E+01 Qxc -0.3176437E+01 3,-1 80 3 +1 -2.034055 2.972424 -0.007495 Rho 0.1205794E-01 |GRAD(Rho)| 0.1221727E-16 GRAD(Rho)x -0.6730811E-17 GRAD(Rho)y -0.9667721E-17 GRAD(Rho)z -0.3239303E-17 Laplacian 0.5443945E-01 (-1/4)Del**2(Rho)) -0.1360986E-01 Diamond 0.1783595E-02 Metallicity 0.8025789E+00 Ellipticity -0.1172079E+01 Gb(Abramov) 0.1089374E-01 Vb(Abramov) -0.8177616E-02 Hb(Abramov) 0.2716122E-02 Ex_ueg -0.2042125E-02 Ec_ueg -0.4622442E-03 Delta_ex -0.2560970E-02 Delta_ec 0.4952827E-03 Delta_et -0.3880163E-02 Pxc 0.4417849E+01 Qxc -0.5170725E+01 3,+1 81 3 +1 -0.575739 0.777805 -1.603031 Rho 0.7523551E-02 |GRAD(Rho)| 0.1131297E-16 GRAD(Rho)x 0.8066854E-17 GRAD(Rho)y -0.8945495E-18 GRAD(Rho)z 0.7880924E-17 Laplacian 0.2744840E-01 (-1/4)Del**2(Rho)) -0.6862099E-02 Diamond 0.5757504E-03 Metallicity 0.7252164E+00 Ellipticity -0.1398110E+01 Gb(Abramov) 0.5404151E-02 Vb(Abramov) -0.3946202E-02 Hb(Abramov) 0.1457949E-02 Ex_ueg -0.1088802E-02 Ec_ueg -0.2570773E-03 Delta_ex -0.1192793E-02 Delta_ec 0.3511221E-03 Delta_et -0.2348048E-02 Pxc 0.4235309E+01 Qxc -0.3397088E+01 3,+1 82 3 -1 -0.184410 -3.564433 1.740632 Rho 0.2624716E-02 |GRAD(Rho)| 0.4519292E-17 GRAD(Rho)x 0.4401532E-17 GRAD(Rho)y 0.1009220E-17 GRAD(Rho)z 0.1788572E-18 Laplacian 0.8467636E-02 (-1/4)Del**2(Rho)) -0.2116909E-02 Diamond 0.1307338E-03 Metallicity 0.4064322E+00 Ellipticity 0.1250360E+00 Gb(Abramov) 0.1554669E-02 Vb(Abramov) -0.9924297E-03 Hb(Abramov) 0.5622397E-03 Ex_ueg -0.2674000E-03 Ec_ueg -0.4617197E-04 Delta_ex -0.4783733E-03 Delta_ec 0.4528751E-03 Delta_et -0.1946860E-02 Pxc 0.5791393E+01 Qxc -0.1056303E+01 3,-1 83 3 -1 -3.023549 2.100988 0.831661 Rho 0.1489642E+00 |GRAD(Rho)| 0.1187812E-13 GRAD(Rho)x -0.7673197E-14 GRAD(Rho)y 0.4072941E-15 GRAD(Rho)z -0.9057913E-14 Laplacian 0.5797531E+00 (-1/4)Del**2(Rho)) -0.1449383E+00 Diamond 0.1160669E+01 Metallicity 0.4975535E+01 Ellipticity 0.3256361E-01 Gb(Abramov) 0.2168164E+00 Vb(Abramov) -0.2886946E+00 Hb(Abramov) -0.7187815E-01 Ex_ueg -0.5832134E-01 Ec_ueg -0.8377239E-02 Delta_ex -0.6210923E-01 Delta_ec 0.1465487E-01 Delta_et -0.1947136E+00 Pxc 0.6961881E+01 Qxc -0.4238128E+01 3,-1 84 3 -1 -1.830195 1.605620 -2.443603 Rho 0.1261192E+00 |GRAD(Rho)| 0.4702413E-14 GRAD(Rho)x 0.3895294E-14 GRAD(Rho)y -0.2418042E-14 GRAD(Rho)z 0.1045198E-14 Laplacian 0.5303021E+00 (-1/4)Del**2(Rho)) -0.1325755E+00 Diamond 0.8968418E+00 Metallicity 0.4121533E+01 Ellipticity 0.1502469E-01 Gb(Abramov) 0.1794527E+00 Vb(Abramov) -0.2263300E+00 Hb(Abramov) -0.4687723E-01 Ex_ueg -0.4671183E-01 Ec_ueg -0.6932822E-02 Delta_ex -0.5490479E-01 Delta_ec 0.1457711E-01 Delta_et -0.1899264E+00 Pxc 0.6737781E+01 Qxc -0.3766506E+01 3,-1 85 3 -1 -1.753253 1.583349 0.849738 Rho 0.4562442E-01 |GRAD(Rho)| 0.5811569E-16 GRAD(Rho)x 0.2976728E-16 GRAD(Rho)y -0.3059165E-17 GRAD(Rho)z -0.4981951E-16 Laplacian 0.1780830E+00 (-1/4)Del**2(Rho)) -0.4452075E-01 Diamond 0.7879196E-01 Metallicity 0.2254168E+01 Ellipticity 0.2142979E-01 Gb(Abramov) 0.4640671E-01 Vb(Abramov) -0.4829267E-01 Hb(Abramov) -0.1885956E-02 Ex_ueg -0.1204060E-01 Ec_ueg -0.2174475E-02 Delta_ex -0.1428084E-01 Delta_ec 0.5230152E-02 Delta_et -0.5382193E-01 Pxc 0.5537246E+01 Qxc -0.2730483E+01 3,-1 86 3 +1 0.532730 1.485784 0.853903 Rho 0.7531966E-02 |GRAD(Rho)| 0.4210689E-17 GRAD(Rho)x -0.2504504E-17 GRAD(Rho)y -0.3378368E-17 GRAD(Rho)z 0.2097482E-18 Laplacian 0.2958121E-01 (-1/4)Del**2(Rho)) -0.7395303E-02 Diamond 0.6765375E-03 Metallicity 0.6741830E+00 Ellipticity -0.1411560E+01 Gb(Abramov) 0.5761167E-02 Vb(Abramov) -0.4127030E-02 Hb(Abramov) 0.1634136E-02 Ex_ueg -0.1090426E-02 Ec_ueg -0.2574497E-03 Delta_ex -0.1315472E-02 Delta_ec 0.4313087E-03 Delta_et -0.2836049E-02 Pxc 0.4235491E+01 Qxc -0.3049955E+01 3,+1 87 3 +3 -1.892015 2.738953 -0.015134 Rho 0.1182696E-01 |GRAD(Rho)| 0.1782886E-16 GRAD(Rho)x -0.8955077E-17 GRAD(Rho)y 0.8106811E-17 GRAD(Rho)z 0.1311314E-16 Laplacian 0.5234858E-01 (-1/4)Del**2(Rho)) -0.1308715E-01 Diamond 0.1136871E-02 Metallicity 0.8081591E+00 Ellipticity -0.6663791E+00 Gb(Abramov) 0.1048751E-01 Vb(Abramov) -0.7887880E-02 Hb(Abramov) 0.2599633E-02 Ex_ueg -0.1990135E-02 Ec_ueg -0.4515868E-03 Delta_ex -0.2292454E-02 Delta_ec 0.1958606E-03 Delta_et -0.1837919E-02 Pxc 0.4406983E+01 Qxc -0.1170452E+02 3,+3 88 3 +1 1.646914 -0.810261 -0.000785 Rho 0.8600855E-02 |GRAD(Rho)| 0.9290121E-17 GRAD(Rho)x -0.5329677E-17 GRAD(Rho)y 0.5159078E-17 GRAD(Rho)z -0.5593282E-17 Laplacian 0.3479963E-01 (-1/4)Del**2(Rho)) -0.8699908E-02 Diamond 0.9462248E-03 Metallicity 0.7149481E+00 Ellipticity -0.1422388E+01 Gb(Abramov) 0.6836602E-02 Vb(Abramov) -0.4973297E-02 Hb(Abramov) 0.1863306E-02 Ex_ueg -0.1301489E-02 Ec_ueg -0.3050184E-03 Delta_ex -0.1596498E-02 Delta_ec 0.5016048E-03 Delta_et -0.3418853E-02 Pxc 0.4266920E+01 Qxc -0.3182780E+01 3,+1 89 3 +1 -0.592020 -0.823161 1.546864 Rho 0.9681818E-02 |GRAD(Rho)| 0.1926711E-12 GRAD(Rho)x -0.3020768E-13 GRAD(Rho)y -0.1116964E-12 GRAD(Rho)z 0.1540571E-12 Laplacian 0.3677033E-01 (-1/4)Del**2(Rho)) -0.9192583E-02 Diamond 0.1182104E-02 Metallicity 0.8242213E+00 Ellipticity -0.1564125E+01 Gb(Abramov) 0.7391175E-02 Vb(Abramov) -0.5589768E-02 Hb(Abramov) 0.1801407E-02 Ex_ueg -0.1524033E-02 Ec_ueg -0.3536399E-03 Delta_ex -0.1741039E-02 Delta_ec 0.5349149E-03 Delta_et -0.3755107E-02 Pxc 0.4309561E+01 Qxc -0.3254795E+01 3,+1 90 3 +1 -0.666375 -0.899784 -1.560666 Rho 0.7900492E-02 |GRAD(Rho)| 0.7617918E-13 GRAD(Rho)x -0.2580181E-13 GRAD(Rho)y -0.2447989E-13 GRAD(Rho)z -0.6736667E-13 Laplacian 0.2898718E-01 (-1/4)Del**2(Rho)) -0.7246796E-02 Diamond 0.7016423E-03 Metallicity 0.7450132E+00 Ellipticity -0.1500522E+01 Gb(Abramov) 0.5731024E-02 Vb(Abramov) -0.4215252E-02 Hb(Abramov) 0.1515772E-02 Ex_ueg -0.1162137E-02 Ec_ueg -0.2737917E-03 Delta_ex -0.1301548E-02 Delta_ec 0.4174105E-03 Delta_et -0.2783333E-02 Pxc 0.4244602E+01 Qxc -0.3118147E+01 3,+1 91 3 +3 1.955166 0.035093 -2.667458 Rho 0.1123487E-01 |GRAD(Rho)| 0.1808834E-16 GRAD(Rho)x -0.9375845E-17 GRAD(Rho)y -0.1038957E-16 GRAD(Rho)z -0.1146030E-16 Laplacian 0.4993559E-01 (-1/4)Del**2(Rho)) -0.1248390E-01 Diamond 0.1038294E-02 Metallicity 0.7777072E+00 Ellipticity -0.6189042E+00 Gb(Abramov) 0.9940735E-02 Vb(Abramov) -0.7397571E-02 Hb(Abramov) 0.2543163E-02 Ex_ueg -0.1858413E-02 Ec_ueg -0.4243639E-03 Delta_ex -0.2163168E-02 Delta_ec 0.2032275E-03 Delta_et -0.1852902E-02 Pxc 0.4379291E+01 Qxc -0.1064407E+02 3,+3 92 3 +3 0.024725 1.592683 -1.648838 Rho 0.4109904E-02 |GRAD(Rho)| 0.4192861E-17 GRAD(Rho)x 0.3447923E-17 GRAD(Rho)y 0.1974375E-17 GRAD(Rho)z 0.1339313E-17 Laplacian 0.1636031E-01 (-1/4)Del**2(Rho)) -0.4090077E-02 Diamond 0.1107168E-03 Metallicity 0.4441618E+00 Ellipticity -0.2574400E+00 Gb(Abramov) 0.3029494E-02 Vb(Abramov) -0.1968911E-02 Hb(Abramov) 0.1060583E-02 Ex_ueg -0.4862139E-03 Ec_ueg -0.1088118E-03 Delta_ex -0.5636240E-03 Delta_ec 0.1222978E-03 Delta_et -0.7876640E-03 Pxc 0.4468394E+01 Qxc -0.4608617E+01 3,+3 93 3 -1 1.754737 0.806998 1.619582 Rho 0.3510140E-01 |GRAD(Rho)| 0.1478541E-13 GRAD(Rho)x 0.3428662E-14 GRAD(Rho)y 0.1436509E-13 GRAD(Rho)z 0.7048892E-15 Laplacian 0.1337751E+00 (-1/4)Del**2(Rho)) -0.3344377E-01 Diamond 0.4043328E-01 Metallicity 0.1938408E+01 Ellipticity 0.3520820E-01 Gb(Abramov) 0.3310046E-01 Vb(Abramov) -0.3275716E-01 Hb(Abramov) 0.3433090E-03 Ex_ueg -0.8488240E-02 Ec_ueg -0.1609622E-02 Delta_ex -0.9981837E-02 Delta_ec 0.3812039E-02 Delta_et -0.3655761E-01 Pxc 0.5273435E+01 Qxc -0.2618504E+01 3,-1 94 3 +1 -1.421652 2.302913 -0.819965 Rho 0.2342015E-01 |GRAD(Rho)| 0.1839218E-13 GRAD(Rho)x -0.1371212E-13 GRAD(Rho)y -0.2248772E-14 GRAD(Rho)z -0.1204961E-13 Laplacian 0.8639311E-01 (-1/4)Del**2(Rho)) -0.2159828E-01 Diamond 0.8920153E-02 Metallicity 0.1529151E+01 Ellipticity -0.2368968E+01 Gb(Abramov) 0.1990336E-01 Vb(Abramov) -0.1820843E-01 Hb(Abramov) 0.1694923E-02 Ex_ueg -0.4948855E-02 Ec_ueg -0.1009505E-02 Delta_ex -0.5113657E-02 Delta_ec 0.1168127E-02 Delta_et -0.1022946E-01 Pxc 0.4902259E+01 Qxc -0.4377656E+01 3,+1 95 3 +1 0.234660 1.975957 2.279342 Rho 0.6210463E-02 |GRAD(Rho)| 0.6460325E-17 GRAD(Rho)x -0.5971532E-17 GRAD(Rho)y -0.7256577E-18 GRAD(Rho)z -0.2355848E-17 Laplacian 0.2534260E-01 (-1/4)Del**2(Rho)) -0.6335650E-02 Diamond 0.6403189E-03 Metallicity 0.5705608E+00 Ellipticity -0.1860453E+01 Gb(Abramov) 0.4826246E-02 Vb(Abramov) -0.3316841E-02 Hb(Abramov) 0.1509404E-02 Ex_ueg -0.8431089E-03 Ec_ueg -0.1993702E-03 Delta_ex -0.1209854E-02 Delta_ec 0.6107717E-03 Delta_et -0.3613054E-02 Pxc 0.4228862E+01 Qxc -0.1980861E+01 3,+1 96 3 -1 -0.178703 -3.507946 -1.724538 Rho 0.2752192E-02 |GRAD(Rho)| 0.4404088E-17 GRAD(Rho)x 0.4273456E-17 GRAD(Rho)y 0.1014647E-17 GRAD(Rho)z 0.3225749E-18 Laplacian 0.8863071E-02 (-1/4)Del**2(Rho)) -0.2215768E-02 Diamond 0.1412134E-03 Metallicity 0.4202362E+00 Ellipticity 0.1659420E+00 Gb(Abramov) 0.1632369E-02 Vb(Abramov) -0.1048971E-02 Hb(Abramov) 0.5833983E-03 Ex_ueg -0.2848547E-03 Ec_ueg -0.5150122E-04 Delta_ex -0.4945286E-03 Delta_ec 0.4571690E-03 Delta_et -0.1999067E-02 Pxc 0.5531027E+01 Qxc -0.1081719E+01 3,-1 97 3 -1 0.023764 2.142581 -2.154144 Rho 0.5325351E-02 |GRAD(Rho)| 0.1749003E-16 GRAD(Rho)x 0.8712213E-17 GRAD(Rho)y -0.9442332E-17 GRAD(Rho)z -0.1186765E-16 Laplacian 0.2067145E-01 (-1/4)Del**2(Rho)) -0.5167863E-02 Diamond 0.5784005E-03 Metallicity 0.5413639E+00 Ellipticity 0.6682979E+01 Gb(Abramov) 0.3911524E-02 Vb(Abramov) -0.2655186E-02 Hb(Abramov) 0.1256339E-02 Ex_ueg -0.6868302E-03 Ec_ueg -0.1609407E-03 Delta_ex -0.1086243E-02 Delta_ec 0.7327768E-03 Delta_et -0.4022757E-02 Pxc 0.4267597E+01 Qxc -0.1482366E+01 3,-1 98 3 -1 -0.028209 2.150299 2.074878 Rho 0.6431807E-02 |GRAD(Rho)| 0.2509345E-17 GRAD(Rho)x -0.1754699E-17 GRAD(Rho)y -0.6041863E-18 GRAD(Rho)z -0.1689024E-17 Laplacian 0.2545863E-01 (-1/4)Del**2(Rho)) -0.6364659E-02 Diamond 0.9636840E-03 Metallicity 0.6020969E+00 Ellipticity 0.1404829E+01 Gb(Abramov) 0.4881796E-02 Vb(Abramov) -0.3398933E-02 Hb(Abramov) 0.1482863E-02 Ex_ueg -0.8834102E-03 Ec_ueg -0.2090403E-03 Delta_ex -0.1416685E-02 Delta_ec 0.9564032E-03 Delta_et -0.5540711E-02 Pxc 0.4226028E+01 Qxc -0.1481264E+01 3,-1 99 3 +1 -0.144932 2.258427 -2.036651 Rho 0.5301027E-02 |GRAD(Rho)| 0.4101281E-17 GRAD(Rho)x -0.3972136E-17 GRAD(Rho)y -0.9626920E-18 GRAD(Rho)z 0.3403960E-18 Laplacian 0.2093082E-01 (-1/4)Del**2(Rho)) -0.5232704E-02 Diamond 0.5126547E-03 Metallicity 0.5305915E+00 Ellipticity -0.3391252E+01 Gb(Abramov) 0.3951207E-02 Vb(Abramov) -0.2669711E-02 Hb(Abramov) 0.1281497E-02 Ex_ueg -0.6826504E-03 Ec_ueg -0.1598901E-03 Delta_ex -0.1039314E-02 Delta_ec 0.6355258E-03 Delta_et -0.3521997E-02 Pxc 0.4269497E+01 Qxc -0.1635362E+01 3,+1 100 3 +3 0.059583 1.542269 1.597457 Rho 0.4705937E-02 |GRAD(Rho)| 0.8973761E-16 GRAD(Rho)x 0.5637022E-16 GRAD(Rho)y -0.1255872E-16 GRAD(Rho)z 0.6868417E-16 Laplacian 0.1921530E-01 (-1/4)Del**2(Rho)) -0.4803825E-02 Diamond 0.1487169E-03 Metallicity 0.4739249E+00 Ellipticity -0.3451831E+00 Gb(Abramov) 0.3581992E-02 Vb(Abramov) -0.2360159E-02 Hb(Abramov) 0.1221833E-02 Ex_ueg -0.5824338E-03 Ec_ueg -0.1342801E-03 Delta_ex -0.6782047E-03 Delta_ec 0.1299679E-03 Delta_et -0.8863770E-03 Pxc 0.4337454E+01 Qxc -0.5218246E+01 3,+3 101 3 -1 -0.554935 0.714223 3.212331 Rho 0.1093266E+00 |GRAD(Rho)| 0.7098380E-16 GRAD(Rho)x 0.4609214E-16 GRAD(Rho)y 0.2209062E-16 GRAD(Rho)z 0.4925666E-16 Laplacian 0.4695555E+00 (-1/4)Del**2(Rho)) -0.1173889E+00 Diamond 0.6712867E+00 Metallicity 0.3668340E+01 Ellipticity 0.1335025E-01 Gb(Abramov) 0.1500296E+00 Vb(Abramov) -0.1826704E+00 Hb(Abramov) -0.3264076E-01 Ex_ueg -0.3860881E-01 Ec_ueg -0.5893410E-02 Delta_ex -0.4704456E-01 Delta_ec 0.1340509E-01 Delta_et -0.1702157E+00 Pxc 0.6551184E+01 Qxc -0.3509455E+01 3,-1 102 3 -1 -0.539177 2.451490 0.004795 Rho 0.4247181E-01 |GRAD(Rho)| 0.2371705E-12 GRAD(Rho)x 0.8001456E-13 GRAD(Rho)y 0.2232654E-12 GRAD(Rho)z 0.2824228E-15 Laplacian 0.1667727E+00 (-1/4)Del**2(Rho)) -0.4169317E-01 Diamond 0.6691927E-01 Metallicity 0.2136270E+01 Ellipticity 0.2085936E-01 Gb(Abramov) 0.4264009E-01 Vb(Abramov) -0.4358701E-01 Hb(Abramov) -0.9469230E-03 Ex_ueg -0.1094425E-01 Ec_ueg -0.2003177E-02 Delta_ex -0.1313514E-01 Delta_ec 0.4898316E-02 Delta_et -0.4945901E-01 Pxc 0.5463448E+01 Qxc -0.2681563E+01 3,-1 103 3 -1 -0.592411 -0.707712 3.204836 Rho 0.1234045E+00 |GRAD(Rho)| 0.4503769E-13 GRAD(Rho)x 0.3375830E-13 GRAD(Rho)y 0.2219163E-13 GRAD(Rho)z 0.1990735E-13 Laplacian 0.5333675E+00 (-1/4)Del**2(Rho)) -0.1333419E+00 Diamond 0.8785336E+00 Metallicity 0.3951892E+01 Ellipticity 0.5661746E-02 Gb(Abramov) 0.1767200E+00 Vb(Abramov) -0.2200982E+00 Hb(Abramov) -0.4337816E-01 Ex_ueg -0.4537603E-01 Ec_ueg -0.6763452E-02 Delta_ex -0.5493465E-01 Delta_ec 0.1473090E-01 Delta_et -0.1911888E+00 Pxc 0.6709004E+01 Qxc -0.3729211E+01 3,-1 104 3 -1 -0.515376 0.590143 0.010260 Rho 0.1704521E+00 |GRAD(Rho)| 0.5530696E-15 GRAD(Rho)x 0.2220446E-15 GRAD(Rho)y -0.5065393E-15 GRAD(Rho)z 0.4607859E-18 Laplacian 0.4197314E+00 (-1/4)Del**2(Rho)) -0.1049328E+00 Diamond 0.1012137E+01 Metallicity 0.8602916E+01 Ellipticity 0.6449549E-02 Gb(Abramov) 0.2204100E+00 Vb(Abramov) -0.3358871E+00 Hb(Abramov) -0.1154771E+00 Ex_ueg -0.6979992E-01 Ec_ueg -0.9765354E-02 Delta_ex -0.4669782E-01 Delta_ec 0.1061659E-01 Delta_et -0.1445012E+00 Pxc 0.7147710E+01 Qxc -0.4398572E+01 3,-1 105 3 -1 -0.584810 0.724332 -3.303521 Rho 0.1316326E+00 |GRAD(Rho)| 0.1938458E-13 GRAD(Rho)x 0.1869623E-13 GRAD(Rho)y 0.4743195E-14 GRAD(Rho)z -0.1927474E-14 Laplacian 0.5503210E+00 (-1/4)Del**2(Rho)) -0.1375803E+00 Diamond 0.9747875E+00 Metallicity 0.4265168E+01 Ellipticity 0.1425719E-01 Gb(Abramov) 0.1895206E+00 Vb(Abramov) -0.2414610E+00 Hb(Abramov) -0.5194039E-01 Ex_ueg -0.4945417E-01 Ec_ueg -0.7278319E-02 Delta_ex -0.5750300E-01 Delta_ec 0.1487039E-01 Delta_et -0.1949797E+00 Pxc 0.6794725E+01 Qxc -0.3866947E+01 3,-1 106 3 -1 -0.828700 3.601692 -0.706325 Rho 0.1652507E+00 |GRAD(Rho)| 0.5741056E-13 GRAD(Rho)x 0.5635501E-13 GRAD(Rho)y -0.8174595E-14 GRAD(Rho)z 0.7298036E-14 Laplacian 0.6441255E+00 (-1/4)Del**2(Rho)) -0.1610314E+00 Diamond 0.1456347E+01 Metallicity 0.5323715E+01 Ellipticity 0.3844884E-01 Gb(Abramov) 0.2502351E+00 Vb(Abramov) -0.3394388E+00 Hb(Abramov) -0.8920374E-01 Ex_ueg -0.6697449E-01 Ec_ueg -0.9426821E-02 Delta_ex -0.7076289E-01 Delta_ec 0.1579339E-01 Delta_et -0.2125036E+00 Pxc 0.7104674E+01 Qxc -0.4480539E+01 3,-1 107 3 -1 -0.841210 3.580545 0.724898 Rho 0.1524958E+00 |GRAD(Rho)| 0.9410895E-14 GRAD(Rho)x 0.6692699E-14 GRAD(Rho)y 0.1460654E-14 GRAD(Rho)z -0.6452846E-14 Laplacian 0.5945411E+00 (-1/4)Del**2(Rho)) -0.1486353E+00 Diamond 0.1226090E+01 Metallicity 0.5045000E+01 Ellipticity 0.4799600E-01 Gb(Abramov) 0.2240677E+00 Vb(Abramov) -0.2995001E+00 Hb(Abramov) -0.7543241E-01 Ex_ueg -0.6017217E-01 Ec_ueg -0.8603474E-02 Delta_ex -0.6408000E-01 Delta_ec 0.1497316E-01 Delta_et -0.1996580E+00 Pxc 0.6993939E+01 Qxc -0.4279657E+01 3,-1 108 3 +1 1.139092 0.603306 -2.464707 Rho 0.2308736E-01 |GRAD(Rho)| 0.3826661E-16 GRAD(Rho)x -0.1197018E-16 GRAD(Rho)y -0.2645573E-16 GRAD(Rho)z 0.2492273E-16 Laplacian 0.8666831E-01 (-1/4)Del**2(Rho)) -0.2166708E-01 Diamond 0.1060291E-01 Metallicity 0.1488367E+01 Ellipticity -0.5045149E+01 Gb(Abramov) 0.1981948E-01 Vb(Abramov) -0.1797188E-01 Hb(Abramov) 0.1847598E-02 Ex_ueg -0.4855316E-02 Ec_ueg -0.9929065E-03 Delta_ex -0.5330789E-02 Delta_ec 0.1566346E-02 Delta_et -0.1353091E-01 Pxc 0.4890004E+01 Qxc -0.3403328E+01 3,+1 109 3 +1 1.675954 0.732242 -0.016649 Rho 0.6682016E-02 |GRAD(Rho)| 0.1021789E-16 GRAD(Rho)x -0.3014951E-17 GRAD(Rho)y 0.5855760E-18 GRAD(Rho)z -0.9745382E-17 Laplacian 0.2588681E-01 (-1/4)Del**2(Rho)) -0.6471702E-02 Diamond 0.5167129E-03 Metallicity 0.6310260E+00 Ellipticity -0.1407198E+01 Gb(Abramov) 0.4995103E-02 Vb(Abramov) -0.3518504E-02 Hb(Abramov) 0.1476599E-02 Ex_ueg -0.9295265E-03 Ec_ueg -0.2199998E-03 Delta_ex -0.1126185E-02 Delta_ec 0.3927082E-03 Delta_et -0.2489579E-02 Pxc 0.4225124E+01 Qxc -0.2867739E+01 3,+1 110 3 +1 0.108482 2.086843 -2.215117 Rho 0.5321481E-02 |GRAD(Rho)| 0.7030324E-17 GRAD(Rho)x 0.2445302E-17 GRAD(Rho)y -0.4405798E-17 GRAD(Rho)z -0.4902540E-17 Laplacian 0.2085329E-01 (-1/4)Del**2(Rho)) -0.5213322E-02 Diamond 0.5401469E-03 Metallicity 0.5359935E+00 Ellipticity -0.5949578E+01 Gb(Abramov) 0.3941266E-02 Vb(Abramov) -0.2669210E-02 Hb(Abramov) 0.1272056E-02 Ex_ueg -0.6861648E-03 Ec_ueg -0.1607736E-03 Delta_ex -0.1059100E-02 Delta_ec 0.6739662E-03 Delta_et -0.3722350E-02 Pxc 0.4267895E+01 Qxc -0.1571444E+01 3,+1 111 3 +1 0.545520 1.500961 -0.846509 Rho 0.7140473E-02 |GRAD(Rho)| 0.6294009E-17 GRAD(Rho)x -0.2967318E-17 GRAD(Rho)y 0.5363183E-17 GRAD(Rho)z -0.1430331E-17 Laplacian 0.2769615E-01 (-1/4)Del**2(Rho)) -0.6924038E-02 Diamond 0.5890634E-03 Metallicity 0.6587775E+00 Ellipticity -0.1404167E+01 Gb(Abramov) 0.5376259E-02 Vb(Abramov) -0.3828479E-02 Hb(Abramov) 0.1547779E-02 Ex_ueg -0.1015518E-02 Ec_ueg -0.2401580E-03 Delta_ex -0.1215441E-02 Delta_ec 0.4037891E-03 Delta_et -0.2618251E-02 Pxc 0.4228542E+01 Qxc -0.3010087E+01 3,+1 112 3 +1 2.077956 -0.006334 2.840922 Rho 0.1071998E-01 |GRAD(Rho)| 0.8694798E-14 GRAD(Rho)x -0.5570728E-14 GRAD(Rho)y -0.1550550E-15 GRAD(Rho)z -0.6674014E-14 Laplacian 0.4521013E-01 (-1/4)Del**2(Rho)) -0.1130253E-01 Diamond 0.1162155E-02 Metallicity 0.7943904E+00 Ellipticity -0.1086672E+01 Gb(Abramov) 0.9031459E-02 Vb(Abramov) -0.6760386E-02 Hb(Abramov) 0.2271074E-02 Ex_ueg -0.1745730E-02 Ec_ueg -0.4008060E-03 Delta_ex -0.2026427E-02 Delta_ec 0.3529562E-03 Delta_et -0.2764027E-02 Pxc 0.4355548E+01 Qxc -0.5741300E+01 3,+1 113 3 -1 0.919501 -0.695849 -3.545885 Rho 0.1080881E+00 |GRAD(Rho)| 0.8037834E-13 GRAD(Rho)x -0.6711907E-13 GRAD(Rho)y 0.4315289E-13 GRAD(Rho)z -0.9671406E-14 Laplacian 0.4461831E+00 (-1/4)Del**2(Rho)) -0.1115458E+00 Diamond 0.6264100E+00 Metallicity 0.3787883E+01 Ellipticity 0.3397042E-01 Gb(Abramov) 0.1447842E+00 Vb(Abramov) -0.1780227E+00 Hb(Abramov) -0.3323846E-01 Ex_ueg -0.3802672E-01 Ec_ueg -0.5817552E-02 Delta_ex -0.4454169E-01 Delta_ec 0.1269390E-01 Delta_et -0.1607257E+00 Pxc 0.6536551E+01 Qxc -0.3508904E+01 3,-1 114 3 -1 0.483520 -0.072965 -2.438510 Rho 0.4693974E-01 |GRAD(Rho)| 0.5726374E-16 GRAD(Rho)x 0.1375878E-16 GRAD(Rho)y -0.3863000E-17 GRAD(Rho)z -0.5545186E-16 Laplacian 0.1974820E+00 (-1/4)Del**2(Rho)) -0.4937049E-01 Diamond 0.9895776E-01 Metallicity 0.2131344E+01 Ellipticity 0.1429300E-01 Gb(Abramov) 0.5045125E-01 Vb(Abramov) -0.5153200E-01 Hb(Abramov) -0.1080754E-02 Ex_ueg -0.1250564E-01 Ec_ueg -0.2246426E-02 Delta_ex -0.1633158E-01 Delta_ec 0.6480080E-02 Delta_et -0.6734584E-01 Pxc 0.5566907E+01 Qxc -0.2520275E+01 3,-1 115 3 -1 0.406391 -0.121234 -0.658051 Rho 0.1747381E+00 |GRAD(Rho)| 0.3802181E-15 GRAD(Rho)x 0.1769418E-15 GRAD(Rho)y -0.8402567E-18 GRAD(Rho)z -0.3365364E-15 Laplacian 0.4372005E+00 (-1/4)Del**2(Rho)) -0.1093001E+00 Diamond 0.1089489E+01 Metallicity 0.8608187E+01 Ellipticity 0.4338210E-02 Gb(Abramov) 0.2296794E+00 Vb(Abramov) -0.3500587E+00 Hb(Abramov) -0.1203793E+00 Ex_ueg -0.7214979E-01 Ec_ueg -0.1004549E-01 Delta_ex -0.4896992E-01 Delta_ec 0.1103646E-01 Delta_et -0.1508048E+00 Pxc 0.7182306E+01 Qxc -0.4437106E+01 3,-1 116 3 -1 0.426308 -0.115218 0.672241 Rho 0.1748638E+00 |GRAD(Rho)| 0.7652130E-15 GRAD(Rho)x -0.4996004E-15 GRAD(Rho)y -0.1577514E-16 GRAD(Rho)z -0.5793976E-15 Laplacian 0.4417280E+00 (-1/4)Del**2(Rho)) -0.1104320E+00 Diamond 0.1098216E+01 Metallicity 0.8530177E+01 Ellipticity 0.3313177E-02 Gb(Abramov) 0.2306221E+00 Vb(Abramov) -0.3508122E+00 Hb(Abramov) -0.1201901E+00 Ex_ueg -0.7221902E-01 Ec_ueg -0.1005373E-01 Delta_ex -0.4945744E-01 Delta_ec 0.1109786E-01 Delta_et -0.1515160E+00 Pxc 0.7183310E+01 Qxc -0.4456486E+01 3,-1 117 3 -1 0.535896 -0.069547 2.422190 Rho 0.5042550E-01 |GRAD(Rho)| 0.6662028E-13 GRAD(Rho)x 0.4888237E-13 GRAD(Rho)y 0.4236081E-13 GRAD(Rho)z -0.1594795E-13 Laplacian 0.2134328E+00 (-1/4)Del**2(Rho)) -0.5335821E-01 Diamond 0.1170078E+00 Metallicity 0.2222128E+01 Ellipticity 0.1917737E-01 Gb(Abramov) 0.5533360E-01 Vb(Abramov) -0.5730899E-01 Hb(Abramov) -0.1975390E-02 Ex_ueg -0.1375895E-01 Ec_ueg -0.2438408E-02 Delta_ex -0.1792786E-01 Delta_ec 0.6934202E-02 Delta_et -0.7344949E-01 Pxc 0.5642597E+01 Qxc -0.2585425E+01 3,-1 118 3 -1 0.904342 -0.732398 3.566326 Rho 0.1325065E+00 |GRAD(Rho)| 0.1456180E-14 GRAD(Rho)x -0.1201106E-14 GRAD(Rho)y 0.8223538E-15 GRAD(Rho)z 0.3922652E-16 Laplacian 0.5383708E+00 (-1/4)Del**2(Rho)) -0.1345927E+00 Diamond 0.9544204E+00 Metallicity 0.4408190E+01 Ellipticity 0.4058169E-01 Gb(Abramov) 0.1886135E+00 Vb(Abramov) -0.2426343E+00 Hb(Abramov) -0.5402080E-01 Ex_ueg -0.4989243E-01 Ec_ueg -0.7333268E-02 Delta_ex -0.5626367E-01 Delta_ec 0.1438180E-01 Delta_et -0.1885154E+00 Pxc 0.6803573E+01 Qxc -0.3912144E+01 3,-1 119 3 -1 -0.038686 -0.027245 -4.573695 Rho 0.1958429E+00 |GRAD(Rho)| 0.4091697E-15 GRAD(Rho)x -0.3983088E-16 GRAD(Rho)y 0.2731681E-18 GRAD(Rho)z -0.4072263E-15 Laplacian 0.7479759E+00 (-1/4)Del**2(Rho)) -0.1869940E+00 Diamond 0.2079593E+01 Metallicity 0.6084690E+01 Ellipticity 0.2880742E-02 Gb(Abramov) 0.3142961E+00 Vb(Abramov) -0.4415981E+00 Hb(Abramov) -0.1273021E+00 Ex_ueg -0.8399667E-01 Ec_ueg -0.1144030E-01 Delta_ex -0.8580699E-01 Delta_ec 0.1760514E-01 Delta_et -0.2412616E+00 Pxc 0.7342172E+01 Qxc -0.4873974E+01 3,-1 120 3 -1 0.857378 0.744313 -3.518032 Rho 0.9139701E-01 |GRAD(Rho)| 0.1424227E-12 GRAD(Rho)x -0.1011760E-12 GRAD(Rho)y -0.9960861E-13 GRAD(Rho)z -0.1121444E-13 Laplacian 0.3800304E+00 (-1/4)Del**2(Rho)) -0.9500760E-01 Diamond 0.4384103E+00 Metallicity 0.3362648E+01 Ellipticity 0.5326522E-02 Gb(Abramov) 0.1165846E+00 Vb(Abramov) -0.1381616E+00 Hb(Abramov) -0.2157699E-01 Ex_ueg -0.3040612E-01 Ec_ueg -0.4806930E-02 Delta_ex -0.3654965E-01 Delta_ec 0.1130251E-01 Delta_et -0.1383658E+00 Pxc 0.6325477E+01 Qxc -0.3233764E+01 3,-1 121 3 +1 1.256840 0.670075 2.391516 Rho 0.2402146E-01 |GRAD(Rho)| 0.1094814E-14 GRAD(Rho)x 0.1951056E-15 GRAD(Rho)y 0.4314381E-15 GRAD(Rho)z 0.9871232E-15 Laplacian 0.9004560E-01 (-1/4)Del**2(Rho)) -0.2251140E-01 Diamond 0.1175333E-01 Metallicity 0.1530440E+01 Ellipticity -0.6594743E+01 Gb(Abramov) 0.2074966E-01 Vb(Abramov) -0.1898791E-01 Hb(Abramov) 0.1761743E-02 Ex_ueg -0.5118988E-02 Ec_ueg -0.1039573E-02 Delta_ex -0.5610446E-02 Delta_ec 0.1651964E-02 Delta_et -0.1440787E-01 Pxc 0.4924125E+01 Qxc -0.3396227E+01 3,+1 122 3 -1 0.559714 3.269987 -0.676254 Rho 0.1424788E+00 |GRAD(Rho)| 0.2612081E-15 GRAD(Rho)x 0.7815742E-16 GRAD(Rho)y -0.1905689E-15 GRAD(Rho)z 0.1606381E-15 Laplacian 0.5903646E+00 (-1/4)Del**2(Rho)) -0.1475912E+00 Diamond 0.1124188E+01 Metallicity 0.4536732E+01 Ellipticity 0.1596854E-01 Gb(Abramov) 0.2099910E+00 Vb(Abramov) -0.2723909E+00 Hb(Abramov) -0.6239987E-01 Ex_ueg -0.5496066E-01 Ec_ueg -0.7963799E-02 Delta_ex -0.6260032E-01 Delta_ec 0.1516061E-01 Delta_et -0.2003132E+00 Pxc 0.6901312E+01 Qxc -0.4129143E+01 3,-1 123 3 -1 0.545008 3.250944 0.694147 Rho 0.1425679E+00 |GRAD(Rho)| 0.3446270E-15 GRAD(Rho)x 0.3346119E-16 GRAD(Rho)y 0.2194154E-16 GRAD(Rho)z 0.3422962E-15 Laplacian 0.5944090E+00 (-1/4)Del**2(Rho)) -0.1486023E+00 Diamond 0.1130575E+01 Metallicity 0.4510561E+01 Ellipticity 0.1495788E-01 Gb(Abramov) 0.2107814E+00 Vb(Abramov) -0.2729606E+00 Hb(Abramov) -0.6217918E-01 Ex_ueg -0.5500650E-01 Ec_ueg -0.7969462E-02 Delta_ex -0.6301572E-01 Delta_ec 0.1522094E-01 Delta_et -0.2010406E+00 Pxc 0.6902159E+01 Qxc -0.4140069E+01 3,-1 124 3 +1 1.756925 2.535141 0.010506 Rho 0.1268488E-01 |GRAD(Rho)| 0.1235386E-16 GRAD(Rho)x 0.1953315E-17 GRAD(Rho)y 0.8768950E-18 GRAD(Rho)z -0.1216690E-16 Laplacian 0.6349408E-01 (-1/4)Del**2(Rho)) -0.1587352E-01 Diamond 0.2680144E-02 Metallicity 0.7487853E+00 Ellipticity -0.1246325E+01 Gb(Abramov) 0.1256332E-01 Vb(Abramov) -0.9253126E-02 Hb(Abramov) 0.3310197E-02 Ex_ueg -0.2184910E-02 Ec_ueg -0.4912771E-03 Delta_ex -0.3149597E-02 Delta_ec 0.7928230E-03 Delta_et -0.6049225E-02 Pxc 0.4447409E+01 Qxc -0.3972636E+01 3,+1 125 3 -1 0.875169 0.741982 3.518186 Rho 0.1075729E+00 |GRAD(Rho)| 0.1594747E-13 GRAD(Rho)x -0.3620856E-14 GRAD(Rho)y 0.1552050E-13 GRAD(Rho)z -0.5703488E-15 Laplacian 0.4407544E+00 (-1/4)Del**2(Rho)) -0.1101886E+00 Diamond 0.6175149E+00 Metallicity 0.3804122E+01 Ellipticity 0.1629675E-01 Gb(Abramov) 0.1433209E+00 Vb(Abramov) -0.1764532E+00 Hb(Abramov) -0.3313227E-01 Ex_ueg -0.3778523E-01 Ec_ueg -0.5786029E-02 Delta_ex -0.4398614E-01 Delta_ec 0.1261589E-01 Delta_et -0.1596730E+00 Pxc 0.6530425E+01 Qxc -0.3486566E+01 3,-1 126 3 +3 1.100018 1.493170 -0.010627 Rho 0.4219091E-02 |GRAD(Rho)| 0.3515298E-13 GRAD(Rho)x 0.1383255E-14 GRAD(Rho)y -0.3512445E-13 GRAD(Rho)z -0.3030696E-15 Laplacian 0.1664315E-01 (-1/4)Del**2(Rho)) -0.4160788E-02 Diamond 0.1030538E-03 Metallicity 0.4561165E+00 Ellipticity -0.5843364E-01 Gb(Abramov) 0.3090159E-02 Vb(Abramov) -0.2019530E-02 Hb(Abramov) 0.1070629E-02 Ex_ueg -0.5035124E-03 Ec_ueg -0.1134634E-03 Delta_ex -0.5613898E-03 Delta_ec 0.9600970E-04 Delta_et -0.6711445E-03 Pxc 0.4437662E+01 Qxc -0.5847219E+01 3,+3 127 3 -1 1.731861 0.803372 -1.620511 Rho 0.3285560E-01 |GRAD(Rho)| 0.1016301E-15 GRAD(Rho)x -0.4894368E-16 GRAD(Rho)y -0.8692824E-16 GRAD(Rho)z 0.1940828E-16 Laplacian 0.1232904E+00 (-1/4)Del**2(Rho)) -0.3082261E-01 Diamond 0.3371939E-01 Metallicity 0.1883791E+01 Ellipticity 0.3472309E-01 Gb(Abramov) 0.3022563E-01 Vb(Abramov) -0.2962865E-01 Hb(Abramov) 0.5969751E-03 Ex_ueg -0.7771966E-02 Ec_ueg -0.1491821E-02 Delta_ex -0.9024876E-02 Delta_ec 0.3468986E-02 Delta_et -0.3267495E-01 Pxc 0.5209717E+01 Qxc -0.2601589E+01 3,-1 128 3 +3 2.334918 0.047496 -0.011309 Rho 0.3930430E-02 |GRAD(Rho)| 0.5364473E-17 GRAD(Rho)x 0.1574905E-17 GRAD(Rho)y -0.4397591E-17 GRAD(Rho)z 0.2637886E-17 Laplacian 0.1617704E-01 (-1/4)Del**2(Rho)) -0.4044261E-02 Diamond 0.1203660E-03 Metallicity 0.4169790E+00 Ellipticity -0.2671484E+00 Gb(Abramov) 0.2977236E-02 Vb(Abramov) -0.1910211E-02 Hb(Abramov) 0.1067025E-02 Ex_ueg -0.4581122E-03 Ec_ueg -0.1011793E-03 Delta_ex -0.5730637E-03 Delta_ec 0.1605271E-03 Delta_et -0.9546702E-03 Pxc 0.4527728E+01 Qxc -0.3569888E+01 3,+3 129 3 -1 3.054834 -0.800280 -2.002410 Rho 0.7084113E-01 |GRAD(Rho)| 0.1090926E-15 GRAD(Rho)x 0.1011891E-15 GRAD(Rho)y 0.4062709E-16 GRAD(Rho)z -0.3377544E-17 Laplacian 0.2808100E+00 (-1/4)Del**2(Rho)) -0.7020249E-01 Diamond 0.2257325E+00 Metallicity 0.2976298E+01 Ellipticity 0.1476390E-01 Gb(Abramov) 0.8162558E-01 Vb(Abramov) -0.9304867E-01 Hb(Abramov) -0.1142309E-01 Ex_ueg -0.2164873E-01 Ec_ueg -0.3595747E-02 Delta_ex -0.2518373E-01 Delta_ec 0.8205909E-02 Delta_et -0.9442478E-01 Pxc 0.6020648E+01 Qxc -0.3068975E+01 3,-1 130 3 +1 2.216073 -0.241977 -1.735441 Rho 0.2138570E-01 |GRAD(Rho)| 0.6595034E-16 GRAD(Rho)x 0.2127522E-16 GRAD(Rho)y 0.4976129E-16 GRAD(Rho)z -0.3769119E-16 Laplacian 0.8049222E-01 (-1/4)Del**2(Rho)) -0.2012306E-01 Diamond 0.8011322E-02 Metallicity 0.1410583E+01 Ellipticity -0.2689404E+01 Gb(Abramov) 0.1814624E-01 Vb(Abramov) -0.1616943E-01 Hb(Abramov) 0.1976813E-02 Ex_ueg -0.4384127E-02 Ec_ueg -0.9085208E-03 Delta_ex -0.4738380E-02 Delta_ec 0.1251013E-02 Delta_et -0.1066262E-01 Pxc 0.4825566E+01 Qxc -0.3787635E+01 3,+1 131 3 +1 2.262541 -0.391039 1.762019 Rho 0.1977622E-01 |GRAD(Rho)| 0.1718443E-16 GRAD(Rho)x 0.1097585E-16 GRAD(Rho)y -0.1255577E-16 GRAD(Rho)z 0.4145841E-17 Laplacian 0.7208691E-01 (-1/4)Del**2(Rho)) -0.1802173E-01 Diamond 0.5306219E-02 Metallicity 0.1382490E+01 Ellipticity -0.1832241E+01 Gb(Abramov) 0.1616696E-01 Vb(Abramov) -0.1431220E-01 Hb(Abramov) 0.1854765E-02 Ex_ueg -0.3949808E-02 Ec_ueg -0.8294839E-03 Delta_ex -0.3987169E-02 Delta_ec 0.8193077E-03 Delta_et -0.6975180E-02 Pxc 0.4761766E+01 Qxc -0.4866510E+01 3,+1 132 3 -1 1.739401 -1.009948 1.609146 Rho 0.3672382E-01 |GRAD(Rho)| 0.1008221E-13 GRAD(Rho)x -0.2183521E-14 GRAD(Rho)y -0.9837264E-14 GRAD(Rho)z -0.3338942E-15 Laplacian 0.1529578E+00 (-1/4)Del**2(Rho)) -0.3823946E-01 Diamond 0.5506836E-01 Metallicity 0.1827909E+01 Ellipticity 0.3793843E-01 Gb(Abramov) 0.3714268E-01 Vb(Abramov) -0.3604590E-01 Hb(Abramov) 0.1096780E-02 Ex_ueg -0.9015341E-02 Ec_ueg -0.1695367E-02 Delta_ex -0.1192597E-01 Delta_ec 0.5043217E-02 Delta_et -0.4900195E-01 Pxc 0.5317634E+01 Qxc -0.2364754E+01 3,-1 133 3 -1 2.053789 -1.612755 2.783957 Rho 0.1144171E+00 |GRAD(Rho)| 0.7669972E-13 GRAD(Rho)x -0.1407716E-13 GRAD(Rho)y -0.6384740E-13 GRAD(Rho)z -0.4010224E-13 Laplacian 0.4575982E+00 (-1/4)Del**2(Rho)) -0.1143995E+00 Diamond 0.6889786E+00 Metallicity 0.4060823E+01 Ellipticity 0.1142861E-01 Gb(Abramov) 0.1536924E+00 Vb(Abramov) -0.1929853E+00 Hb(Abramov) -0.3929287E-01 Ex_ueg -0.4102418E-01 Ec_ueg -0.6206378E-02 Delta_ex -0.4630774E-01 Delta_ec 0.1287864E-01 Delta_et -0.1648859E+00 Pxc 0.6610003E+01 Qxc -0.3595700E+01 3,-1 134 3 -1 1.730589 -0.979181 -1.613390 Rho 0.3969271E-01 |GRAD(Rho)| 0.2816956E-16 GRAD(Rho)x -0.2517890E-16 GRAD(Rho)y -0.9370302E-17 GRAD(Rho)z -0.8470224E-17 Laplacian 0.1506627E+00 (-1/4)Del**2(Rho)) -0.3766567E-01 Diamond 0.5485657E-01 Metallicity 0.2112477E+01 Ellipticity 0.9681395E-01 Gb(Abramov) 0.3837176E-01 Vb(Abramov) -0.3907785E-01 Hb(Abramov) -0.7060882E-03 Ex_ueg -0.9999985E-02 Ec_ueg -0.1853595E-02 Delta_ex -0.1165145E-01 Delta_ec 0.4397544E-02 Delta_et -0.4360234E-01 Pxc 0.5394913E+01 Qxc -0.2649537E+01 3,-1 135 3 +1 1.490268 -0.921675 2.258507 Rho 0.2520128E-01 |GRAD(Rho)| 0.1070507E-15 GRAD(Rho)x 0.2523817E-16 GRAD(Rho)y -0.6979561E-16 GRAD(Rho)z -0.7714566E-16 Laplacian 0.9347951E-01 (-1/4)Del**2(Rho)) -0.2336988E-01 Diamond 0.1051449E-01 Metallicity 0.1596863E+01 Ellipticity -0.2377934E+01 Gb(Abramov) 0.2179967E-01 Vb(Abramov) -0.2022946E-01 Hb(Abramov) 0.1570210E-02 Ex_ueg -0.5456931E-02 Ec_ueg -0.1098854E-02 Delta_ex -0.5627894E-02 Delta_ec 0.1231883E-02 Delta_et -0.1097558E-01 Pxc 0.4966022E+01 Qxc -0.4568530E+01 3,+1 136 3 +1 2.122560 0.055307 -2.894225 Rho 0.1148456E-01 |GRAD(Rho)| 0.4502535E-14 GRAD(Rho)x -0.9431709E-15 GRAD(Rho)y 0.3966532E-14 GRAD(Rho)z -0.1910464E-14 Laplacian 0.5158965E-01 (-1/4)Del**2(Rho)) -0.1289741E-01 Diamond 0.1644483E-02 Metallicity 0.7808627E+00 Ellipticity -0.1192343E+01 Gb(Abramov) 0.1027679E-01 Vb(Abramov) -0.7656174E-02 Hb(Abramov) 0.2620620E-02 Ex_ueg -0.1913687E-02 Ec_ueg -0.4358272E-03 Delta_ex -0.2414188E-02 Delta_ec 0.5044407E-03 Delta_et -0.3871821E-02 Pxc 0.4390932E+01 Qxc -0.4785871E+01 3,+1 137 3 -1 2.033102 1.584513 -2.728037 Rho 0.1654195E+00 |GRAD(Rho)| 0.8245124E-14 GRAD(Rho)x 0.4764120E-14 GRAD(Rho)y 0.2031842E-14 GRAD(Rho)z 0.6415360E-14 Laplacian 0.6426367E+00 (-1/4)Del**2(Rho)) -0.1606592E+00 Diamond 0.1458900E+01 Metallicity 0.5345137E+01 Ellipticity 0.3761159E-01 Gb(Abramov) 0.2502303E+00 Vb(Abramov) -0.3398015E+00 Hb(Abramov) -0.8957116E-01 Ex_ueg -0.6706574E-01 Ec_ueg -0.9437784E-02 Delta_ex -0.7065348E-01 Delta_ec 0.1581732E-01 Delta_et -0.2130244E+00 Pxc 0.7106090E+01 Qxc -0.4466844E+01 3,-1 138 3 -1 2.025835 1.577884 2.741494 Rho 0.1510822E+00 |GRAD(Rho)| 0.7031908E-15 GRAD(Rho)x -0.4026185E-15 GRAD(Rho)y -0.9851671E-16 GRAD(Rho)z 0.5680406E-15 Laplacian 0.5840988E+00 (-1/4)Del**2(Rho)) -0.1460247E+00 Diamond 0.1192768E+01 Metallicity 0.5056098E+01 Ellipticity 0.2786409E-01 Gb(Abramov) 0.2204023E+00 Vb(Abramov) -0.2947800E+00 Hb(Abramov) -0.7437764E-01 Ex_ueg -0.5942958E-01 Ec_ueg -0.8512824E-02 Delta_ex -0.6282613E-01 Delta_ec 0.1477281E-01 Delta_et -0.1968030E+00 Pxc 0.6981183E+01 Qxc -0.4252823E+01 3,-1 139 3 -1 3.061563 -0.816973 2.024856 Rho 0.5562956E-01 |GRAD(Rho)| 0.9465811E-16 GRAD(Rho)x -0.2084887E-16 GRAD(Rho)y 0.8712073E-16 GRAD(Rho)z -0.3058530E-16 Laplacian 0.2329075E+00 (-1/4)Del**2(Rho)) -0.5822688E-01 Diamond 0.1454403E+00 Metallicity 0.2398496E+01 Ellipticity 0.4306377E-02 Gb(Abramov) 0.6209408E-01 Vb(Abramov) -0.6596128E-01 Hb(Abramov) -0.3867201E-02 Ex_ueg -0.1568409E-01 Ec_ueg -0.2728339E-02 Delta_ex -0.2002961E-01 Delta_ec 0.7531097E-02 Delta_et -0.8186523E-01 Pxc 0.5748583E+01 Qxc -0.2659588E+01 3,-1 140 3 +3 2.025845 -0.013817 2.762386 Rho 0.1071129E-01 |GRAD(Rho)| 0.1257770E-16 GRAD(Rho)x -0.3374474E-17 GRAD(Rho)y 0.6174554E-18 GRAD(Rho)z -0.1210084E-16 Laplacian 0.4499548E-01 (-1/4)Del**2(Rho)) -0.1124887E-01 Diamond 0.1001233E-02 Metallicity 0.7971026E+00 Ellipticity -0.8906726E+00 Gb(Abramov) 0.8993663E-02 Vb(Abramov) -0.6738457E-02 Hb(Abramov) 0.2255206E-02 Ex_ueg -0.1743844E-02 Ec_ueg -0.4004095E-03 Delta_ex -0.1964533E-02 Delta_ec 0.2587637E-03 Delta_et -0.2150972E-02 Pxc 0.4355152E+01 Qxc -0.7591994E+01 3,+3 141 3 +1 2.984180 0.041642 0.219152 Rho 0.4625860E-02 |GRAD(Rho)| 0.2310415E-17 GRAD(Rho)x 0.3411825E-18 GRAD(Rho)y -0.1544994E-17 GRAD(Rho)z -0.1683628E-17 Laplacian 0.1847497E-01 (-1/4)Del**2(Rho)) -0.4618743E-02 Diamond 0.3716262E-03 Metallicity 0.4790162E+00 Ellipticity -0.2440577E+01 Gb(Abramov) 0.3447904E-02 Vb(Abramov) -0.2277065E-02 Hb(Abramov) 0.1170839E-02 Ex_ueg -0.5692570E-03 Ec_ueg -0.1308477E-03 Delta_ex -0.8880123E-03 Delta_ec 0.5515081E-03 Delta_et -0.2938278E-02 Pxc 0.4350530E+01 Qxc -0.1610153E+01 3,+1 142 3 -1 1.824771 2.390721 -1.568867 Rho 0.1266465E+00 |GRAD(Rho)| 0.2453853E-15 GRAD(Rho)x -0.1586323E-15 GRAD(Rho)y 0.1517476E-15 GRAD(Rho)z 0.1096467E-15 Laplacian 0.5305364E+00 (-1/4)Del**2(Rho)) -0.1326341E+00 Diamond 0.8749059E+00 Metallicity 0.4148456E+01 Ellipticity 0.1020827E-01 Gb(Abramov) 0.1801272E+00 Vb(Abramov) -0.2276203E+00 Hb(Abramov) -0.4749308E-01 Ex_ueg -0.4697237E-01 Ec_ueg -0.6965772E-02 Delta_ex -0.5464857E-01 Delta_ec 0.1397116E-01 Delta_et -0.1811327E+00 Pxc 0.6743312E+01 Qxc -0.3911528E+01 3,-1 143 3 -1 2.803150 -1.738700 -0.917779 Rho 0.1557918E+00 |GRAD(Rho)| 0.7356482E-14 GRAD(Rho)x -0.1037575E-14 GRAD(Rho)y 0.5032433E-14 GRAD(Rho)z 0.5264588E-14 Laplacian 0.6325902E+00 (-1/4)Del**2(Rho)) -0.1581476E+00 Diamond 0.1335478E+01 Metallicity 0.4913582E+01 Ellipticity 0.8434029E-02 Gb(Abramov) 0.2349435E+00 Vb(Abramov) -0.3117395E+00 Hb(Abramov) -0.7679598E-01 Ex_ueg -0.6191241E-01 Ec_ueg -0.8815296E-02 Delta_ex -0.6851325E-01 Delta_ec 0.1579520E-01 Delta_et -0.2110969E+00 Pxc 0.7023294E+01 Qxc -0.4337598E+01 3,-1 144 3 -1 2.797810 -1.770187 0.865048 Rho 0.1077396E+00 |GRAD(Rho)| 0.6101826E-15 GRAD(Rho)x -0.7450163E-16 GRAD(Rho)y 0.2067878E-15 GRAD(Rho)z -0.5692197E-15 Laplacian 0.4662068E+00 (-1/4)Del**2(Rho)) -0.1165517E+00 Diamond 0.6568700E+00 Metallicity 0.3605734E+01 Ellipticity 0.6709511E-02 Gb(Abramov) 0.1477435E+00 Vb(Abramov) -0.1789354E+00 Hb(Abramov) -0.3119183E-01 Ex_ueg -0.3786334E-01 Ec_ueg -0.5796229E-02 Delta_ex -0.4658132E-01 Delta_ec 0.1340828E-01 Delta_et -0.1698443E+00 Pxc 0.6532410E+01 Qxc -0.3474070E+01 3,-1 145 3 -1 3.229882 2.392218 -2.219752 Rho 0.2224233E+00 |GRAD(Rho)| 0.2446076E-14 GRAD(Rho)x 0.6555086E-15 GRAD(Rho)y 0.2329950E-14 GRAD(Rho)z -0.3534499E-15 Laplacian 0.8078635E+00 (-1/4)Del**2(Rho)) -0.2019659E+00 Diamond 0.2622599E+01 Metallicity 0.6964803E+01 Ellipticity 0.2302874E-02 Gb(Abramov) 0.3690860E+00 Vb(Abramov) -0.5362061E+00 Hb(Abramov) -0.1671201E+00 Ex_ueg -0.9953106E-01 Ec_ueg -0.1323255E-01 Delta_ex -0.9578488E-01 Delta_ec 0.1840699E-01 Delta_et -0.2547604E+00 Pxc 0.7521683E+01 Qxc -0.5203723E+01 3,-1 146 3 -1 3.217607 2.405258 2.230436 Rho 0.2212075E+00 |GRAD(Rho)| 0.1113144E-14 GRAD(Rho)x 0.9081277E-15 GRAD(Rho)y 0.6124116E-15 GRAD(Rho)z 0.1983548E-15 Laplacian 0.8061712E+00 (-1/4)Del**2(Rho)) -0.2015428E+00 Diamond 0.2597635E+01 Metallicity 0.6915957E+01 Ellipticity 0.5563147E-02 Gb(Abramov) 0.3666721E+00 Vb(Abramov) -0.5318014E+00 Hb(Abramov) -0.1651293E+00 Ex_ueg -0.9880635E-01 Ec_ueg -0.1314972E-01 Delta_ex -0.9543545E-01 Delta_ec 0.1837304E-01 Delta_et -0.2541147E+00 Pxc 0.7513949E+01 Qxc -0.5194321E+01 3,-1 147 3 -1 3.430598 -2.277444 2.260594 Rho 0.1880214E+00 |GRAD(Rho)| 0.1745385E-13 GRAD(Rho)x -0.1403397E-13 GRAD(Rho)y -0.9178801E-14 GRAD(Rho)z -0.4840908E-14 Laplacian 0.7035029E+00 (-1/4)Del**2(Rho)) -0.1758757E+00 Diamond 0.1878629E+01 Metallicity 0.6044487E+01 Ellipticity 0.2212094E-01 Gb(Abramov) 0.2944302E+00 Vb(Abramov) -0.4129848E+00 Hb(Abramov) -0.1185545E+00 Ex_ueg -0.7955390E-01 Ec_ueg -0.1092043E-01 Delta_ex -0.7999298E-01 Delta_ec 0.1695406E-01 Delta_et -0.2321661E+00 Pxc 0.7284867E+01 Qxc -0.4718219E+01 3,-1 148 3 -1 3.403483 -2.246342 -2.255689 Rho 0.2147435E+00 |GRAD(Rho)| 0.3256914E-13 GRAD(Rho)x -0.2707676E-13 GRAD(Rho)y 0.1366003E-13 GRAD(Rho)z 0.1187443E-13 Laplacian 0.7831817E+00 (-1/4)Del**2(Rho)) -0.1957954E+00 Diamond 0.2439900E+01 Metallicity 0.6775647E+01 Ellipticity 0.1309258E-01 Gb(Abramov) 0.3516371E+00 Vb(Abramov) -0.5074788E+00 Hb(Abramov) -0.1558417E+00 Ex_ueg -0.9497556E-01 Ec_ueg -0.1271071E-01 Delta_ex -0.9203678E-01 Delta_ec 0.1805195E-01 Delta_et -0.2494166E+00 Pxc 0.7472091E+01 Qxc -0.5098441E+01 3,-1 149 3 -1 2.803734 1.738576 0.897868 Rho 0.1383240E+00 |GRAD(Rho)| 0.2398993E-14 GRAD(Rho)x 0.2350211E-14 GRAD(Rho)y -0.4792894E-15 GRAD(Rho)z 0.4420834E-16 Laplacian 0.5740833E+00 (-1/4)Del**2(Rho)) -0.1435208E+00 Diamond 0.1056558E+01 Metallicity 0.4440863E+01 Ellipticity 0.1441979E-01 Gb(Abramov) 0.2019066E+00 Vb(Abramov) -0.2602924E+00 Hb(Abramov) -0.5838578E-01 Ex_ueg -0.5283419E-01 Ec_ueg -0.7700323E-02 Delta_ex -0.6045375E-01 Delta_ec 0.1488009E-01 Delta_et -0.1957987E+00 Pxc 0.6861295E+01 Qxc -0.4062728E+01 3,-1 150 3 -1 -3.416845 -2.199141 -2.361952 Rho 0.1868368E+00 |GRAD(Rho)| 0.1440616E-14 GRAD(Rho)x -0.2084921E-15 GRAD(Rho)y -0.1378414E-14 GRAD(Rho)z -0.3631535E-15 Laplacian 0.7049268E+00 (-1/4)Del**2(Rho)) -0.1762317E+00 Diamond 0.1869172E+01 Metallicity 0.5969070E+01 Ellipticity 0.2462909E-01 Gb(Abramov) 0.2928110E+00 Vb(Abramov) -0.4093904E+00 Hb(Abramov) -0.1165793E+00 Ex_ueg -0.7888633E-01 Ec_ueg -0.1084200E-01 Delta_ex -0.8003425E-01 Delta_ec 0.1702994E-01 Delta_et -0.2330997E+00 Pxc 0.7275995E+01 Qxc -0.4699621E+01 3,-1 151 3 -1 -3.346738 -2.125767 2.350295 Rho 0.2143374E+00 |GRAD(Rho)| 0.4395626E-14 GRAD(Rho)x -0.6240126E-15 GRAD(Rho)y -0.4120470E-14 GRAD(Rho)z 0.1397808E-14 Laplacian 0.7945162E+00 (-1/4)Del**2(Rho)) -0.1986290E+00 Diamond 0.2462875E+01 Metallicity 0.6657948E+01 Ellipticity 0.1531747E-01 Gb(Abramov) 0.3528297E+00 Vb(Abramov) -0.5070303E+00 Hb(Abramov) -0.1542006E+00 Ex_ueg -0.9473615E-01 Ec_ueg -0.1268320E-01 Delta_ex -0.9328177E-01 Delta_ec 0.1824880E-01 Delta_et -0.2518247E+00 Pxc 0.7469420E+01 Qxc -0.5111666E+01 3,-1 152 3 -1 -1.819847 1.606740 2.347098 Rho 0.1532082E+00 |GRAD(Rho)| 0.3389782E-14 GRAD(Rho)x 0.2461166E-14 GRAD(Rho)y 0.1930618E-14 GRAD(Rho)z 0.1306138E-14 Laplacian 0.6265240E+00 (-1/4)Del**2(Rho)) -0.1566310E+00 Diamond 0.1296863E+01 Metallicity 0.4824795E+01 Ellipticity 0.1059775E-01 Gb(Abramov) 0.2303727E+00 Vb(Abramov) -0.3041145E+00 Hb(Abramov) -0.7374173E-01 Ex_ueg -0.6054725E-01 Ec_ueg -0.8649201E-02 Delta_ex -0.6758118E-01 Delta_ec 0.1571812E-01 Delta_et -0.2096229E+00 Pxc 0.7000329E+01 Qxc -0.4299572E+01 3,-1 153 3 -1 -0.611075 -0.740489 -3.296213 Rho 0.1423106E+00 |GRAD(Rho)| 0.1962917E-12 GRAD(Rho)x 0.1303536E-12 GRAD(Rho)y 0.1289315E-12 GRAD(Rho)z -0.7010736E-13 Laplacian 0.6004469E+00 (-1/4)Del**2(Rho)) -0.1501117E+00 Diamond 0.1157878E+01 Metallicity 0.4451785E+01 Ellipticity 0.1436763E-01 Gb(Abramov) 0.2114520E+00 Vb(Abramov) -0.2727923E+00 Hb(Abramov) -0.6134028E-01 Ex_ueg -0.5487420E-01 Ec_ueg -0.7953116E-02 Delta_ex -0.6382321E-01 Delta_ec 0.1573134E-01 Delta_et -0.2084746E+00 Pxc 0.6899711E+01 Qxc -0.4057073E+01 3,-1 154 3 +1 1.088222 -0.591893 -2.548494 Rho 0.2743891E-01 |GRAD(Rho)| 0.3202234E-16 GRAD(Rho)x 0.1192996E-16 GRAD(Rho)y -0.1576922E-16 GRAD(Rho)z 0.2518805E-16 Laplacian 0.1067677E+00 (-1/4)Del**2(Rho)) -0.2669192E-01 Diamond 0.1539847E-01 Metallicity 0.1611084E+01 Ellipticity -0.3674823E+01 Gb(Abramov) 0.2496176E-01 Vb(Abramov) -0.2323161E-01 Hb(Abramov) 0.1730154E-02 Ex_ueg -0.6112339E-02 Ec_ueg -0.1212276E-02 Delta_ex -0.6762435E-02 Delta_ec 0.1730335E-02 Delta_et -0.1563626E-01 Pxc 0.5042035E+01 Qxc -0.3908166E+01 3,+1 155 3 -1 -0.580929 -0.778056 0.024473 Rho 0.1856867E+00 |GRAD(Rho)| 0.6797495E-13 GRAD(Rho)x 0.1360717E-13 GRAD(Rho)y -0.6659603E-13 GRAD(Rho)z 0.6381072E-15 Laplacian 0.4837176E+00 (-1/4)Del**2(Rho)) -0.1209294E+00 Diamond 0.1271627E+01 Metallicity 0.8609724E+01 Ellipticity 0.2707640E-01 Gb(Abramov) 0.2541477E+00 Vb(Abramov) -0.3873661E+00 Hb(Abramov) -0.1332183E+00 Ex_ueg -0.7823951E-01 Ec_ueg -0.1076592E-01 Delta_ex -0.5482228E-01 Delta_ec 0.1168479E-01 Delta_et -0.1597755E+00 Pxc 0.7267331E+01 Qxc -0.4691762E+01 3,-1 156 3 -1 -0.076400 -0.009022 4.529970 Rho 0.1968988E+00 |GRAD(Rho)| 0.6858379E-13 GRAD(Rho)x 0.1433898E-13 GRAD(Rho)y -0.1792664E-14 GRAD(Rho)z -0.6704414E-13 Laplacian 0.7574018E+00 (-1/4)Del**2(Rho)) -0.1893505E+00 Diamond 0.2114628E+01 Metallicity 0.6063059E+01 Ellipticity 0.4437760E-02 Gb(Abramov) 0.3175741E+00 Vb(Abramov) -0.4457978E+00 Hb(Abramov) -0.1282237E+00 Ex_ueg -0.8460104E-01 Ec_ueg -0.1151075E-01 Delta_ex -0.8697400E-01 Delta_ec 0.1774128E-01 Delta_et -0.2430361E+00 Pxc 0.7349743E+01 Qxc -0.4902353E+01 3,-1 157 3 -1 0.100958 4.567122 0.027866 Rho 0.2211344E+00 |GRAD(Rho)| 0.4223427E-08 GRAD(Rho)x 0.9665056E-09 GRAD(Rho)y 0.4110283E-08 GRAD(Rho)z 0.9370785E-10 Laplacian 0.8147979E+00 (-1/4)Del**2(Rho)) -0.2036995E+00 Diamond 0.2618623E+01 Metallicity 0.6838969E+01 Ellipticity 0.2775398E-02 Gb(Abramov) 0.3679820E+00 Vb(Abramov) -0.5322646E+00 Hb(Abramov) -0.1642826E+00 Ex_ueg -0.9876284E-01 Ec_ueg -0.1314475E-01 Delta_ex -0.9641422E-01 Delta_ec 0.1851027E-01 Delta_et -0.2557667E+00 Pxc 0.7513483E+01 Qxc -0.5208687E+01 3,-1 158 3 -1 1.812695 2.370501 1.583102 Rho 0.1266334E+00 |GRAD(Rho)| 0.5237715E-13 GRAD(Rho)x 0.3182717E-13 GRAD(Rho)y 0.3322386E-13 GRAD(Rho)z -0.2503142E-13 Laplacian 0.5321990E+00 (-1/4)Del**2(Rho)) -0.1330498E+00 Diamond 0.8783717E+00 Metallicity 0.4134786E+01 Ellipticity 0.1205134E-01 Gb(Abramov) 0.1803886E+00 Vb(Abramov) -0.2277273E+00 Hb(Abramov) -0.4733879E-01 Ex_ueg -0.4696593E-01 Ec_ueg -0.6964957E-02 Delta_ex -0.5482887E-01 Delta_ec 0.1403384E-01 Delta_et -0.1819756E+00 Pxc 0.6743175E+01 Qxc -0.3906904E+01 3,-1 159 3 -1 2.071517 -2.739999 1.775756 Rho 0.2015483E+00 |GRAD(Rho)| 0.1516250E-12 GRAD(Rho)x 0.1478756E-12 GRAD(Rho)y 0.3303662E-13 GRAD(Rho)z 0.5615246E-14 Laplacian 0.7779321E+00 (-1/4)Del**2(Rho)) -0.1944830E+00 Diamond 0.2234499E+01 Metallicity 0.6137194E+01 Ellipticity 0.5478725E-02 Gb(Abramov) 0.3285854E+00 Vb(Abramov) -0.4626877E+00 Hb(Abramov) -0.1341023E+00 Ex_ueg -0.8727512E-01 Ec_ueg -0.1182169E-01 Delta_ex -0.8987068E-01 Delta_ec 0.1811528E-01 Delta_et -0.2486595E+00 Pxc 0.7382625E+01 Qxc -0.4961042E+01 3,-1 160 3 -1 2.045875 -2.635986 -1.786263 Rho 0.2264136E+00 |GRAD(Rho)| 0.3703595E-13 GRAD(Rho)x 0.2470165E-13 GRAD(Rho)y -0.1789291E-13 GRAD(Rho)z 0.2100795E-13 Laplacian 0.8662434E+00 (-1/4)Del**2(Rho)) -0.2165608E+00 Diamond 0.2842248E+01 Metallicity 0.6690791E+01 Ellipticity 0.2220219E-02 Gb(Abramov) 0.3858678E+00 Vb(Abramov) -0.5551747E+00 Hb(Abramov) -0.1693069E+00 Ex_ueg -0.1019190E+00 Ec_ueg -0.1350498E-01 Delta_ex -0.1030040E+00 Delta_ec 0.1932194E-01 Delta_et -0.2664061E+00 Pxc 0.7546769E+01 Qxc -0.5330933E+01 3,-1 161 3 -1 3.066203 0.891914 -2.005741 Rho 0.1819696E+00 |GRAD(Rho)| 0.3632694E-13 GRAD(Rho)x 0.1531696E-13 GRAD(Rho)y 0.7472592E-14 GRAD(Rho)z -0.3208111E-13 Laplacian 0.7044609E+00 (-1/4)Del**2(Rho)) -0.1761152E+00 Diamond 0.1791026E+01 Metallicity 0.5715938E+01 Ellipticity 0.4327308E-01 Gb(Abramov) 0.2851874E+00 Vb(Abramov) -0.3942596E+00 Hb(Abramov) -0.1090722E+00 Ex_ueg -0.7615821E-01 Ec_ueg -0.1052056E-01 Delta_ex -0.7930754E-01 Delta_ec 0.1688199E-01 Delta_et -0.2296803E+00 Pxc 0.7238988E+01 Qxc -0.4697760E+01 3,-1 162 3 -1 3.080494 0.903642 2.029729 Rho 0.1905679E+00 |GRAD(Rho)| 0.1363516E-13 GRAD(Rho)x -0.6219499E-14 GRAD(Rho)y -0.1152762E-13 GRAD(Rho)z -0.3788074E-14 Laplacian 0.7336725E+00 (-1/4)Del**2(Rho)) -0.1834181E+00 Diamond 0.1969548E+01 Metallicity 0.5927347E+01 Ellipticity 0.3473042E-01 Gb(Abramov) 0.3034759E+00 Vb(Abramov) -0.4235337E+00 Hb(Abramov) -0.1200578E+00 Ex_ueg -0.8099371E-01 Ec_ueg -0.1108931E-01 Delta_ex -0.8355175E-01 Delta_ec 0.1733904E-01 Delta_et -0.2368548E+00 Pxc 0.7303765E+01 Qxc -0.4818708E+01 3,-1 163 3 -1 -3.088898 -2.119829 0.848681 Rho 0.1572118E+00 |GRAD(Rho)| 0.2892641E-15 GRAD(Rho)x 0.1071598E-15 GRAD(Rho)y 0.3704075E-16 GRAD(Rho)z 0.2661174E-15 Laplacian 0.6020639E+00 (-1/4)Del**2(Rho)) -0.1505160E+00 Diamond 0.1294679E+01 Metallicity 0.5241380E+01 Ellipticity 0.4612836E-01 Gb(Abramov) 0.2318292E+00 Vb(Abramov) -0.3131425E+00 Hb(Abramov) -0.8131325E-01 Ex_ueg -0.6266597E-01 Ec_ueg -0.8906758E-02 Delta_ex -0.6544462E-01 Delta_ec 0.1516098E-01 Delta_et -0.2032633E+00 Pxc 0.7035778E+01 Qxc -0.4316648E+01 3,-1 164 3 -1 2.800122 1.740221 -0.885479 Rho 0.1316121E+00 |GRAD(Rho)| 0.4678153E-16 GRAD(Rho)x -0.1078442E-16 GRAD(Rho)y 0.3538586E-16 GRAD(Rho)z -0.2863649E-16 Laplacian 0.5509305E+00 (-1/4)Del**2(Rho)) -0.1377326E+00 Diamond 0.9529412E+00 Metallicity 0.4259343E+01 Ellipticity 0.1157301E-01 Gb(Abramov) 0.1895968E+00 Vb(Abramov) -0.2414610E+00 Hb(Abramov) -0.5186420E-01 Ex_ueg -0.4944390E-01 Ec_ueg -0.7277030E-02 Delta_ex -0.5729483E-01 Delta_ec 0.1440586E-01 Delta_et -0.1879976E+00 Pxc 0.6794517E+01 Qxc -0.3977188E+01 3,-1 165 3 -1 2.099822 -1.548107 -2.751000 Rho 0.1444612E+00 |GRAD(Rho)| 0.3583403E-09 GRAD(Rho)x -0.1716177E-09 GRAD(Rho)y 0.1103761E-09 GRAD(Rho)z -0.2945713E-09 Laplacian 0.5489918E+00 (-1/4)Del**2(Rho)) -0.1372479E+00 Diamond 0.1068261E+01 Metallicity 0.4992285E+01 Ellipticity 0.2212452E-01 Gb(Abramov) 0.2056954E+00 Vb(Abramov) -0.2741429E+00 Hb(Abramov) -0.6844748E-01 Ex_ueg -0.5598263E-01 Ec_ueg -0.8089899E-02 Delta_ex -0.5846633E-01 Delta_ec 0.1415066E-01 Delta_et -0.1875668E+00 Pxc 0.6920066E+01 Qxc -0.4131702E+01 3,-1 166 3 -1 -3.270490 2.256002 -2.345174 Rho 0.1910199E+00 |GRAD(Rho)| 0.2100267E-15 GRAD(Rho)x 0.6049848E-16 GRAD(Rho)y -0.5754403E-16 GRAD(Rho)z 0.1927169E-15 Laplacian 0.7283720E+00 (-1/4)Del**2(Rho)) -0.1820930E+00 Diamond 0.1965916E+01 Metallicity 0.5994102E+01 Ellipticity 0.3334725E-02 Gb(Abramov) 0.3033093E+00 Vb(Abramov) -0.4245257E+00 Hb(Abramov) -0.1212163E+00 Ex_ueg -0.8124994E-01 Ec_ueg -0.1111932E-01 Delta_ex -0.8303430E-01 Delta_ec 0.1726751E-01 Delta_et -0.2361395E+00 Pxc 0.7307095E+01 Qxc -0.4808703E+01 3,-1 167 3 -1 -3.215769 2.251554 2.340975 Rho 0.2174435E+00 |GRAD(Rho)| 0.1232245E-12 GRAD(Rho)x 0.8248746E-13 GRAD(Rho)y -0.4334404E-13 GRAD(Rho)z -0.8063125E-13 Laplacian 0.8050535E+00 (-1/4)Del**2(Rho)) -0.2012634E+00 Diamond 0.2530356E+01 Metallicity 0.6730271E+01 Ellipticity 0.1650068E-02 Gb(Abramov) 0.3599351E+00 Vb(Abramov) -0.5186068E+00 Hb(Abramov) -0.1586717E+00 Ex_ueg -0.9657107E-01 Ec_ueg -0.1289380E-01 Delta_ex -0.9481698E-01 Delta_ec 0.1832126E-01 Delta_et -0.2526899E+00 Pxc 0.7489727E+01 Qxc -0.5175242E+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 74 117 101 103 125 118 156 116 155 115 104 114 153 105 113 120 119 102 123 122 107 106 157 132 144 159 139 133 147 127 164 142 161 137 145 53 69 84 68 79 166 76 57 77 163 63 151 74 58 73 64 62 150 85 71 152 83 70 167 93 149 158 162 138 146 134 143 160 129 165 148 96 98 97 82 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 21 22 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 36 24 27 37 2.359078 2.034893 1.984333 2.049871 1.969812 1.818600 1.726650 1.699187 1.727628 1.738163 2.386371 1.932912 1.965585 2.048739 2.113350 1.820891 2.434971 1.935685 1.935600 1.919387 1.888396 1.774322 2.481959 2.035580 1.809693 2.317957 2.027980 1.837642 2.552722 1.965355 1.981649 1.850211 1.886861 1.772433 2.440209 1.868285 1.980818 2.060674 2.137566 1.830455 2.346785 2.231335 1.944484 1.907417 1.773785 1.786878 2.440423 2.186162 2.027617 2.077886 1.832625 1.839714 2.409990 1.823669 1.909785 1.929780 2.063903 1.780875 2.520974 1.946191 1.982253 1.833375 1.923052 1.774539 2.466256 1.901639 1.765009 2.227160 1.943038 1.786424 3.606410 3.181574 3.304662 3.620908 2.361044 2.035133 1.984622 2.050111 1.970086 1.818609 1.726684 1.699232 1.727660 1.738176 2.388648 1.933103 1.965783 2.048994 2.113614 1.820902 2.436827 1.936145 1.936057 1.919860 1.888762 1.774324 2.484268 2.035790 1.809716 2.318235 2.028200 1.837656 2.554223 1.965799 1.982103 1.850564 1.887241 1.772443 2.441983 1.868434 1.980966 2.060891 2.137879 1.830459 2.349263 2.231608 1.944830 1.907859 1.773797 1.786894 2.442801 2.186328 2.027747 2.078138 1.832631 1.839722 2.411356 1.824031 1.910045 1.930248 2.064319 1.780888 2.522481 1.946655 1.982672 1.833647 1.923500 1.774549 2.467561 1.901940 1.765035 2.227534 1.943505 1.786450 3.607764 3.183045 3.307134 3.621508 29 30 26 25 27 23 22 21 24 23 28 23 27 24 27 24 29 26 26 25 27 21 29 26 22 27 26 23 29 23 25 23 24 23 27 23 27 26 29 22 27 26 25 23 23 24 27 26 25 26 24 23 31 23 23 27 27 23 33 25 23 23 25 25 27 26 22 28 23 25 39 37 37 39 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 Ta W Ta W Ta 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 2.1389 2.3892 2.1257 2.3837 1.9806 2.3508 2.0843 2.3117 1.9990 2.3539 2.3496 2.2778 -1.0975 -1.0056 -1.0892 -1.0919 -0.9320 -1.0119 -0.9969 -0.9863 -0.8437 -0.9787 -1.0363 -0.9903 -1.0328 -1.0153 -0.9807 -0.9608 -0.9583 -1.0390 -0.9776 -1.0355 -1.0238 -1.0468 -1.0124 -1.0133 -0.8908 -1.0100 -1.0643 -1.0070 -0.9955 -0.9373 -1.0028 -0.9081 -1.0345 -0.9050 -1.0217 -0.9339 -1.0428 -0.9245 -0.9104 2.1252 0.8755 2.1291 2.1117 2.1650 2.1223 2.1327 2.1552 2.1675 2.1205 2.1251 2.1547 1.9380 1.9486 1.9387 1.9323 1.9385 1.9257 1.9271 1.9255 1.9515 1.9268 1.9200 1.9259 1.9202 1.9228 1.9261 1.9332 1.9411 1.9297 1.9376 1.9300 1.9298 1.9285 1.9322 1.9251 1.9435 1.9334 1.9240 1.9322 1.9321 1.9431 1.9317 1.9457 1.9273 1.9473 1.9291 1.9416 1.9251 1.9444 1.9464 6.0929 1.1981 6.0987 6.0973 6.1089 6.1101 6.0935 6.1104 6.1093 6.1053 6.1082 6.1270 5.1256 5.0230 5.1165 5.1255 4.9636 5.0603 5.0453 5.0329 4.8603 5.0242 5.0929 5.0379 5.0883 5.0670 5.0268 5.0026 4.9891 5.0823 5.0117 5.0789 5.0667 5.0923 5.0522 5.0664 4.9180 5.0498 5.1161 5.0471 5.0401 4.9661 5.0480 4.9328 5.0856 4.9277 5.0704 4.9642 5.0963 4.9514 4.9343 2.6079 10.5372 2.6118 3.3772 2.7132 3.3872 2.6548 3.3938 2.6910 3.3904 3.3873 3.4118 0.0339 0.0339 0.0340 0.0341 0.0300 0.0259 0.0244 0.0279 0.0319 0.0277 0.0234 0.0264 0.0243 0.0254 0.0278 0.0250 0.0280 0.0270 0.0283 0.0267 0.0273 0.0260 0.0279 0.0217 0.0294 0.0268 0.0242 0.0276 0.0233 0.0281 0.0231 0.0296 0.0216 0.0300 0.0222 0.0280 0.0213 0.0287 0.0297 14.0351 0.0000 14.0348 14.0301 14.0323 14.0297 14.0346 14.0290 14.0334 14.0299 14.0298 14.0287 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 Ta As Ta W Ta W Ta 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 2.362419 2.300733 2.354291 2.492143 2.303373 2.482721 2.329618 2.484586 2.334824 2.475215 2.482275 2.456343 -1.086388 -1.038806 -1.083463 -1.090909 -0.988341 -1.040962 -1.076209 -1.014186 -0.927474 -1.015921 -1.085872 -1.035136 -1.082596 -1.044404 -1.016385 -1.065898 -1.016555 -1.051637 -1.015387 -1.062168 -1.048510 -1.064484 -1.033810 -1.119919 -0.959052 -1.043815 -1.098551 -1.036616 -1.104717 -1.009083 -1.114665 -0.974779 -1.158027 -0.968901 -1.143423 -1.002022 -1.167762 -0.995474 -0.976235 1.833214 1.761138 1.831112 1.918520 1.848037 1.918028 1.807799 1.956791 1.858130 1.909195 1.916393 1.940127 -0.691782 -0.695000 -0.688078 -0.688410 -0.765115 -0.763227 -0.840883 -0.748156 -0.835917 -0.747394 -0.831752 -0.785841 -0.835066 -0.765206 -0.752060 -1.004715 -0.881203 -0.889233 -0.872831 -0.910183 -0.899126 -0.898091 -0.882310 -1.077337 -0.884868 -0.905325 -0.941210 -0.892696 -1.068256 -0.957746 -1.082657 -0.912737 -1.136296 -0.905680 -1.110046 -0.954861 -1.149696 -0.933226 -0.914272 1.951824 1.702904 1.952082 2.027193 1.956779 2.032956 1.935670 2.070213 1.984462 2.027032 2.031693 2.046452 -0.775544 -0.757261 -0.778000 -0.777147 -0.833626 -0.870840 -0.923826 -0.856070 -0.829657 -0.837318 -0.942255 -0.864844 -0.920504 -0.874531 -0.844096 -1.009731 -0.885410 -0.930311 -0.886742 -0.950481 -0.926560 -0.952305 -0.913955 -1.067716 -0.861672 -0.926462 -1.000679 -0.911772 -1.038550 -0.929526 -1.050338 -0.875975 -1.118220 -0.870821 -1.080394 -0.934934 -1.137933 -0.893347 -0.879907 7.72754491 8.95142110 4.70605997 12.72752492 -32.23754881 8.55941352 -47.35116680 53.69975804 4.04847621 -21.46220923 -350.1240 411.4266 76.6486 -437.6113 -170.7563 -470.4165 Jun20-2024 06:06:50 Nodes: 1 Procs: 1 Jun20-2024 06:06:54 Nodes: 1 Procs: 1 0 Jun20-2024 06:06:58 Nodes: 1 Procs: 1 Jun20-2024 06:07:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 06:07:06 Nodes: 1 Procs: 1 Jun20-2024 06:07:08 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun20-2024 06:07:10 Nodes: 1 Procs: 1 Jun20-2024 06:07:13 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Jun20-2024 06:07:19 Nodes: 1 Procs: 5 *** (NO TITLE) *** -12 -16.79562571 -17.08499490 -17.14697648 -17.14481131 -17.21653219 -17.25220071 -17.26375960 -17.27245924 -17.27942259 -17.28203992 -17.28448701 -17.28587259 -17.28671250 -17.28688178 -17.28700654 -17.28740571 -17.28745465 -17.28750188 -17.28750361 -17.28748840 GEOMETRY CONVERGED