ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun21-2024 16:27:37 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.70 0.04 11.32 1 2 3 1 1.000 0.000 0.000 0.000 -6.493 2.471 41.409 11.031 S S S P S S P S 1 2 1 3 1.00 0.00 0.00 0.00 -6.4931 2.4706 11.0309 41.4090 1 H -0.0000 1.0000 0.0000 0.0000 0.0000 Jun21-2024 16:27:37 Nodes: 1 Procs: 1 Jun21-2024 16:27:42 Nodes: 1 Procs: 1 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun21-2024 16:27:53 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.36 0.06 2.20 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 Jun21-2024 16:27:37 Nodes: 1 Procs: 1 Jun21-2024 16:27:42 Nodes: 1 Procs: 1 0 Jun21-2024 16:27:53 Nodes: 1 Procs: 1 Jun21-2024 16:27:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun21-2024 16:27:58 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.45 0.07 3.43 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 Jun21-2024 16:27:37 Nodes: 1 Procs: 1 Jun21-2024 16:27:42 Nodes: 1 Procs: 1 0 Jun21-2024 16:27:53 Nodes: 1 Procs: 1 Jun21-2024 16:27:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun21-2024 16:27:58 Nodes: 1 Procs: 1 Jun21-2024 16:28:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun21-2024 16:28:05 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.91 0.04 1.73 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 Jun21-2024 16:27:37 Nodes: 1 Procs: 1 Jun21-2024 16:27:42 Nodes: 1 Procs: 1 0 Jun21-2024 16:27:53 Nodes: 1 Procs: 1 Jun21-2024 16:27:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun21-2024 16:27:58 Nodes: 1 Procs: 1 Jun21-2024 16:28:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun21-2024 16:28:05 Nodes: 1 Procs: 1 Jun21-2024 16:28:07 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun21-2024 16:28:09 Hydrogen (TZP) c1-13 c1-13 c1-13 c1-13 c1-13 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.44 0.08 3.00 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 Jun21-2024 16:27:37 Nodes: 1 Procs: 1 Jun21-2024 16:27:42 Nodes: 1 Procs: 1 0 Jun21-2024 16:27:53 Nodes: 1 Procs: 1 Jun21-2024 16:27:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun21-2024 16:27:58 Nodes: 1 Procs: 1 Jun21-2024 16:28:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun21-2024 16:28:05 Nodes: 1 Procs: 1 Jun21-2024 16:28:07 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun21-2024 16:28:09 Nodes: 1 Procs: 1 Jun21-2024 16:28:12 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun21-2024 16:28:17 Hydrogen (TZP) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP TZP 2900.7329000000063 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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 Jun21-2024 16:28:01 1 1 Tantalum TZP 4d t21.W ADF 2019.304 Jun21-2024 16:28:12 1 1 Tungsten TZP 4d t21.O ADF 2019.304 Jun21-2024 16:28:07 1 1 Oxygen TZP 1s t21.As ADF 2019.304 Jun21-2024 16:27:55 1 1 Arsenic TZP 3p t21.H ADF 2019.304 Jun21-2024 16:27:42 1 1 Hydrogen TZP 1 1 -17.62814055 0.22665725 0.00100000 F 0.08893855 0.00066667 F 0.22665725 0.08893855 0.11888693 0.01000000 F 0.03386165 0.00666667 F Cartesian 2900.7329000000063 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288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 -5.313 -5.297 -5.222 -5.212 -5.178 -5.152 -5.131 -5.126 -4.867 -4.853 -1.838 -1.532 -1.485 -1.285 -1.142 -1.118 -1.090 -0.999 -0.954 -0.915 A A A A A A A A A A A A A A A A A A A A 0.00000000062517 0.00043582897770 0.00030873185759 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 73 73 73 73 73 73 73 74 74 74 74 74 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 33 1 0.100478 -2.576108 2.607360 -0.114986 2.610515 2.622165 -2.534476 2.521183 0.149246 -2.569625 -0.105071 -2.605957 -2.596396 0.129177 2.646382 2.569470 -0.107724 2.619813 2.591674 0.108135 -2.579413 -0.102527 -2.572234 -2.569170 0.122109 2.566724 -2.587769 2.588777 -2.581045 0.125089 2.585174 2.559666 -0.085820 -2.585347 -2.543603 -0.083542 0.974362 -0.957738 1.003332 -0.983142 -0.971692 -0.988364 0.988615 0.985435 -0.987981 -1.012619 1.002810 0.965279 -3.085314 -1.199139 1.135216 3.038534 -1.218131 -1.159217 -3.055181 1.212955 -1.207303 3.083799 1.193084 1.121852 1.146154 -1.213881 -3.064071 1.222662 1.224829 3.094278 -1.117090 1.203609 -3.103245 -1.225992 -1.214897 3.095660 -1.092823 3.007483 -1.183811 -1.195324 -3.046479 1.105435 1.203309 3.050497 1.114585 1.143150 -3.015175 -1.154310 3.475881 -1.579977 1.471046 -3.444040 -1.568162 -1.537240 3.470921 1.558971 -1.517039 -3.505653 1.549328 1.515879 1.566467 -1.574295 3.498395 1.516005 1.559850 -3.480221 -1.551831 1.568590 3.516694 -1.475062 -1.580704 -3.482418 -1.514529 -3.424017 -1.532137 -1.537410 3.515318 1.498801 1.548538 -3.472590 1.457750 1.552791 3.422291 -1.549098 -0.215961 -3.895169 3.790332 0.233364 -3.841442 -3.736573 -0.192529 3.832449 -3.765411 0.230735 3.900588 3.825382 3.774736 -3.821288 -0.254120 3.788643 3.808850 0.205185 -3.836398 3.936776 -0.261928 -3.783624 -3.800586 0.194560 -3.804267 0.191751 -3.875456 -3.881764 -0.203246 3.858310 3.886115 0.195307 3.808148 3.840131 -0.219136 -3.829571 -0.001221 0.010702 0.002449 -4.377363 3.790656 -1.061136 1 3 -3 0.100478 -2.576108 2.607360 Rho 0.3882647E+07 3,-3 2 3 -3 -0.114986 2.610515 2.622165 Rho 0.3882647E+07 3,-3 3 3 -3 -2.534476 2.521183 0.149246 Rho 0.3882646E+07 3,-3 4 3 -3 -2.569625 -0.105071 -2.605957 Rho 0.3882646E+07 3,-3 5 3 -3 -2.596396 0.129177 2.646382 Rho 0.3882647E+07 3,-3 6 3 -3 2.569470 -0.107724 2.619813 Rho 0.3882646E+07 3,-3 7 3 -3 2.591674 0.108135 -2.579413 Rho 0.3882646E+07 3,-3 8 3 -3 -0.102527 -2.572234 -2.569170 Rho 0.4361415E+07 3,-3 9 3 -3 0.122109 2.566724 -2.587769 Rho 0.4361415E+07 3,-3 10 3 -3 2.588777 -2.581045 0.125089 Rho 0.4361415E+07 3,-3 11 3 -3 2.585174 2.559666 -0.085820 Rho 0.4361415E+07 3,-3 12 3 -3 -2.585347 -2.543603 -0.083542 Rho 0.4361415E+07 3,-3 13 3 -3 0.974362 -0.957738 1.003332 Rho 0.3190207E+03 3,-3 14 3 -3 -0.983142 -0.971692 -0.988364 Rho 0.3190263E+03 3,-3 15 3 -3 0.988615 0.985435 -0.987981 Rho 0.3190240E+03 3,-3 16 3 -3 -1.012619 1.002810 0.965279 Rho 0.3189705E+03 3,-3 17 3 -3 -3.085314 -1.199139 1.135216 Rho 0.3188666E+03 3,-3 18 3 -3 3.038534 -1.218131 -1.159217 Rho 0.3188425E+03 3,-3 19 3 -3 -3.055181 1.212955 -1.207303 Rho 0.3188580E+03 3,-3 20 3 -3 3.083799 1.193084 1.121852 Rho 0.3188599E+03 3,-3 21 3 -3 1.146154 -1.213881 -3.064071 Rho 0.3188506E+03 3,-3 22 3 -3 1.222662 1.224829 3.094278 Rho 0.3188119E+03 3,-3 23 3 -3 -1.117090 1.203609 -3.103245 Rho 0.3188448E+03 3,-3 24 3 -3 -1.225992 -1.214897 3.095660 Rho 0.3188109E+03 3,-3 25 3 -3 -1.092823 3.007483 -1.183811 Rho 0.3188749E+03 3,-3 26 3 -3 -1.195324 -3.046479 1.105435 Rho 0.3188590E+03 3,-3 27 3 -3 1.203309 3.050497 1.114585 Rho 0.3188604E+03 3,-3 28 3 -3 1.143150 -3.015175 -1.154310 Rho 0.3188559E+03 3,-3 29 3 -3 3.475881 -1.579977 1.471046 Rho 0.3189108E+03 3,-3 30 3 -3 -3.444040 -1.568162 -1.537240 Rho 0.3188902E+03 3,-3 31 3 -3 3.470921 1.558971 -1.517039 Rho 0.3188903E+03 3,-3 32 3 -3 -3.505653 1.549328 1.515879 Rho 0.3188783E+03 3,-3 33 3 -3 1.566467 -1.574295 3.498395 Rho 0.3188500E+03 3,-3 34 3 -3 1.516005 1.559850 -3.480221 Rho 0.3188976E+03 3,-3 35 3 -3 -1.551831 1.568590 3.516694 Rho 0.3188407E+03 3,-3 36 3 -3 -1.475062 -1.580704 -3.482418 Rho 0.3189018E+03 3,-3 37 3 -3 -1.514529 -3.424017 -1.532137 Rho 0.3189167E+03 3,-3 38 3 -3 -1.537410 3.515318 1.498801 Rho 0.3188846E+03 3,-3 39 3 -3 1.548538 -3.472590 1.457750 Rho 0.3189055E+03 3,-3 40 3 -3 1.552791 3.422291 -1.549098 Rho 0.3189123E+03 3,-3 41 3 -3 -0.215961 -3.895169 3.790332 Rho 0.3190883E+03 3,-3 42 3 -3 0.233364 -3.841442 -3.736573 Rho 0.3192201E+03 3,-3 43 3 -3 -0.192529 3.832449 -3.765411 Rho 0.3192178E+03 3,-3 44 3 -3 0.230735 3.900588 3.825382 Rho 0.3190927E+03 3,-3 45 3 -3 3.774736 -3.821288 -0.254120 Rho 0.3192151E+03 3,-3 46 3 -3 3.788643 3.808850 0.205185 Rho 0.3192107E+03 3,-3 47 3 -3 -3.836398 3.936776 -0.261928 Rho 0.3186452E+03 3,-3 48 3 -3 -3.783624 -3.800586 0.194560 Rho 0.3192112E+03 3,-3 49 3 -3 -3.804267 0.191751 -3.875456 Rho 0.3191058E+03 3,-3 50 3 -3 -3.881764 -0.203246 3.858310 Rho 0.3190934E+03 3,-3 51 3 -3 3.886115 0.195307 3.808148 Rho 0.3190909E+03 3,-3 52 3 -3 3.840131 -0.219136 -3.829571 Rho 0.3191020E+03 3,-3 53 3 -3 -0.001221 0.010702 0.002449 Rho 0.4276085E+05 3,-3 54 3 -3 -4.377363 3.790656 -1.061136 Rho 0.4684530E+00 3,-3 55 3 +1 -2.212583 1.019637 1.476022 Rho 0.2552675E-01 |GRAD(Rho)| 0.1368192E-12 GRAD(Rho)x -0.2957584E-13 GRAD(Rho)y 0.1016475E-12 GRAD(Rho)z -0.8667496E-13 Laplacian 0.9580214E-01 (-1/4)Del**2(Rho)) -0.2395053E-01 Diamond 0.1036859E-01 Metallicity 0.1591832E+01 Ellipticity -0.2119107E+01 Gb(Abramov) 0.2232123E-01 Vb(Abramov) -0.2069192E-01 Hb(Abramov) 0.1629309E-02 Ex_ueg -0.5551100E-02 Ec_ueg -0.1115272E-02 Delta_ex -0.5724840E-02 Delta_ec 0.1149283E-02 Delta_et -0.1030012E-01 Pxc 0.4977353E+01 Qxc -0.4981226E+01 3,+1 56 3 +3 0.015798 2.310191 0.020994 Rho 0.4698200E-02 |GRAD(Rho)| 0.4851787E-13 GRAD(Rho)x -0.1664607E-13 GRAD(Rho)y -0.1248733E-13 GRAD(Rho)z 0.4382874E-13 Laplacian 0.1924245E-01 (-1/4)Del**2(Rho)) -0.4810613E-02 Diamond 0.1649366E-03 Metallicity 0.4719601E+00 Ellipticity -0.3261767E+00 Gb(Abramov) 0.3585478E-02 Vb(Abramov) -0.2360343E-02 Hb(Abramov) 0.1225135E-02 Ex_ueg -0.5811573E-03 Ec_ueg -0.1339483E-03 Delta_ex -0.6953547E-03 Delta_ec 0.1595913E-03 Delta_et -0.1032257E-02 Pxc 0.4338668E+01 Qxc -0.4357095E+01 3,+3 57 3 +1 0.546370 -1.661592 -0.520733 Rho 0.8425988E-02 |GRAD(Rho)| 0.6383726E-17 GRAD(Rho)x -0.4621399E-17 GRAD(Rho)y 0.4391025E-17 GRAD(Rho)z -0.3369404E-18 Laplacian 0.3258393E-01 (-1/4)Del**2(Rho)) -0.8145982E-02 Diamond 0.8677113E-03 Metallicity 0.7378665E+00 Ellipticity -0.1473484E+01 Gb(Abramov) 0.6432430E-02 Vb(Abramov) -0.4718877E-02 Hb(Abramov) 0.1713553E-02 Ex_ueg -0.1266328E-02 Ec_ueg -0.2972011E-03 Delta_ex -0.1489996E-02 Delta_ec 0.4747763E-03 Delta_et -0.3214754E-02 Pxc 0.4260845E+01 Qxc -0.3138312E+01 3,+1 58 3 +1 -2.186261 -1.066637 -1.421680 Rho 0.2627873E-01 |GRAD(Rho)| 0.3968385E-14 GRAD(Rho)x -0.1981242E-14 GRAD(Rho)y 0.3193198E-16 GRAD(Rho)z 0.3438276E-14 Laplacian 0.1013244E+00 (-1/4)Del**2(Rho)) -0.2533111E-01 Diamond 0.1349718E-01 Metallicity 0.1579694E+01 Ellipticity -0.3218299E+01 Gb(Abramov) 0.2355664E-01 Vb(Abramov) -0.2178217E-01 Hb(Abramov) 0.1774470E-02 Ex_ueg -0.5770201E-02 Ec_ueg -0.1153309E-02 Delta_ex -0.6315652E-02 Delta_ec 0.1592915E-02 Delta_et -0.1425763E-01 Pxc 0.5003168E+01 Qxc -0.3964839E+01 3,+1 59 3 +1 1.682755 -0.548960 -0.545721 Rho 0.8103111E-02 |GRAD(Rho)| 0.4238095E-15 GRAD(Rho)x -0.1081110E-15 GRAD(Rho)y -0.5258487E-16 GRAD(Rho)z -0.4064004E-15 Laplacian 0.3078458E-01 (-1/4)Del**2(Rho)) -0.7696146E-02 Diamond 0.7676611E-03 Metallicity 0.7317559E+00 Ellipticity -0.1462890E+01 Gb(Abramov) 0.6069381E-02 Vb(Abramov) -0.4442615E-02 Hb(Abramov) 0.1626765E-02 Ex_ueg -0.1202045E-02 Ec_ueg -0.2828031E-03 Delta_ex -0.1389282E-02 Delta_ec 0.4401419E-03 Delta_et -0.2956829E-02 Pxc 0.4250467E+01 Qxc -0.3156440E+01 3,+1 60 3 +1 -0.131593 -0.143124 -3.009696 Rho 0.5210730E-02 |GRAD(Rho)| 0.4625185E-14 GRAD(Rho)x -0.3220895E-14 GRAD(Rho)y -0.3307087E-14 GRAD(Rho)z -0.2852145E-15 Laplacian 0.2053912E-01 (-1/4)Del**2(Rho)) -0.5134779E-02 Diamond 0.4959698E-03 Metallicity 0.5254471E+00 Ellipticity -0.3587130E+01 Gb(Abramov) 0.3872862E-02 Vb(Abramov) -0.2610945E-02 Hb(Abramov) 0.1261917E-02 Ex_ueg -0.6671904E-03 Ec_ueg -0.1559926E-03 Delta_ex -0.1020289E-02 Delta_ec 0.6305378E-03 Delta_et -0.3473576E-02 Pxc 0.4277064E+01 Qxc -0.1618125E+01 3,+1 61 3 +1 -2.986425 -0.062712 -0.097487 Rho 0.4881757E-02 |GRAD(Rho)| 0.9954626E-17 GRAD(Rho)x 0.5603387E-18 GRAD(Rho)y -0.8596091E-17 GRAD(Rho)z 0.4988770E-17 Laplacian 0.1898921E-01 (-1/4)Del**2(Rho)) -0.4747304E-02 Diamond 0.4464522E-03 Metallicity 0.5097999E+00 Ellipticity -0.8179942E+01 Gb(Abramov) 0.3568231E-02 Vb(Abramov) -0.2389159E-02 Hb(Abramov) 0.1179072E-02 Ex_ueg -0.6116269E-03 Ec_ueg -0.1418279E-03 Delta_ex -0.9566958E-03 Delta_ec 0.6281513E-03 Delta_et -0.3374713E-02 Pxc 0.4312459E+01 Qxc -0.1523034E+01 3,+1 62 3 +1 1.806477 1.788452 1.776164 Rho 0.1139163E-01 |GRAD(Rho)| 0.4914260E-17 GRAD(Rho)x -0.4052442E-17 GRAD(Rho)y 0.3214521E-18 GRAD(Rho)z -0.2761220E-17 Laplacian 0.5375522E-01 (-1/4)Del**2(Rho)) -0.1343880E-01 Diamond 0.1926191E-02 Metallicity 0.7393251E+00 Ellipticity -0.1257673E+01 Gb(Abramov) 0.1061514E-01 Vb(Abramov) -0.7791483E-02 Hb(Abramov) 0.2823661E-02 Ex_ueg -0.1893067E-02 Ec_ueg -0.4315577E-03 Delta_ex -0.2581737E-02 Delta_ec 0.6537720E-03 Delta_et -0.4874760E-02 Pxc 0.4386591E+01 Qxc -0.3948986E+01 3,+1 63 3 +1 2.201862 1.087871 -1.392313 Rho 0.2614012E-01 |GRAD(Rho)| 0.2902715E-13 GRAD(Rho)x 0.1215542E-13 GRAD(Rho)y -0.1536566E-13 GRAD(Rho)z -0.2141769E-13 Laplacian 0.1005403E+00 (-1/4)Del**2(Rho)) -0.2513508E-01 Diamond 0.1354967E-01 Metallicity 0.1578044E+01 Ellipticity -0.3528137E+01 Gb(Abramov) 0.2336743E-01 Vb(Abramov) -0.2159978E-01 Hb(Abramov) 0.1767651E-02 Ex_ueg -0.5729657E-02 Ec_ueg -0.1146287E-02 Delta_ex -0.6283827E-02 Delta_ec 0.1627050E-02 Delta_et -0.1453500E-01 Pxc 0.4998447E+01 Qxc -0.3862099E+01 3,+1 64 3 +1 0.555873 -0.535826 -1.697005 Rho 0.8059673E-02 |GRAD(Rho)| 0.6205046E-17 GRAD(Rho)x -0.4844464E-17 GRAD(Rho)y -0.3524168E-17 GRAD(Rho)z -0.1616787E-17 Laplacian 0.3071706E-01 (-1/4)Del**2(Rho)) -0.7679265E-02 Diamond 0.7509046E-03 Metallicity 0.7268239E+00 Ellipticity -0.1442539E+01 Gb(Abramov) 0.6049756E-02 Vb(Abramov) -0.4420246E-02 Hb(Abramov) 0.1629509E-02 Ex_ueg -0.1193461E-02 Ec_ueg -0.2808696E-03 Delta_ex -0.1379704E-02 Delta_ec 0.4308538E-03 Delta_et -0.2897184E-02 Pxc 0.4249164E+01 Qxc -0.3202256E+01 3,+1 65 3 +3 -2.385594 -0.003904 -0.022780 Rho 0.4235894E-02 |GRAD(Rho)| 0.5134350E-17 GRAD(Rho)x -0.3041458E-17 GRAD(Rho)y 0.2427079E-17 GRAD(Rho)z -0.3349683E-17 Laplacian 0.1692654E-01 (-1/4)Del**2(Rho)) -0.4231635E-02 Diamond 0.1334632E-03 Metallicity 0.4514609E+00 Ellipticity -0.1982703E+00 Gb(Abramov) 0.3139493E-02 Vb(Abramov) -0.2047351E-02 Hb(Abramov) 0.1092142E-02 Ex_ueg -0.5061880E-03 Ec_ueg -0.1141799E-03 Delta_ex -0.6040913E-03 Delta_ec 0.1557302E-03 Delta_et -0.9593949E-03 Pxc 0.4433251E+01 Qxc -0.3879089E+01 3,+3 66 3 +1 0.188738 -2.986476 0.194257 Rho 0.5522454E-02 |GRAD(Rho)| 0.5092162E-17 GRAD(Rho)x -0.2379860E-17 GRAD(Rho)y -0.2746705E-18 GRAD(Rho)z 0.4493433E-17 Laplacian 0.2234420E-01 (-1/4)Del**2(Rho)) -0.5586050E-02 Diamond 0.5198118E-03 Metallicity 0.5321107E+00 Ellipticity -0.2059616E+01 Gb(Abramov) 0.4219432E-02 Vb(Abramov) -0.2852815E-02 Hb(Abramov) 0.1366617E-02 Ex_ueg -0.7209325E-03 Ec_ueg -0.1694650E-03 Delta_ex -0.1070982E-02 Delta_ec 0.5935869E-03 Delta_et -0.3365174E-02 Pxc 0.4254168E+01 Qxc -0.1804255E+01 3,+1 67 3 +1 -1.689816 0.543421 -0.588343 Rho 0.8325157E-02 |GRAD(Rho)| 0.9908639E-17 GRAD(Rho)x 0.2759316E-17 GRAD(Rho)y -0.8947452E-17 GRAD(Rho)z -0.3241976E-17 Laplacian 0.3133468E-01 (-1/4)Del**2(Rho)) -0.7833671E-02 Diamond 0.7752471E-03 Metallicity 0.7520417E+00 Ellipticity -0.1434388E+01 Gb(Abramov) 0.6204322E-02 Vb(Abramov) -0.4574973E-02 Hb(Abramov) 0.1629349E-02 Ex_ueg -0.1246163E-02 Ec_ueg -0.2926997E-03 Delta_ex -0.1407078E-02 Delta_ec 0.4182418E-03 Delta_et -0.2853478E-02 Pxc 0.4257481E+01 Qxc -0.3364270E+01 3,+1 68 3 -1 -1.767228 0.552755 1.768195 Rho 0.3818236E-01 |GRAD(Rho)| 0.6061378E-16 GRAD(Rho)x -0.1205709E-16 GRAD(Rho)y -0.4338460E-16 GRAD(Rho)z 0.4057627E-16 Laplacian 0.1628882E+00 (-1/4)Del**2(Rho)) -0.4072205E-01 Diamond 0.6146017E-01 Metallicity 0.1831589E+01 Ellipticity 0.1625245E-01 Gb(Abramov) 0.3957904E-01 Vb(Abramov) -0.3843604E-01 Hb(Abramov) 0.1143005E-02 Ex_ueg -0.9495883E-02 Ec_ueg -0.1772891E-02 Delta_ex -0.1279725E-01 Delta_ec 0.5328909E-02 Delta_et -0.5233773E-01 Pxc 0.5356156E+01 Qxc -0.2401476E+01 3,-1 69 3 -1 -3.068816 0.879384 2.042807 Rho 0.1131248E+00 |GRAD(Rho)| 0.2573573E-15 GRAD(Rho)x 0.1542549E-15 GRAD(Rho)y -0.1554204E-15 GRAD(Rho)z 0.1352136E-15 Laplacian 0.4661323E+00 (-1/4)Del**2(Rho)) -0.1165331E+00 Diamond 0.6883324E+00 Metallicity 0.3911712E+01 Ellipticity 0.6813783E-02 Gb(Abramov) 0.1536627E+00 Vb(Abramov) -0.1907923E+00 Hb(Abramov) -0.3712962E-01 Ex_ueg -0.4040751E-01 Ec_ueg -0.6126744E-02 Delta_ex -0.4698827E-01 Delta_ec 0.1304976E-01 Delta_et -0.1665710E+00 Pxc 0.6595267E+01 Qxc -0.3600699E+01 3,-1 70 3 -1 -3.232002 -3.222075 0.065600 Rho 0.2305240E+00 |GRAD(Rho)| 0.2214777E-14 GRAD(Rho)x 0.1589278E-14 GRAD(Rho)y 0.2424276E-15 GRAD(Rho)z -0.1523372E-14 Laplacian 0.8444507E+00 (-1/4)Del**2(Rho)) -0.2111127E+00 Diamond 0.2847029E+01 Metallicity 0.7072382E+01 Ellipticity 0.2189228E-02 Gb(Abramov) 0.3895867E+00 Vb(Abramov) -0.5680607E+00 Hb(Abramov) -0.1784740E+00 Ex_ueg -0.1043934E+00 Ec_ueg -0.1378652E-01 Delta_ex -0.1009714E+00 Delta_ec 0.1889450E-01 Delta_et -0.2613817E+00 Pxc 0.7572137E+01 Qxc -0.5343957E+01 3,-1 71 3 -1 -3.024989 -2.015346 -0.857733 Rho 0.1412846E+00 |GRAD(Rho)| 0.2925282E-13 GRAD(Rho)x 0.2418244E-13 GRAD(Rho)y -0.7087511E-14 GRAD(Rho)z -0.1485612E-13 Laplacian 0.5534424E+00 (-1/4)Del**2(Rho)) -0.1383606E+00 Diamond 0.1038816E+01 Metallicity 0.4771979E+01 Ellipticity 0.2627665E-01 Gb(Abramov) 0.2022827E+00 Vb(Abramov) -0.2662048E+00 Hb(Abramov) -0.6392211E-01 Ex_ueg -0.5434730E-01 Ec_ueg -0.7887955E-02 Delta_ex -0.5851666E-01 Delta_ec 0.1415579E-01 Delta_et -0.1866218E+00 Pxc 0.6889909E+01 Qxc -0.4133761E+01 3,-1 72 3 -1 -2.800835 1.821319 -0.573052 Rho 0.1349327E+00 |GRAD(Rho)| 0.1148858E-13 GRAD(Rho)x 0.7002936E-14 GRAD(Rho)y 0.8630412E-14 GRAD(Rho)z 0.2909023E-14 Laplacian 0.5805639E+00 (-1/4)Del**2(Rho)) -0.1451410E+00 Diamond 0.1053759E+01 Metallicity 0.4213325E+01 Ellipticity 0.2313570E-01 Gb(Abramov) 0.1986816E+00 Vb(Abramov) -0.2522223E+00 Hb(Abramov) -0.5354068E-01 Ex_ueg -0.5111415E-01 Ec_ueg -0.7486080E-02 Delta_ex -0.6096022E-01 Delta_ec 0.1548002E-01 Delta_et -0.2035833E+00 Pxc 0.6827892E+01 Qxc -0.3937994E+01 3,-1 73 3 -1 -3.039463 1.995063 0.877219 Rho 0.1448539E+00 |GRAD(Rho)| 0.6889859E-15 GRAD(Rho)x 0.2624853E-15 GRAD(Rho)y 0.1828642E-15 GRAD(Rho)z -0.6102161E-15 Laplacian 0.5745307E+00 (-1/4)Del**2(Rho)) -0.1436327E+00 Diamond 0.1134236E+01 Metallicity 0.4792003E+01 Ellipticity 0.1721771E-01 Gb(Abramov) 0.2104698E+00 Vb(Abramov) -0.2773070E+00 Hb(Abramov) -0.6683715E-01 Ex_ueg -0.5618566E-01 Ec_ueg -0.8114910E-02 Delta_ex -0.6135854E-01 Delta_ec 0.1503438E-01 Delta_et -0.1998723E+00 Pxc 0.6923756E+01 Qxc -0.4081215E+01 3,-1 74 3 -1 -3.230690 3.254157 -0.089505 Rho 0.1338614E+00 |GRAD(Rho)| 0.3702790E-15 GRAD(Rho)x 0.2729479E-15 GRAD(Rho)y 0.2353532E-15 GRAD(Rho)z 0.8494046E-16 Laplacian 0.5298506E+00 (-1/4)Del**2(Rho)) -0.1324627E+00 Diamond 0.9791669E+00 Metallicity 0.4555666E+01 Ellipticity 0.1117508E+00 Gb(Abramov) 0.1888844E+00 Vb(Abramov) -0.2453061E+00 Hb(Abramov) -0.5642172E-01 Ex_ueg -0.5057378E-01 Ec_ueg -0.7418558E-02 Delta_ex -0.5583715E-01 Delta_ec 0.1470576E-01 Delta_et -0.1941993E+00 Pxc 0.6817198E+01 Qxc -0.3796958E+01 3,-1 75 3 +1 -2.018585 -2.014700 -2.048340 Rho 0.1197144E-01 |GRAD(Rho)| 0.8542962E-17 GRAD(Rho)x -0.7678215E-18 GRAD(Rho)y -0.8027316E-17 GRAD(Rho)z 0.2820435E-17 Laplacian 0.5444782E-01 (-1/4)Del**2(Rho)) -0.1361196E-01 Diamond 0.1623793E-02 Metallicity 0.7928849E+00 Ellipticity -0.1087593E+01 Gb(Abramov) 0.1087342E-01 Vb(Abramov) -0.8134890E-02 Hb(Abramov) 0.2738533E-02 Ex_ueg -0.2022617E-02 Ec_ueg -0.4582509E-03 Delta_ex -0.2514987E-02 Delta_ec 0.4216347E-03 Delta_et -0.3379083E-02 Pxc 0.4413777E+01 Qxc -0.5964850E+01 3,+1 76 3 -1 -2.838677 -1.821693 0.568162 Rho 0.1638187E+00 |GRAD(Rho)| 0.3020529E-13 GRAD(Rho)x 0.1783323E-13 GRAD(Rho)y 0.1628604E-13 GRAD(Rho)z 0.1814111E-13 Laplacian 0.6702927E+00 (-1/4)Del**2(Rho)) -0.1675732E+00 Diamond 0.1495523E+01 Metallicity 0.5042211E+01 Ellipticity 0.1396717E-01 Gb(Abramov) 0.2525386E+00 Vb(Abramov) -0.3375041E+00 Hb(Abramov) -0.8496548E-01 Ex_ueg -0.6620176E-01 Ec_ueg -0.9333897E-02 Delta_ex -0.7344054E-01 Delta_ec 0.1640487E-01 Delta_et -0.2203244E+00 Pxc 0.7092617E+01 Qxc -0.4476752E+01 3,-1 77 3 +1 -0.034243 0.037795 3.000688 Rho 0.4357589E-02 |GRAD(Rho)| 0.1169546E-16 GRAD(Rho)x -0.3671824E-17 GRAD(Rho)y -0.1601191E-18 GRAD(Rho)z 0.1110297E-16 Laplacian 0.1634226E-01 (-1/4)Del**2(Rho)) -0.4085566E-02 Diamond 0.3231115E-03 Metallicity 0.4902054E+00 Ellipticity -0.5279660E+01 Gb(Abramov) 0.3057505E-02 Vb(Abramov) -0.2029444E-02 Hb(Abramov) 0.1028061E-02 Ex_ueg -0.5256703E-03 Ec_ueg -0.1193729E-03 Delta_ex -0.7985024E-03 Delta_ec 0.5271652E-03 Delta_et -0.2741818E-02 Pxc 0.4403600E+01 Qxc -0.1514710E+01 3,+1 78 3 +3 -1.949171 -1.940260 -1.976880 Rho 0.1194787E-01 |GRAD(Rho)| 0.6592973E-16 GRAD(Rho)x 0.2854772E-16 GRAD(Rho)y 0.5312432E-16 GRAD(Rho)z 0.2663763E-16 Laplacian 0.5397107E-01 (-1/4)Del**2(Rho)) -0.1349277E-01 Diamond 0.1323153E-02 Metallicity 0.7972649E+00 Ellipticity -0.8813963E+00 Gb(Abramov) 0.1078806E-01 Vb(Abramov) -0.8083359E-02 Hb(Abramov) 0.2704704E-02 Ex_ueg -0.2017308E-02 Ec_ueg -0.4571628E-03 Delta_ex -0.2409612E-02 Delta_ec 0.2715814E-03 Delta_et -0.2364649E-02 Pxc 0.4412668E+01 Qxc -0.8872520E+01 3,+3 79 3 -1 -0.585286 -2.814092 1.811049 Rho 0.1076790E+00 |GRAD(Rho)| 0.1114236E-13 GRAD(Rho)x 0.1095929E-13 GRAD(Rho)y 0.1615851E-14 GRAD(Rho)z -0.1197976E-14 Laplacian 0.4653540E+00 (-1/4)Del**2(Rho)) -0.1163385E+00 Diamond 0.6555169E+00 Metallicity 0.3608953E+01 Ellipticity 0.1956840E-01 Gb(Abramov) 0.1475357E+00 Vb(Abramov) -0.1787329E+00 Hb(Abramov) -0.3119720E-01 Ex_ueg -0.3783493E-01 Ec_ueg -0.5792519E-02 Delta_ex -0.4649457E-01 Delta_ec 0.1339353E-01 Delta_et -0.1696493E+00 Pxc 0.6531688E+01 Qxc -0.3471419E+01 3,-1 80 3 +1 -1.804986 -1.785151 1.778854 Rho 0.1137808E-01 |GRAD(Rho)| 0.1690162E-16 GRAD(Rho)x -0.9316435E-17 GRAD(Rho)y -0.3048732E-17 GRAD(Rho)z -0.1376859E-16 Laplacian 0.5368386E-01 (-1/4)Del**2(Rho)) -0.1342096E-01 Diamond 0.1922821E-02 Metallicity 0.7388414E+00 Ellipticity -0.1259262E+01 Gb(Abramov) 0.1059997E-01 Vb(Abramov) -0.7778977E-02 Hb(Abramov) 0.2820994E-02 Ex_ueg -0.1890067E-02 Ec_ueg -0.4309358E-03 Delta_ex -0.2578217E-02 Delta_ec 0.6541912E-03 Delta_et -0.4875405E-02 Pxc 0.4385960E+01 Qxc -0.3941076E+01 3,+1 81 3 -1 0.581723 2.832383 1.823895 Rho 0.1045973E+00 |GRAD(Rho)| 0.3329582E-14 GRAD(Rho)x -0.2113618E-14 GRAD(Rho)y -0.4100758E-15 GRAD(Rho)z 0.2539798E-14 Laplacian 0.4504340E+00 (-1/4)Del**2(Rho)) -0.1126085E+00 Diamond 0.6122947E+00 Metallicity 0.3552355E+01 Ellipticity 0.2399552E-01 Gb(Abramov) 0.1417432E+00 Vb(Abramov) -0.1708780E+00 Hb(Abramov) -0.2913473E-01 Ex_ueg -0.3639814E-01 Ec_ueg -0.5604374E-02 Delta_ex -0.4469556E-01 Delta_ec 0.1303606E-01 Delta_et -0.1641569E+00 Pxc 0.6494596E+01 Qxc -0.3428609E+01 3,-1 82 3 +1 -1.714887 -0.521895 0.550104 Rho 0.7938001E-02 |GRAD(Rho)| 0.9117430E-17 GRAD(Rho)x -0.5688061E-17 GRAD(Rho)y 0.5361348E-17 GRAD(Rho)z 0.4693553E-17 Laplacian 0.3019205E-01 (-1/4)Del**2(Rho)) -0.7548014E-02 Diamond 0.7324513E-03 Metallicity 0.7209510E+00 Ellipticity -0.1453290E+01 Gb(Abramov) 0.5938967E-02 Vb(Abramov) -0.4329921E-02 Hb(Abramov) 0.1609047E-02 Ex_ueg -0.1169499E-02 Ec_ueg -0.2754585E-03 Delta_ex -0.1355710E-02 Delta_ec 0.4320025E-03 Delta_et -0.2886424E-02 Pxc 0.4245646E+01 Qxc -0.3138199E+01 3,+1 83 3 -1 -1.866079 -0.584494 2.875170 Rho 0.1288976E+00 |GRAD(Rho)| 0.4456170E-15 GRAD(Rho)x 0.3632077E-15 GRAD(Rho)y -0.2569559E-15 GRAD(Rho)z 0.2506540E-16 Laplacian 0.5476960E+00 (-1/4)Del**2(Rho)) -0.1369240E+00 Diamond 0.9477055E+00 Metallicity 0.4138232E+01 Ellipticity 0.1765808E-01 Gb(Abramov) 0.1857199E+00 Vb(Abramov) -0.2345157E+00 Hb(Abramov) -0.4879587E-01 Ex_ueg -0.4808888E-01 Ec_ueg -0.7106673E-02 Delta_ex -0.5696284E-01 Delta_ec 0.1491070E-01 Delta_et -0.1948855E+00 Pxc 0.6766722E+01 Qxc -0.3820267E+01 3,-1 84 3 -1 -1.983022 -0.884188 -3.057111 Rho 0.1115264E+00 |GRAD(Rho)| 0.6385020E-14 GRAD(Rho)x 0.5188964E-14 GRAD(Rho)y -0.2538836E-14 GRAD(Rho)z 0.2719823E-14 Laplacian 0.4607695E+00 (-1/4)Del**2(Rho)) -0.1151924E+00 Diamond 0.6721370E+00 Metallicity 0.3864492E+01 Ellipticity 0.1578315E-01 Gb(Abramov) 0.1509883E+00 Vb(Abramov) -0.1867841E+00 Hb(Abramov) -0.3579588E-01 Ex_ueg -0.3964808E-01 Ec_ueg -0.6028422E-02 Delta_ex -0.4634132E-01 Delta_ec 0.1302771E-01 Delta_et -0.1659659E+00 Pxc 0.6576859E+01 Qxc -0.3557134E+01 3,-1 85 3 -1 -2.843845 -0.572581 1.847630 Rho 0.9930022E-01 |GRAD(Rho)| 0.3953141E-15 GRAD(Rho)x -0.1628675E-16 GRAD(Rho)y -0.3294145E-15 GRAD(Rho)z -0.2179314E-15 Laplacian 0.4286267E+00 (-1/4)Del**2(Rho)) -0.1071567E+00 Diamond 0.5480530E+00 Metallicity 0.3423348E+01 Ellipticity 0.2199844E-01 Gb(Abramov) 0.1325769E+00 Vb(Abramov) -0.1579971E+00 Hb(Abramov) -0.2542020E-01 Ex_ueg -0.3396138E-01 Ec_ueg -0.5282681E-02 Delta_ex -0.4203854E-01 Delta_ec 0.1257052E-01 Delta_et -0.1566577E+00 Pxc 0.6428815E+01 Qxc -0.3344216E+01 3,-1 86 3 -1 -1.736802 -0.521976 -1.758072 Rho 0.4234803E-01 |GRAD(Rho)| 0.1261682E-14 GRAD(Rho)x -0.8712183E-15 GRAD(Rho)y 0.3861498E-15 GRAD(Rho)z -0.8268672E-15 Laplacian 0.1815294E+00 (-1/4)Del**2(Rho)) -0.4538235E-01 Diamond 0.7908108E-01 Metallicity 0.1953087E+01 Ellipticity 0.1386362E-01 Gb(Abramov) 0.4502751E-01 Vb(Abramov) -0.4467267E-01 Hb(Abramov) 0.3548393E-03 Ex_ueg -0.1090174E-01 Ec_ueg -0.1996485E-02 Delta_ex -0.1463815E-01 Delta_ec 0.5958822E-02 Delta_et -0.6021859E-01 Pxc 0.5460468E+01 Qxc -0.2456551E+01 3,-1 87 3 +1 -1.173034 1.352021 2.207916 Rho 0.2387186E-01 |GRAD(Rho)| 0.7375017E-16 GRAD(Rho)x -0.2729672E-16 GRAD(Rho)y 0.7008229E-17 GRAD(Rho)z 0.6815322E-16 Laplacian 0.8865671E-01 (-1/4)Del**2(Rho)) -0.2216418E-01 Diamond 0.1170575E-01 Metallicity 0.1538315E+01 Ellipticity -0.1153411E+02 Gb(Abramov) 0.2045870E-01 Vb(Abramov) -0.1875322E-01 Hb(Abramov) 0.1705477E-02 Ex_ueg -0.5076528E-02 Ec_ueg -0.1032083E-02 Delta_ex -0.5541706E-02 Delta_ec 0.1674451E-02 Delta_et -0.1456926E-01 Pxc 0.4918718E+01 Qxc -0.3309566E+01 3,+1 88 3 +3 -1.116346 1.083552 -1.180885 Rho 0.5047177E-02 |GRAD(Rho)| 0.5314075E-17 GRAD(Rho)x -0.1966860E-17 GRAD(Rho)y 0.4613827E-17 GRAD(Rho)z -0.1755977E-17 Laplacian 0.1892763E-01 (-1/4)Del**2(Rho)) -0.4731908E-02 Diamond 0.1296396E-03 Metallicity 0.5406685E+00 Ellipticity -0.5723622E-01 Gb(Abramov) 0.3581004E-02 Vb(Abramov) -0.2430100E-02 Hb(Abramov) 0.1150904E-02 Ex_ueg -0.6394154E-03 Ec_ueg -0.1489436E-03 Delta_ex -0.6517470E-03 Delta_ec 0.7641975E-04 Delta_et -0.6260493E-03 Pxc 0.4293004E+01 Qxc -0.8528515E+01 3,+3 89 3 -1 -1.798464 0.589029 -2.857129 Rho 0.1138240E+00 |GRAD(Rho)| 0.1332918E-13 GRAD(Rho)x 0.1144501E-13 GRAD(Rho)y 0.3295988E-14 GRAD(Rho)z 0.5984583E-14 Laplacian 0.4903396E+00 (-1/4)Del**2(Rho)) -0.1225849E+00 Diamond 0.7352778E+00 Metallicity 0.3756985E+01 Ellipticity 0.1370700E-01 Gb(Abramov) 0.1584815E+00 Vb(Abramov) -0.1943782E+00 Hb(Abramov) -0.3589664E-01 Ex_ueg -0.4074087E-01 Ec_ueg -0.6169816E-02 Delta_ex -0.4958369E-01 Delta_ec 0.1385759E-01 Delta_et -0.1773060E+00 Pxc 0.6603256E+01 Qxc -0.3578088E+01 3,-1 90 3 +1 0.518938 1.691677 0.554855 Rho 0.8252617E-02 |GRAD(Rho)| 0.2123594E-13 GRAD(Rho)x -0.5091836E-14 GRAD(Rho)y 0.5549690E-14 GRAD(Rho)z 0.1985546E-13 Laplacian 0.3139709E-01 (-1/4)Del**2(Rho)) -0.7849274E-02 Diamond 0.8123980E-03 Metallicity 0.7396789E+00 Ellipticity -0.1483529E+01 Gb(Abramov) 0.6200506E-02 Vb(Abramov) -0.4551739E-02 Hb(Abramov) 0.1648768E-02 Ex_ueg -0.1231707E-02 Ec_ueg -0.2894642E-03 Delta_ex -0.1428079E-02 Delta_ec 0.4571680E-03 Delta_et -0.3079093E-02 Pxc 0.4255127E+01 Qxc -0.3123751E+01 3,+1 91 3 +1 -1.746886 1.765106 -1.811275 Rho 0.1171386E-01 |GRAD(Rho)| 0.1723174E-16 GRAD(Rho)x -0.4160285E-18 GRAD(Rho)y -0.1135515E-16 GRAD(Rho)z -0.1295455E-16 Laplacian 0.5552373E-01 (-1/4)Del**2(Rho)) -0.1388093E-01 Diamond 0.2049305E-02 Metallicity 0.7498387E+00 Ellipticity -0.1249884E+01 Gb(Abramov) 0.1098870E-01 Vb(Abramov) -0.8096465E-02 Hb(Abramov) 0.2892234E-02 Ex_ueg -0.1964800E-02 Ec_ueg -0.4463759E-03 Delta_ex -0.2681159E-02 Delta_ec 0.6657524E-03 Delta_et -0.5005379E-02 Pxc 0.4401672E+01 Qxc -0.4027261E+01 3,+1 92 3 -1 -2.034797 0.892674 3.095943 Rho 0.1290284E+00 |GRAD(Rho)| 0.1581921E-15 GRAD(Rho)x 0.9446111E-17 GRAD(Rho)y 0.9424427E-16 GRAD(Rho)z 0.1267026E-15 Laplacian 0.5188949E+00 (-1/4)Del**2(Rho)) -0.1297237E+00 Diamond 0.8962745E+00 Metallicity 0.4375311E+01 Ellipticity 0.9441917E-02 Gb(Abramov) 0.1810795E+00 Vb(Abramov) -0.2324352E+00 Hb(Abramov) -0.5135571E-01 Ex_ueg -0.4815395E-01 Ec_ueg -0.7114870E-02 Delta_ex -0.5394774E-01 Delta_ec 0.1406476E-01 Delta_et -0.1837565E+00 Pxc 0.6768072E+01 Qxc -0.3835667E+01 3,-1 93 3 -1 -1.736304 1.727954 0.542067 Rho 0.5638708E-01 |GRAD(Rho)| 0.7447565E-14 GRAD(Rho)x -0.4871769E-14 GRAD(Rho)y 0.4433525E-14 GRAD(Rho)z -0.3475048E-14 Laplacian 0.2436365E+00 (-1/4)Del**2(Rho)) -0.6090912E-01 Diamond 0.1543742E+00 Metallicity 0.2345148E+01 Ellipticity 0.1744434E-01 Gb(Abramov) 0.6441289E-01 Vb(Abramov) -0.6791667E-01 Hb(Abramov) -0.3503777E-02 Ex_ueg -0.1596950E-01 Ec_ueg -0.2770856E-02 Delta_ex -0.2100164E-01 Delta_ec 0.7838859E-02 Delta_et -0.8549989E-01 Pxc 0.5763381E+01 Qxc -0.2679170E+01 3,-1 94 3 -1 -1.839034 -2.798735 0.550397 Rho 0.1577890E+00 |GRAD(Rho)| 0.1568061E-14 GRAD(Rho)x 0.1385231E-14 GRAD(Rho)y 0.5672004E-15 GRAD(Rho)z 0.4671556E-15 Laplacian 0.6499148E+00 (-1/4)Del**2(Rho)) -0.1624787E+00 Diamond 0.1387983E+01 Metallicity 0.4885224E+01 Ellipticity 0.9996872E-02 Gb(Abramov) 0.2406099E+00 Vb(Abramov) -0.3187412E+00 Hb(Abramov) -0.7813124E-01 Ex_ueg -0.6297293E-01 Ec_ueg -0.8943970E-02 Delta_ex -0.7056332E-01 Delta_ec 0.1608887E-01 Delta_et -0.2151602E+00 Pxc 0.7040825E+01 Qxc -0.4385847E+01 3,-1 95 3 +1 -1.391720 -1.073275 -2.211749 Rho 0.2549366E-01 |GRAD(Rho)| 0.4875057E-14 GRAD(Rho)x -0.4506519E-14 GRAD(Rho)y 0.5768639E-15 GRAD(Rho)z -0.1767681E-14 Laplacian 0.9717537E-01 (-1/4)Del**2(Rho)) -0.2429384E-01 Diamond 0.1210901E-01 Metallicity 0.1565948E+01 Ellipticity -0.2913025E+01 Gb(Abramov) 0.2253638E-01 Vb(Abramov) -0.2077891E-01 Hb(Abramov) 0.1757465E-02 Ex_ueg -0.5541509E-02 Ec_ueg -0.1113601E-02 Delta_ex -0.5975221E-02 Delta_ec 0.1470042E-02 Delta_et -0.1307746E-01 Pxc 0.4976205E+01 Qxc -0.4064659E+01 3,+1 96 3 +1 -0.160845 -2.968702 -0.164660 Rho 0.5643730E-02 |GRAD(Rho)| 0.9244259E-17 GRAD(Rho)x -0.5937518E-17 GRAD(Rho)y -0.1837471E-17 GRAD(Rho)z 0.6842946E-17 Laplacian 0.2298457E-01 (-1/4)Del**2(Rho)) -0.5746141E-02 Diamond 0.6302400E-03 Metallicity 0.5363569E+00 Ellipticity -0.4084517E+01 Gb(Abramov) 0.4344425E-02 Vb(Abramov) -0.2942708E-02 Hb(Abramov) 0.1401717E-02 Ex_ueg -0.7421186E-03 Ec_ueg -0.1747194E-03 Delta_ex -0.1169585E-02 Delta_ec 0.7229629E-03 Delta_et -0.4071858E-02 Pxc 0.4247487E+01 Qxc -0.1617767E+01 3,+1 97 3 +1 -1.317269 -2.173456 -1.152808 Rho 0.2754824E-01 |GRAD(Rho)| 0.1969343E-11 GRAD(Rho)x -0.1217958E-11 GRAD(Rho)y 0.5011045E-12 GRAD(Rho)z 0.1464167E-11 Laplacian 0.1115178E+00 (-1/4)Del**2(Rho)) -0.2787944E-01 Diamond 0.1790602E-01 Metallicity 0.1552717E+01 Ellipticity -0.6555574E+01 Gb(Abramov) 0.2580111E-01 Vb(Abramov) -0.2372277E-01 Hb(Abramov) 0.2078333E-02 Ex_ueg -0.6144835E-02 Ec_ueg -0.1217851E-02 Delta_ex -0.7236363E-02 Delta_ec 0.2102738E-02 Delta_et -0.1896999E-01 Pxc 0.5045640E+01 Qxc -0.3441400E+01 3,+1 98 3 -1 -1.750402 -1.723162 -0.526664 Rho 0.4392614E-01 |GRAD(Rho)| 0.2507009E-16 GRAD(Rho)x -0.1449866E-16 GRAD(Rho)y 0.3631230E-17 GRAD(Rho)z 0.2012741E-16 Laplacian 0.1760651E+00 (-1/4)Del**2(Rho)) -0.4401627E-01 Diamond 0.7406407E-01 Metallicity 0.2140318E+01 Ellipticity 0.1869860E-01 Gb(Abramov) 0.4504565E-01 Vb(Abramov) -0.4607503E-01 Hb(Abramov) -0.1029382E-02 Ex_ueg -0.1144676E-01 Ec_ueg -0.2081991E-02 Delta_ex -0.1398963E-01 Delta_ec 0.5179739E-02 Delta_et -0.5277248E-01 Pxc 0.5497985E+01 Qxc -0.2700838E+01 3,-1 99 3 -1 -1.768611 2.767417 -0.558198 Rho 0.1129560E+00 |GRAD(Rho)| 0.2599553E-15 GRAD(Rho)x 0.4908725E-16 GRAD(Rho)y 0.2039994E-16 GRAD(Rho)z -0.2544622E-15 Laplacian 0.4852296E+00 (-1/4)Del**2(Rho)) -0.1213074E+00 Diamond 0.7188706E+00 Metallicity 0.3748418E+01 Ellipticity 0.1865498E-01 Gb(Abramov) 0.1566567E+00 Vb(Abramov) -0.1920061E+00 Hb(Abramov) -0.3534935E-01 Ex_ueg -0.4032714E-01 Ec_ueg -0.6116352E-02 Delta_ex -0.4894890E-01 Delta_ec 0.1368308E-01 Delta_et -0.1747421E+00 Pxc 0.6593333E+01 Qxc -0.3577332E+01 3,-1 100 3 +1 -0.596693 -0.531844 1.706849 Rho 0.7498117E-02 |GRAD(Rho)| 0.2972757E-16 GRAD(Rho)x 0.7854877E-17 GRAD(Rho)y 0.1663311E-16 GRAD(Rho)z -0.2335314E-16 Laplacian 0.2774469E-01 (-1/4)Del**2(Rho)) -0.6936174E-02 Diamond 0.6161051E-03 Metallicity 0.7134336E+00 Ellipticity -0.1448885E+01 Gb(Abramov) 0.5448866E-02 Vb(Abramov) -0.3961558E-02 Hb(Abramov) 0.1487308E-02 Ex_ueg -0.1083897E-02 Ec_ueg -0.2559519E-03 Delta_ex -0.1224548E-02 Delta_ec 0.3904723E-03 Delta_et -0.2575955E-02 Pxc 0.4234769E+01 Qxc -0.3136070E+01 3,+1 101 3 -1 -1.995275 3.039224 0.866691 Rho 0.1400645E+00 |GRAD(Rho)| 0.2487825E-15 GRAD(Rho)x -0.4015614E-16 GRAD(Rho)y 0.2283059E-15 GRAD(Rho)z 0.9031404E-16 Laplacian 0.5707872E+00 (-1/4)Del**2(Rho)) -0.1426968E+00 Diamond 0.1075711E+01 Metallicity 0.4560571E+01 Ellipticity 0.1009245E-01 Gb(Abramov) 0.2035943E+00 Vb(Abramov) -0.2644919E+00 Hb(Abramov) -0.6089755E-01 Ex_ueg -0.5372247E-01 Ec_ueg -0.7810567E-02 Delta_ex -0.6039150E-01 Delta_ec 0.1493136E-01 Delta_et -0.1972251E+00 Pxc 0.6878178E+01 Qxc -0.4044608E+01 3,-1 102 3 +1 -1.020701 2.213235 1.463298 Rho 0.2521191E-01 |GRAD(Rho)| 0.1641165E-14 GRAD(Rho)x -0.1598811E-14 GRAD(Rho)y -0.2636636E-15 GRAD(Rho)z -0.2602050E-15 Laplacian 0.9422580E-01 (-1/4)Del**2(Rho)) -0.2355645E-01 Diamond 0.1004864E-01 Metallicity 0.1585330E+01 Ellipticity -0.2126693E+01 Gb(Abramov) 0.2192842E-01 Vb(Abramov) -0.2030040E-01 Hb(Abramov) 0.1628027E-02 Ex_ueg -0.5460001E-02 Ec_ueg -0.1099389E-02 Delta_ex -0.5613779E-02 Delta_ec 0.1135115E-02 Delta_et -0.1014536E-01 Pxc 0.4966394E+01 Qxc -0.4945559E+01 3,+1 103 3 +3 -1.142789 -1.089595 1.154114 Rho 0.4726464E-02 |GRAD(Rho)| 0.4574624E-17 GRAD(Rho)x 0.1574929E-17 GRAD(Rho)y -0.3901663E-17 GRAD(Rho)z 0.1795498E-17 Laplacian 0.1756471E-01 (-1/4)Del**2(Rho)) -0.4391179E-02 Diamond 0.1130672E-03 Metallicity 0.5222351E+00 Ellipticity -0.8578949E-01 Gb(Abramov) 0.3309657E-02 Vb(Abramov) -0.2228135E-02 Hb(Abramov) 0.1081522E-02 Ex_ueg -0.5858236E-03 Ec_ueg -0.1351605E-03 Delta_ex -0.5969611E-03 Delta_ec 0.7648107E-04 Delta_et -0.6022099E-03 Pxc 0.4334282E+01 Qxc -0.7805345E+01 3,+3 104 3 +1 -0.543626 0.542958 -1.713644 Rho 0.7986744E-02 |GRAD(Rho)| 0.7671666E-14 GRAD(Rho)x 0.5092319E-14 GRAD(Rho)y -0.1931865E-14 GRAD(Rho)z 0.5402837E-14 Laplacian 0.3028190E-01 (-1/4)Del**2(Rho)) -0.7570474E-02 Diamond 0.7258232E-03 Metallicity 0.7261835E+00 Ellipticity -0.1436357E+01 Gb(Abramov) 0.5963241E-02 Vb(Abramov) -0.4356009E-02 Hb(Abramov) 0.1607232E-02 Ex_ueg -0.1179084E-02 Ec_ueg -0.2776254E-03 Delta_ex -0.1354395E-02 Delta_ec 0.4200106E-03 Delta_et -0.2821600E-02 Pxc 0.4247032E+01 Qxc -0.3224669E+01 3,+1 105 3 +1 -0.532286 -1.672728 0.552932 Rho 0.8292473E-02 |GRAD(Rho)| 0.5530580E-17 GRAD(Rho)x 0.3968571E-17 GRAD(Rho)y -0.1939123E-17 GRAD(Rho)z 0.3328297E-17 Laplacian 0.3167999E-01 (-1/4)Del**2(Rho)) -0.7919999E-02 Diamond 0.8172887E-03 Metallicity 0.7389837E+00 Ellipticity -0.1469347E+01 Gb(Abramov) 0.6255457E-02 Vb(Abramov) -0.4590916E-02 Hb(Abramov) 0.1664541E-02 Ex_ueg -0.1239645E-02 Ec_ueg -0.2912416E-03 Delta_ex -0.1438988E-02 Delta_ec 0.4546800E-03 Delta_et -0.3071419E-02 Pxc 0.4256413E+01 Qxc -0.3164836E+01 3,+1 106 3 +3 -0.040473 0.043548 2.412001 Rho 0.3838516E-02 |GRAD(Rho)| 0.2196850E-14 GRAD(Rho)x 0.1011778E-14 GRAD(Rho)y -0.9829665E-15 GRAD(Rho)z -0.1684112E-14 Laplacian 0.1480595E-01 (-1/4)Del**2(Rho)) -0.3701486E-02 Diamond 0.1021899E-03 Metallicity 0.4379749E+00 Ellipticity -0.1418303E+00 Gb(Abramov) 0.2737851E-02 Vb(Abramov) -0.1774215E-02 Hb(Abramov) 0.9636358E-03 Ex_ueg -0.4438840E-03 Ec_ueg -0.9727702E-04 Delta_ex -0.5154662E-03 Delta_ec 0.1363040E-03 Delta_et -0.8197629E-03 Pxc 0.4563092E+01 Qxc -0.3781739E+01 3,+3 107 3 -1 -0.853214 -3.007808 -2.006888 Rho 0.1415907E+00 |GRAD(Rho)| 0.5207318E-15 GRAD(Rho)x 0.1470991E-15 GRAD(Rho)y 0.4026456E-15 GRAD(Rho)z -0.2956348E-15 Laplacian 0.5574333E+00 (-1/4)Del**2(Rho)) -0.1393583E+00 Diamond 0.1050377E+01 Metallicity 0.4754938E+01 Ellipticity 0.4614341E-01 Gb(Abramov) 0.2033456E+00 Vb(Abramov) -0.2673328E+00 Hb(Abramov) -0.6398724E-01 Ex_ueg -0.5450437E-01 Ec_ueg -0.7907390E-02 Delta_ex -0.5898426E-01 Delta_ec 0.1427616E-01 Delta_et -0.1883238E+00 Pxc 0.6892840E+01 Qxc -0.4131663E+01 3,-1 108 3 +1 -0.521618 1.661223 -0.545218 Rho 0.9107402E-02 |GRAD(Rho)| 0.9983827E-17 GRAD(Rho)x 0.5897493E-17 GRAD(Rho)y 0.3103317E-17 GRAD(Rho)z -0.7434097E-17 Laplacian 0.3533670E-01 (-1/4)Del**2(Rho)) -0.8834175E-02 Diamond 0.1005911E-02 Metallicity 0.7745415E+00 Ellipticity -0.1457262E+01 Gb(Abramov) 0.7029856E-02 Vb(Abramov) -0.5225537E-02 Hb(Abramov) 0.1804319E-02 Ex_ueg -0.1404681E-02 Ec_ueg -0.3277394E-03 Delta_ex -0.1631039E-02 Delta_ec 0.4848572E-03 Delta_et -0.3372972E-02 Pxc 0.4285969E+01 Qxc -0.3363957E+01 3,+1 109 3 -1 -0.876798 2.050287 3.084332 Rho 0.1265374E+00 |GRAD(Rho)| 0.9047340E-16 GRAD(Rho)x -0.5526721E-16 GRAD(Rho)y 0.6147426E-16 GRAD(Rho)z -0.3676801E-16 Laplacian 0.5102644E+00 (-1/4)Del**2(Rho)) -0.1275661E+00 Diamond 0.8610283E+00 Metallicity 0.4307079E+01 Ellipticity 0.7249040E-02 Gb(Abramov) 0.1766170E+00 Vb(Abramov) -0.2256678E+00 Hb(Abramov) -0.4905085E-01 Ex_ueg -0.4691846E-01 Ec_ueg -0.6958956E-02 Delta_ex -0.5280478E-01 Delta_ec 0.1389577E-01 Delta_et -0.1809475E+00 Pxc 0.6742169E+01 Qxc -0.3800062E+01 3,-1 110 3 +3 1.120676 1.123379 1.154494 Rho 0.4783703E-02 |GRAD(Rho)| 0.9042067E-14 GRAD(Rho)x -0.2670520E-14 GRAD(Rho)y 0.8187181E-14 GRAD(Rho)z -0.2756333E-14 Laplacian 0.1776823E-01 (-1/4)Del**2(Rho)) -0.4442058E-02 Diamond 0.1162263E-03 Metallicity 0.5267153E+00 Ellipticity -0.1727792E+00 Gb(Abramov) 0.3351322E-02 Vb(Abramov) -0.2260586E-02 Hb(Abramov) 0.1090736E-02 Ex_ueg -0.5953020E-03 Ec_ueg -0.1376166E-03 Delta_ex -0.6058441E-03 Delta_ec 0.7727764E-04 Delta_et -0.6100122E-03 Pxc 0.4325802E+01 Qxc -0.7839837E+01 3,+3 111 3 +3 0.014218 -2.295124 0.023715 Rho 0.4544900E-02 |GRAD(Rho)| 0.1229727E-14 GRAD(Rho)x 0.9728409E-15 GRAD(Rho)y 0.7346135E-15 GRAD(Rho)z 0.1617134E-15 Laplacian 0.1854396E-01 (-1/4)Del**2(Rho)) -0.4635990E-02 Diamond 0.1516307E-03 Metallicity 0.4633949E+00 Ellipticity -0.3695965E+00 Gb(Abramov) 0.3448709E-02 Vb(Abramov) -0.2261428E-02 Hb(Abramov) 0.1187281E-02 Ex_ueg -0.5560120E-03 Ec_ueg -0.1273809E-03 Delta_ex -0.6640425E-03 Delta_ec 0.1532113E-03 Delta_et -0.9843125E-03 Pxc 0.4364957E+01 Qxc -0.4334162E+01 3,+3 112 3 -1 -0.473834 -0.462754 -0.474774 Rho 0.1829007E+00 |GRAD(Rho)| 0.3425724E-14 GRAD(Rho)x 0.1967176E-14 GRAD(Rho)y 0.2178813E-14 GRAD(Rho)z 0.1765948E-14 Laplacian 0.4877937E+00 (-1/4)Del**2(Rho)) -0.1219484E+00 Diamond 0.1279220E+01 Metallicity 0.8325353E+01 Ellipticity 0.4500274E-02 Gb(Abramov) 0.2505095E+00 Vb(Abramov) -0.3790707E+00 Hb(Abramov) -0.1285611E+00 Ex_ueg -0.7667826E-01 Ec_ueg -0.1058195E-01 Delta_ex -0.5522646E-01 Delta_ec 0.1210289E-01 Delta_et -0.1660634E+00 Pxc 0.7246138E+01 Qxc -0.4563078E+01 3,-1 113 3 -1 -0.833870 -2.033722 -3.040542 Rho 0.1509774E+00 |GRAD(Rho)| 0.3584502E-15 GRAD(Rho)x -0.2237251E-15 GRAD(Rho)y 0.1200483E-15 GRAD(Rho)z -0.2530257E-15 Laplacian 0.5857831E+00 (-1/4)Del**2(Rho)) -0.1464458E+00 Diamond 0.1194101E+01 Metallicity 0.5035737E+01 Ellipticity 0.2690783E-01 Gb(Abramov) 0.2205409E+00 Vb(Abramov) -0.2946360E+00 Hb(Abramov) -0.7409514E-01 Ex_ueg -0.5937465E-01 Ec_ueg -0.8506113E-02 Delta_ex -0.6298557E-01 Delta_ec 0.1479839E-01 Delta_et -0.1970793E+00 Pxc 0.6980233E+01 Qxc -0.4256246E+01 3,-1 114 3 +1 2.202560 -1.061322 1.418527 Rho 0.2475046E-01 |GRAD(Rho)| 0.2588550E-16 GRAD(Rho)x 0.2150892E-16 GRAD(Rho)y -0.1435630E-16 GRAD(Rho)z -0.1150036E-17 Laplacian 0.9410427E-01 (-1/4)Del**2(Rho)) -0.2352607E-01 Diamond 0.1116341E-01 Metallicity 0.1539251E+01 Ellipticity -0.2765567E+01 Gb(Abramov) 0.2171947E-01 Vb(Abramov) -0.1991286E-01 Hb(Abramov) 0.1806603E-02 Ex_ueg -0.5327165E-02 Ec_ueg -0.1076159E-02 Delta_ex -0.5729739E-02 Delta_ec 0.1405159E-02 Delta_et -0.1241900E-01 Pxc 0.4950168E+01 Qxc -0.4077645E+01 3,+1 115 3 -1 -0.532555 -1.737375 -1.743843 Rho 0.4431438E-01 |GRAD(Rho)| 0.1116066E-15 GRAD(Rho)x 0.6222473E-16 GRAD(Rho)y -0.9110983E-16 GRAD(Rho)z -0.1682589E-16 Laplacian 0.1783232E+00 (-1/4)Del**2(Rho)) -0.4458080E-01 Diamond 0.7591227E-01 Metallicity 0.2144436E+01 Ellipticity 0.1290372E-01 Gb(Abramov) 0.4565398E-01 Vb(Abramov) -0.4672716E-01 Hb(Abramov) -0.1073180E-02 Ex_ueg -0.1158185E-01 Ec_ueg -0.2103092E-02 Delta_ex -0.1420005E-01 Delta_ec 0.5245417E-02 Delta_et -0.5356637E-01 Pxc 0.5507059E+01 Qxc -0.2707134E+01 3,-1 116 3 -1 -0.604021 -1.850135 2.857268 Rho 0.1319676E+00 |GRAD(Rho)| 0.7838718E-14 GRAD(Rho)x 0.5575455E-14 GRAD(Rho)y -0.5346228E-14 GRAD(Rho)z -0.1333284E-14 Laplacian 0.5585011E+00 (-1/4)Del**2(Rho)) -0.1396253E+00 Diamond 0.9943703E+00 Metallicity 0.4220540E+01 Ellipticity 0.1684429E-01 Gb(Abramov) 0.1912992E+00 Vb(Abramov) -0.2429731E+00 Hb(Abramov) -0.5167392E-01 Ex_ueg -0.4962206E-01 Ec_ueg -0.7299378E-02 Delta_ex -0.5841776E-01 Delta_ec 0.1512597E-01 Delta_et -0.1984957E+00 Pxc 0.6798123E+01 Qxc -0.3862083E+01 3,-1 117 3 +1 1.403840 1.080903 -2.205174 Rho 0.2576724E-01 |GRAD(Rho)| 0.1869065E-14 GRAD(Rho)x 0.1152732E-14 GRAD(Rho)y -0.4582581E-15 GRAD(Rho)z -0.1398075E-14 Laplacian 0.9855201E-01 (-1/4)Del**2(Rho)) -0.2463800E-01 Diamond 0.1266010E-01 Metallicity 0.1571789E+01 Ellipticity -0.3103373E+01 Gb(Abramov) 0.2287963E-01 Vb(Abramov) -0.2112125E-01 Hb(Abramov) 0.1758377E-02 Ex_ueg -0.5620941E-02 Ec_ueg -0.1127421E-02 Delta_ex -0.6098067E-02 Delta_ec 0.1527608E-02 Delta_et -0.1361473E-01 Pxc 0.4985664E+01 Qxc -0.3991907E+01 3,+1 118 3 -1 -0.525757 2.787683 -1.835999 Rho 0.1536714E+00 |GRAD(Rho)| 0.1144774E-14 GRAD(Rho)x 0.7401848E-15 GRAD(Rho)y -0.2701764E-15 GRAD(Rho)z -0.8304447E-15 Laplacian 0.6299374E+00 (-1/4)Del**2(Rho)) -0.1574843E+00 Diamond 0.1308807E+01 Metallicity 0.4822855E+01 Ellipticity 0.1912802E-01 Gb(Abramov) 0.2315769E+00 Vb(Abramov) -0.3056695E+00 Hb(Abramov) -0.7409257E-01 Ex_ueg -0.6079144E-01 Ec_ueg -0.8678949E-02 Delta_ex -0.6800141E-01 Delta_ec 0.1579425E-01 Delta_et -0.2107291E+00 Pxc 0.7004470E+01 Qxc -0.4305452E+01 3,-1 119 3 +1 -0.180358 2.976421 0.204824 Rho 0.5600652E-02 |GRAD(Rho)| 0.7340672E-17 GRAD(Rho)x -0.4812191E-17 GRAD(Rho)y 0.6978969E-18 GRAD(Rho)z -0.5499202E-17 Laplacian 0.2211654E-01 (-1/4)Del**2(Rho)) -0.5529134E-02 Diamond 0.5046363E-03 Metallicity 0.5503349E+00 Ellipticity -0.2021796E+01 Gb(Abramov) 0.4193235E-02 Vb(Abramov) -0.2857337E-02 Hb(Abramov) 0.1335899E-02 Ex_ueg -0.7345757E-03 Ec_ueg -0.1728522E-03 Delta_ex -0.1047426E-02 Delta_ec 0.5594400E-03 Delta_et -0.3197997E-02 Pxc 0.4249733E+01 Qxc -0.1872277E+01 3,+1 120 3 -1 -0.866629 3.082299 2.023393 Rho 0.1143915E+00 |GRAD(Rho)| 0.7699716E-14 GRAD(Rho)x -0.3653517E-14 GRAD(Rho)y -0.3067926E-14 GRAD(Rho)z -0.6043614E-14 Laplacian 0.4706038E+00 (-1/4)Del**2(Rho)) -0.1176510E+00 Diamond 0.7034386E+00 Metallicity 0.3947121E+01 Ellipticity 0.7189663E-02 Gb(Abramov) 0.1558311E+00 Vb(Abramov) -0.1940112E+00 Hb(Abramov) -0.3818012E-01 Ex_ueg -0.4101191E-01 Ec_ueg -0.6204795E-02 Delta_ex -0.4755088E-01 Delta_ec 0.1311949E-01 Delta_et -0.1677777E+00 Pxc 0.6609711E+01 Qxc -0.3624446E+01 3,-1 121 3 +3 1.970514 -1.975556 1.973935 Rho 0.1147543E-01 |GRAD(Rho)| 0.2552806E-16 GRAD(Rho)x 0.1292945E-16 GRAD(Rho)y 0.2166661E-16 GRAD(Rho)z -0.3881929E-17 Laplacian 0.4880579E-01 (-1/4)Del**2(Rho)) -0.1220145E-01 Diamond 0.1133310E-02 Metallicity 0.8243092E+00 Ellipticity -0.9270948E+00 Gb(Abramov) 0.9810592E-02 Vb(Abramov) -0.7419737E-02 Hb(Abramov) 0.2390855E-02 Ex_ueg -0.1911659E-02 Ec_ueg -0.4354075E-03 Delta_ex -0.2154371E-02 Delta_ec 0.2468172E-03 Delta_et -0.2134599E-02 Pxc 0.4390505E+01 Qxc -0.8728610E+01 3,+3 122 3 -1 0.017323 -0.001948 -3.010479 Rho 0.5228991E-02 |GRAD(Rho)| 0.4196687E-17 GRAD(Rho)x -0.1381750E-17 GRAD(Rho)y 0.3780303E-17 GRAD(Rho)z 0.1188385E-17 Laplacian 0.2027232E-01 (-1/4)Del**2(Rho)) -0.5068079E-02 Diamond 0.5589389E-03 Metallicity 0.5354755E+00 Ellipticity 0.4764793E+01 Gb(Abramov) 0.3831025E-02 Vb(Abramov) -0.2593970E-02 Hb(Abramov) 0.1237054E-02 Ex_ueg -0.6703098E-03 Ec_ueg -0.1567805E-03 Delta_ex -0.1066424E-02 Delta_ec 0.7271473E-03 Delta_et -0.3966750E-02 Pxc 0.4275467E+01 Qxc -0.1466586E+01 3,-1 123 3 +1 0.155972 0.129561 -3.009655 Rho 0.5213885E-02 |GRAD(Rho)| 0.6802450E-15 GRAD(Rho)x 0.4839171E-15 GRAD(Rho)y 0.4766350E-15 GRAD(Rho)z -0.3710244E-16 Laplacian 0.2052528E-01 (-1/4)Del**2(Rho)) -0.5131319E-02 Diamond 0.4987937E-03 Metallicity 0.5263321E+00 Ellipticity -0.3790199E+01 Gb(Abramov) 0.3871009E-02 Vb(Abramov) -0.2610699E-02 Hb(Abramov) 0.1260310E-02 Ex_ueg -0.6677290E-03 Ec_ueg -0.1561287E-03 Delta_ex -0.1022141E-02 Delta_ec 0.6344315E-03 Delta_et -0.3493877E-02 Pxc 0.4276786E+01 Qxc -0.1611113E+01 3,+1 124 3 -1 -0.551400 1.769671 1.757014 Rho 0.3763788E-01 |GRAD(Rho)| 0.9543126E-16 GRAD(Rho)x 0.5549125E-16 GRAD(Rho)y 0.9733679E-17 GRAD(Rho)z 0.7702664E-16 Laplacian 0.1598152E+00 (-1/4)Del**2(Rho)) -0.3995379E-01 Diamond 0.5905314E-01 Metallicity 0.1822652E+01 Ellipticity 0.1638875E-01 Gb(Abramov) 0.3877283E-01 Vb(Abramov) -0.3759188E-01 Hb(Abramov) 0.1180955E-02 Ex_ueg -0.9315766E-02 Ec_ueg -0.1743903E-02 Delta_ex -0.1250710E-01 Delta_ec 0.5219484E-02 Delta_et -0.5105892E-01 Pxc 0.5341905E+01 Qxc -0.2396234E+01 3,-1 125 3 -1 -0.489087 0.489534 0.463663 Rho 0.1797657E+00 |GRAD(Rho)| 0.2028663E-15 GRAD(Rho)x -0.1283695E-15 GRAD(Rho)y -0.1734723E-16 GRAD(Rho)z 0.1561251E-15 Laplacian 0.4760619E+00 (-1/4)Del**2(Rho)) -0.1190155E+00 Diamond 0.1222220E+01 Metallicity 0.8288220E+01 Ellipticity 0.9577963E-02 Gb(Abramov) 0.2437481E+00 Vb(Abramov) -0.3684806E+00 Hb(Abramov) -0.1247326E+00 Ex_ueg -0.7493090E-01 Ec_ueg -0.1037546E-01 Delta_ex -0.5366070E-01 Delta_ec 0.1185700E-01 Delta_et -0.1623506E+00 Pxc 0.7221933E+01 Qxc -0.4525656E+01 3,-1 126 3 +1 0.528876 0.611575 1.704701 Rho 0.7537290E-02 |GRAD(Rho)| 0.1401911E-16 GRAD(Rho)x -0.6604313E-17 GRAD(Rho)y 0.1054301E-16 GRAD(Rho)z 0.6462461E-17 Laplacian 0.2783534E-01 (-1/4)Del**2(Rho)) -0.6958835E-02 Diamond 0.6215494E-03 Metallicity 0.7173130E+00 Ellipticity -0.1451278E+01 Gb(Abramov) 0.5471167E-02 Vb(Abramov) -0.3983499E-02 Hb(Abramov) 0.1487668E-02 Ex_ueg -0.1091454E-02 Ec_ueg -0.2576854E-03 Delta_ex -0.1229632E-02 Delta_ec 0.3908220E-03 Delta_et -0.2582529E-02 Pxc 0.4235606E+01 Qxc -0.3146271E+01 3,+1 127 3 -1 -0.537904 1.835827 -2.848806 Rho 0.1516484E+00 |GRAD(Rho)| 0.3182123E-15 GRAD(Rho)x -0.8696657E-16 GRAD(Rho)y -0.2445689E-15 GRAD(Rho)z -0.1840704E-15 Laplacian 0.6197206E+00 (-1/4)Del**2(Rho)) -0.1549301E+00 Diamond 0.1265131E+01 Metallicity 0.4795278E+01 Ellipticity 0.1190432E-01 Gb(Abramov) 0.2271089E+00 Vb(Abramov) -0.2992877E+00 Hb(Abramov) -0.7217880E-01 Ex_ueg -0.5972676E-01 Ec_ueg -0.8549121E-02 Delta_ex -0.6665939E-01 Delta_ec 0.1555260E-01 Delta_et -0.2070478E+00 Pxc 0.6986304E+01 Qxc -0.4286059E+01 3,-1 128 3 -1 -0.068013 -2.970764 -0.069440 Rho 0.5652178E-02 |GRAD(Rho)| 0.7505038E-16 GRAD(Rho)x -0.5723631E-16 GRAD(Rho)y -0.1194075E-17 GRAD(Rho)z -0.4852977E-16 Laplacian 0.2244701E-01 (-1/4)Del**2(Rho)) -0.5611751E-02 Diamond 0.6960362E-03 Metallicity 0.5505725E+00 Ellipticity 0.3535423E+01 Gb(Abramov) 0.4256114E-02 Vb(Abramov) -0.2900476E-02 Hb(Abramov) 0.1355638E-02 Ex_ueg -0.7436003E-03 Ec_ueg -0.1750858E-03 Delta_ex -0.1205094E-02 Delta_ec 0.8176911E-03 Delta_et -0.4562962E-02 Pxc 0.4247063E+01 Qxc -0.1473777E+01 3,-1 129 3 -1 -0.068609 -3.284533 3.242765 Rho 0.2072010E+00 |GRAD(Rho)| 0.4100018E-15 GRAD(Rho)x -0.2392021E-16 GRAD(Rho)y -0.3479205E-15 GRAD(Rho)z 0.2155936E-15 Laplacian 0.7789482E+00 (-1/4)Del**2(Rho)) -0.1947370E+00 Diamond 0.2310620E+01 Metallicity 0.6418363E+01 Ellipticity 0.2255326E-02 Gb(Abramov) 0.3381402E+00 Vb(Abramov) -0.4815434E+00 Hb(Abramov) -0.1434032E+00 Ex_ueg -0.9055397E-01 Ec_ueg -0.1220135E-01 Delta_ex -0.9061207E-01 Delta_ec 0.1797259E-01 Delta_et -0.2471111E+00 Pxc 0.7421633E+01 Qxc -0.5041681E+01 3,-1 130 3 +1 1.053498 -2.188553 1.413178 Rho 0.2478044E-01 |GRAD(Rho)| 0.3507283E-16 GRAD(Rho)x -0.2529812E-16 GRAD(Rho)y 0.5720252E-18 GRAD(Rho)z 0.2428540E-16 Laplacian 0.9428920E-01 (-1/4)Del**2(Rho)) -0.2357230E-01 Diamond 0.1127614E-01 Metallicity 0.1539334E+01 Ellipticity -0.2825904E+01 Gb(Abramov) 0.2176248E-01 Vb(Abramov) -0.1995265E-01 Hb(Abramov) 0.1809825E-02 Ex_ueg -0.5335770E-02 Ec_ueg -0.1077666E-02 Delta_ex -0.5750810E-02 Delta_ec 0.1422063E-02 Delta_et -0.1256811E-01 Pxc 0.4951228E+01 Qxc -0.4043992E+01 3,+1 131 3 +1 0.210752 2.961131 -0.191395 Rho 0.5715075E-02 |GRAD(Rho)| 0.1412893E-16 GRAD(Rho)x 0.9317552E-17 GRAD(Rho)y -0.1382061E-17 GRAD(Rho)z 0.1053090E-16 Laplacian 0.2342358E-01 (-1/4)Del**2(Rho)) -0.5855895E-02 Diamond 0.6274249E-03 Metallicity 0.5374399E+00 Ellipticity -0.3055443E+01 Gb(Abramov) 0.4428462E-02 Vb(Abramov) -0.3001029E-02 Hb(Abramov) 0.1427433E-02 Ex_ueg -0.7546537E-03 Ec_ueg -0.1778140E-03 Delta_ex -0.1174827E-02 Delta_ec 0.7009800E-03 Delta_et -0.3977167E-02 Pxc 0.4244061E+01 Qxc -0.1675978E+01 3,+1 132 3 -1 0.077988 2.966502 -0.057365 Rho 0.5738751E-02 |GRAD(Rho)| 0.2621795E-17 GRAD(Rho)x -0.1519790E-17 GRAD(Rho)y 0.6908341E-18 GRAD(Rho)z -0.2021582E-17 Laplacian 0.2260724E-01 (-1/4)Del**2(Rho)) -0.5651810E-02 Diamond 0.7178078E-03 Metallicity 0.5606966E+00 Ellipticity 0.2524866E+01 Gb(Abramov) 0.4296032E-02 Vb(Abramov) -0.2940254E-02 Hb(Abramov) 0.1355778E-02 Ex_ueg -0.7588249E-03 Ec_ueg -0.1788415E-03 Delta_ex -0.1218948E-02 Delta_ec 0.8267476E-03 Delta_et -0.4633750E-02 Pxc 0.4243002E+01 Qxc -0.1474389E+01 3,-1 133 3 -1 -0.046818 3.249874 -3.223220 Rho 0.2313285E+00 |GRAD(Rho)| 0.9186259E-12 GRAD(Rho)x 0.1690237E-12 GRAD(Rho)y -0.6604780E-12 GRAD(Rho)z 0.6156892E-12 Laplacian 0.8498454E+00 (-1/4)Del**2(Rho)) -0.2124614E+00 Diamond 0.2875791E+01 Metallicity 0.7068412E+01 Ellipticity 0.1625010E-02 Gb(Abramov) 0.3919350E+00 Vb(Abramov) -0.5714086E+00 Hb(Abramov) -0.1794736E+00 Ex_ueg -0.1048795E+00 Ec_ueg -0.1384174E-01 Delta_ex -0.1017004E+00 Delta_ec 0.1898133E-01 Delta_et -0.2625623E+00 Pxc 0.7577047E+01 Qxc -0.5357914E+01 3,-1 134 3 -1 0.069978 3.303580 3.268674 Rho 0.2084767E+00 |GRAD(Rho)| 0.1340664E-12 GRAD(Rho)x -0.2580697E-13 GRAD(Rho)y -0.9599732E-13 GRAD(Rho)z -0.8995734E-13 Laplacian 0.7793108E+00 (-1/4)Del**2(Rho)) -0.1948277E+00 Diamond 0.2332869E+01 Metallicity 0.6481343E+01 Ellipticity 0.2361359E-02 Gb(Abramov) 0.3403426E+00 Vb(Abramov) -0.4858576E+00 Hb(Abramov) -0.1455150E+00 Ex_ueg -0.9129810E-01 Ec_ueg -0.1228728E-01 Delta_ex -0.9082324E-01 Delta_ec 0.1799672E-01 Delta_et -0.2477209E+00 Pxc 0.7430293E+01 Qxc -0.5046655E+01 3,-1 135 3 +3 0.008787 0.000468 -2.352246 Rho 0.4329665E-02 |GRAD(Rho)| 0.8503202E-12 GRAD(Rho)x 0.6562826E-12 GRAD(Rho)y 0.3270331E-12 GRAD(Rho)z -0.4305659E-12 Laplacian 0.1730045E-01 (-1/4)Del**2(Rho)) -0.4325112E-02 Diamond 0.1329363E-03 Metallicity 0.4581204E+00 Ellipticity -0.2733991E+00 Gb(Abramov) 0.3213645E-02 Vb(Abramov) -0.2102178E-02 Hb(Abramov) 0.1111467E-02 Ex_ueg -0.5211836E-03 Ec_ueg -0.1181806E-03 Delta_ex -0.6123451E-03 Delta_ec 0.1439316E-03 Delta_et -0.9127726E-03 Pxc 0.4410061E+01 Qxc -0.4254416E+01 3,+3 136 3 +1 1.301097 2.181120 -1.195196 Rho 0.2781334E-01 |GRAD(Rho)| 0.1528845E-16 GRAD(Rho)x 0.1119805E-16 GRAD(Rho)y -0.9417812E-17 GRAD(Rho)z 0.4432281E-17 Laplacian 0.1138844E+00 (-1/4)Del**2(Rho)) -0.2847110E-01 Diamond 0.1901230E-01 Metallicity 0.1544913E+01 Ellipticity -0.9005413E+01 Gb(Abramov) 0.2631163E-01 Vb(Abramov) -0.2415216E-01 Hb(Abramov) 0.2159469E-02 Ex_ueg -0.6223803E-02 Ec_ueg -0.1231378E-02 Delta_ex -0.7454267E-02 Delta_ec 0.2228766E-02 Delta_et -0.2014392E-01 Pxc 0.5054339E+01 Qxc -0.3344572E+01 3,+1 137 3 +3 1.124084 -1.101519 -1.129425 Rho 0.4903613E-02 |GRAD(Rho)| 0.1025469E-12 GRAD(Rho)x 0.9031144E-13 GRAD(Rho)y -0.3912540E-13 GRAD(Rho)z -0.2879085E-13 Laplacian 0.1873934E-01 (-1/4)Del**2(Rho)) -0.4684835E-02 Diamond 0.1286031E-03 Metallicity 0.5204582E+00 Ellipticity -0.9613749E-01 Gb(Abramov) 0.3529600E-02 Vb(Abramov) -0.2374365E-02 Hb(Abramov) 0.1155235E-02 Ex_ueg -0.6152808E-03 Ec_ueg -0.1427672E-03 Delta_ex -0.6450713E-03 Delta_ec 0.8456101E-04 Delta_et -0.6613739E-03 Pxc 0.4309677E+01 Qxc -0.7628472E+01 3,+3 138 3 -1 0.469042 -0.455877 0.485232 Rho 0.1851664E+00 |GRAD(Rho)| 0.3167876E-13 GRAD(Rho)x -0.1707315E-13 GRAD(Rho)y 0.1891542E-13 GRAD(Rho)z -0.1882175E-13 Laplacian 0.4968569E+00 (-1/4)Del**2(Rho)) -0.1242142E+00 Diamond 0.1318359E+01 Metallicity 0.8342930E+01 Ellipticity 0.2559781E-02 Gb(Abramov) 0.2555279E+00 Vb(Abramov) -0.3868416E+00 Hb(Abramov) -0.1313137E+00 Ex_ueg -0.7794732E-01 Ec_ueg -0.1073153E-01 Delta_ex -0.5639632E-01 Delta_ec 0.1223388E-01 Delta_et -0.1679233E+00 Pxc 0.7263395E+01 Qxc -0.4609848E+01 3,-1 139 3 -1 0.545218 1.741232 -1.753548 Rho 0.4484666E-01 |GRAD(Rho)| 0.4676051E-16 GRAD(Rho)x -0.3997127E-16 GRAD(Rho)y -0.2347086E-16 GRAD(Rho)z -0.6161318E-17 Laplacian 0.1809021E+00 (-1/4)Del**2(Rho)) -0.4522553E-01 Diamond 0.7840313E-01 Metallicity 0.2156352E+01 Ellipticity 0.1355045E-01 Gb(Abramov) 0.4640405E-01 Vb(Abramov) -0.4758256E-01 Hb(Abramov) -0.1178519E-02 Ex_ueg -0.1176771E-01 Ec_ueg -0.2132061E-02 Delta_ex -0.1445514E-01 Delta_ec 0.5332606E-02 Delta_et -0.5463148E-01 Pxc 0.5519404E+01 Qxc -0.2710709E+01 3,-1 140 3 -1 0.475014 0.480878 -0.474482 Rho 0.1828846E+00 |GRAD(Rho)| 0.2670036E-14 GRAD(Rho)x -0.1481454E-14 GRAD(Rho)y -0.1620232E-14 GRAD(Rho)z 0.1519618E-14 Laplacian 0.4876905E+00 (-1/4)Del**2(Rho)) -0.1219226E+00 Diamond 0.1278827E+01 Metallicity 0.8325892E+01 Ellipticity 0.5093099E-02 Gb(Abramov) 0.2504675E+00 Vb(Abramov) -0.3790124E+00 Hb(Abramov) -0.1285449E+00 Ex_ueg -0.7666926E-01 Ec_ueg -0.1058089E-01 Delta_ex -0.5521365E-01 Delta_ec 0.1210078E-01 Delta_et -0.1660333E+00 Pxc 0.7246014E+01 Qxc -0.4562817E+01 3,-1 141 3 +1 1.700753 0.544359 0.549680 Rho 0.8137204E-02 |GRAD(Rho)| 0.1469673E-12 GRAD(Rho)x 0.1086662E-12 GRAD(Rho)y 0.7723418E-13 GRAD(Rho)z 0.6185416E-13 Laplacian 0.3106932E-01 (-1/4)Del**2(Rho)) -0.7767331E-02 Diamond 0.7732853E-03 Metallicity 0.7301409E+00 Ellipticity -0.1450061E+01 Gb(Abramov) 0.6123428E-02 Vb(Abramov) -0.4479526E-02 Hb(Abramov) 0.1643903E-02 Ex_ueg -0.1208793E-02 Ec_ueg -0.2843211E-03 Delta_ex -0.1400740E-02 Delta_ec 0.4390881E-03 Delta_et -0.2957125E-02 Pxc 0.4251506E+01 Qxc -0.3190112E+01 3,+1 142 3 +3 2.349714 -0.015990 0.002960 Rho 0.4305104E-02 |GRAD(Rho)| 0.6913294E-14 GRAD(Rho)x -0.3550608E-14 GRAD(Rho)y 0.2367871E-14 GRAD(Rho)z 0.5438750E-14 Laplacian 0.1730150E-01 (-1/4)Del**2(Rho)) -0.4325375E-02 Diamond 0.1360963E-03 Metallicity 0.4537697E+00 Ellipticity -0.2972941E+00 Gb(Abramov) 0.3210704E-02 Vb(Abramov) -0.2096033E-02 Hb(Abramov) 0.1114671E-02 Ex_ueg -0.5172454E-03 Ec_ueg -0.1171323E-03 Delta_ex -0.6162173E-03 Delta_ec 0.1523897E-03 Delta_et -0.9520199E-03 Pxc 0.4415908E+01 Qxc -0.4043693E+01 3,+3 143 3 -1 0.864064 -3.037246 1.992753 Rho 0.1061908E+00 |GRAD(Rho)| 0.2349843E-15 GRAD(Rho)x -0.2122190E-15 GRAD(Rho)y 0.8405955E-16 GRAD(Rho)z 0.5580931E-16 Laplacian 0.4392505E+00 (-1/4)Del**2(Rho)) -0.1098126E+00 Diamond 0.6062750E+00 Metallicity 0.3735761E+01 Ellipticity 0.5469128E-02 Gb(Abramov) 0.1415807E+00 Vb(Abramov) -0.1733488E+00 Hb(Abramov) -0.3176809E-01 Ex_ueg -0.3713935E-01 Ec_ueg -0.5701572E-02 Delta_ex -0.4371047E-01 Delta_ec 0.1261958E-01 Delta_et -0.1593271E+00 Pxc 0.6513880E+01 Qxc -0.3463703E+01 3,-1 144 3 -1 0.561785 -2.791183 -1.813308 Rho 0.1417095E+00 |GRAD(Rho)| 0.1408847E-11 GRAD(Rho)x -0.8869075E-12 GRAD(Rho)y 0.1774648E-12 GRAD(Rho)z -0.1080163E-11 Laplacian 0.5932131E+00 (-1/4)Del**2(Rho)) -0.1483033E+00 Diamond 0.1116110E+01 Metallicity 0.4474395E+01 Ellipticity 0.1452910E-01 Gb(Abramov) 0.2094634E+00 Vb(Abramov) -0.2706235E+00 Hb(Abramov) -0.6116014E-01 Ex_ueg -0.5456538E-01 Ec_ueg -0.7914936E-02 Delta_ex -0.6275288E-01 Delta_ec 0.1513536E-01 Delta_et -0.1995676E+00 Pxc 0.6893976E+01 Qxc -0.4146110E+01 3,-1 145 3 -1 2.029867 -0.885529 3.073944 Rho 0.1284967E+00 |GRAD(Rho)| 0.1887191E-13 GRAD(Rho)x -0.1536449E-13 GRAD(Rho)y -0.7670947E-14 GRAD(Rho)z -0.7825487E-14 Laplacian 0.5180133E+00 (-1/4)Del**2(Rho)) -0.1295033E+00 Diamond 0.8907758E+00 Metallicity 0.4352698E+01 Ellipticity 0.1162078E-01 Gb(Abramov) 0.1802837E+00 Vb(Abramov) -0.2310641E+00 Hb(Abramov) -0.5078038E-01 Ex_ueg -0.4788956E-01 Ec_ueg -0.7081555E-02 Delta_ex -0.5380846E-01 Delta_ec 0.1406440E-01 Delta_et -0.1836407E+00 Pxc 0.6762577E+01 Qxc -0.3825861E+01 3,-1 146 3 -1 0.594567 1.872523 2.863334 Rho 0.1251049E+00 |GRAD(Rho)| 0.3567941E-15 GRAD(Rho)x -0.2738153E-15 GRAD(Rho)y 0.2050226E-15 GRAD(Rho)z -0.1014542E-15 Laplacian 0.5321837E+00 (-1/4)Del**2(Rho)) -0.1330459E+00 Diamond 0.8897375E+00 Metallicity 0.4052055E+01 Ellipticity 0.2055159E-01 Gb(Abramov) 0.1785488E+00 Vb(Abramov) -0.2240518E+00 Hb(Abramov) -0.4550292E-01 Ex_ueg -0.4621157E-01 Ec_ueg -0.6869477E-02 Delta_ex -0.5497363E-01 Delta_ec 0.1462026E-01 Delta_et -0.1901585E+00 Pxc 0.6727087E+01 Qxc -0.3760100E+01 3,-1 147 3 -1 0.864370 2.020568 -3.046766 Rho 0.1459118E+00 |GRAD(Rho)| 0.1284220E-15 GRAD(Rho)x -0.1780802E-16 GRAD(Rho)y -0.9402743E-16 GRAD(Rho)z 0.8563842E-16 Laplacian 0.5688041E+00 (-1/4)Del**2(Rho)) -0.1422010E+00 Diamond 0.1111671E+01 Metallicity 0.4899303E+01 Ellipticity 0.2444766E-01 Gb(Abramov) 0.2109150E+00 Vb(Abramov) -0.2796290E+00 Hb(Abramov) -0.6871397E-01 Ex_ueg -0.5673340E-01 Ec_ueg -0.8182324E-02 Delta_ex -0.6063651E-01 Delta_ec 0.1446851E-01 Delta_et -0.1917148E+00 Pxc 0.6933654E+01 Qxc -0.4190928E+01 3,-1 148 3 -1 0.881926 3.003739 -2.025838 Rho 0.1361660E+00 |GRAD(Rho)| 0.1894590E-15 GRAD(Rho)x 0.6036296E-16 GRAD(Rho)y -0.2490954E-16 GRAD(Rho)z -0.1778498E-15 Laplacian 0.5329003E+00 (-1/4)Del**2(Rho)) -0.1332251E+00 Diamond 0.9600661E+00 Metallicity 0.4660315E+01 Ellipticity 0.3944574E-01 Gb(Abramov) 0.1922952E+00 Vb(Abramov) -0.2513653E+00 Hb(Abramov) -0.5907011E-01 Ex_ueg -0.5173806E-01 Ec_ueg -0.7563912E-02 Delta_ex -0.5587655E-01 Delta_ec 0.1381786E-01 Delta_et -0.1812865E+00 Pxc 0.6840119E+01 Qxc -0.4043792E+01 3,-1 149 3 -1 0.562779 -1.843732 -2.818957 Rho 0.1525835E+00 |GRAD(Rho)| 0.3962994E-15 GRAD(Rho)x -0.2722974E-15 GRAD(Rho)y -0.2730021E-15 GRAD(Rho)z 0.9152699E-16 Laplacian 0.6259414E+00 (-1/4)Del**2(Rho)) -0.1564854E+00 Diamond 0.1286895E+01 Metallicity 0.4796513E+01 Ellipticity 0.1066554E-01 Gb(Abramov) 0.2294209E+00 Vb(Abramov) -0.3023565E+00 Hb(Abramov) -0.7293555E-01 Ex_ueg -0.6021832E-01 Ec_ueg -0.8609102E-02 Delta_ex -0.6742676E-01 Delta_ec 0.1567753E-01 Delta_et -0.2088668E+00 Pxc 0.6994727E+01 Qxc -0.4300855E+01 3,-1 150 3 +1 1.767151 -1.777804 -1.783828 Rho 0.1203043E-01 |GRAD(Rho)| 0.3734661E-14 GRAD(Rho)x -0.1414629E-14 GRAD(Rho)y -0.3172837E-14 GRAD(Rho)z 0.1370994E-14 Laplacian 0.5860953E-01 (-1/4)Del**2(Rho)) -0.1465238E-01 Diamond 0.2281585E-02 Metallicity 0.7426433E+00 Ellipticity -0.1248203E+01 Gb(Abramov) 0.1158184E-01 Vb(Abramov) -0.8511292E-02 Hb(Abramov) 0.3070545E-02 Ex_ueg -0.2035917E-02 Ec_ueg -0.4609740E-03 Delta_ex -0.2861219E-02 Delta_ec 0.7221443E-03 Delta_et -0.5447862E-02 Pxc 0.4416554E+01 Qxc -0.3962115E+01 3,+1 151 3 -1 0.522174 -1.727322 1.767269 Rho 0.4077610E-01 |GRAD(Rho)| 0.1458143E-15 GRAD(Rho)x -0.1716512E-17 GRAD(Rho)y -0.1033130E-15 GRAD(Rho)z 0.1028849E-15 Laplacian 0.1746597E+00 (-1/4)Del**2(Rho)) -0.4366493E-01 Diamond 0.7231614E-01 Metallicity 0.1905885E+01 Ellipticity 0.1711147E-01 Gb(Abramov) 0.4298001E-01 Vb(Abramov) -0.4229508E-01 Hb(Abramov) 0.6849222E-03 Ex_ueg -0.1036556E-01 Ec_ueg -0.1911744E-02 Delta_ex -0.1395731E-01 Delta_ec 0.5738358E-02 Delta_et -0.5739255E-01 Pxc 0.5422044E+01 Qxc -0.2432282E+01 3,-1 152 3 -1 0.877604 -2.037046 3.068136 Rho 0.1269821E+00 |GRAD(Rho)| 0.1769621E-13 GRAD(Rho)x 0.7542361E-14 GRAD(Rho)y 0.1421785E-13 GRAD(Rho)z -0.7356718E-14 Laplacian 0.5127082E+00 (-1/4)Del**2(Rho)) -0.1281770E+00 Diamond 0.8695832E+00 Metallicity 0.4311687E+01 Ellipticity 0.9580255E-02 Gb(Abramov) 0.1775613E+00 Vb(Abramov) -0.2269455E+00 Hb(Abramov) -0.4938421E-01 Ex_ueg -0.4713844E-01 Ec_ueg -0.6986761E-02 Delta_ex -0.5311177E-01 Delta_ec 0.1396808E-01 Delta_et -0.1820291E+00 Pxc 0.6746823E+01 Qxc -0.3802366E+01 3,-1 153 3 +1 2.014584 -2.020641 2.014535 Rho 0.1148028E-01 |GRAD(Rho)| 0.9226206E-14 GRAD(Rho)x -0.5309535E-14 GRAD(Rho)y 0.5502935E-14 GRAD(Rho)z -0.5162307E-14 Laplacian 0.4906825E-01 (-1/4)Del**2(Rho)) -0.1226706E-01 Diamond 0.1287931E-02 Metallicity 0.8204770E+00 Ellipticity -0.1060581E+01 Gb(Abramov) 0.9855516E-02 Vb(Abramov) -0.7443969E-02 Hb(Abramov) 0.2411547E-02 Ex_ueg -0.1912735E-02 Ec_ueg -0.4356302E-03 Delta_ex -0.2211546E-02 Delta_ec 0.3290690E-03 Delta_et -0.2682838E-02 Pxc 0.4390731E+01 Qxc -0.6720616E+01 3,+1 154 3 +1 1.144020 -1.340427 2.219498 Rho 0.2516598E-01 |GRAD(Rho)| 0.4878096E-16 GRAD(Rho)x 0.8204143E-19 GRAD(Rho)y -0.2244538E-17 GRAD(Rho)z 0.4872923E-16 Laplacian 0.9450699E-01 (-1/4)Del**2(Rho)) -0.2362675E-01 Diamond 0.1314366E-01 Metallicity 0.1575816E+01 Ellipticity -0.8339500E+01 Gb(Abramov) 0.2195640E-01 Vb(Abramov) -0.2028605E-01 Hb(Abramov) 0.1670346E-02 Ex_ueg -0.5446743E-02 Ec_ueg -0.1097075E-02 Delta_ex -0.5960358E-02 Delta_ec 0.1732503E-02 Delta_et -0.1528862E-01 Pxc 0.4964788E+01 Qxc -0.3440316E+01 3,+1 155 3 -1 1.752597 1.738412 -0.527792 Rho 0.4422963E-01 |GRAD(Rho)| 0.7525286E-16 GRAD(Rho)x -0.3113058E-16 GRAD(Rho)y -0.6783972E-16 GRAD(Rho)z -0.9573590E-17 Laplacian 0.1777470E+00 (-1/4)Del**2(Rho)) -0.4443674E-01 Diamond 0.7553286E-01 Metallicity 0.2144535E+01 Ellipticity 0.1383456E-01 Gb(Abramov) 0.4550719E-01 Vb(Abramov) -0.4657763E-01 Hb(Abramov) -0.1070442E-02 Ex_ueg -0.1155233E-01 Ec_ueg -0.2098483E-02 Delta_ex -0.1415056E-01 Delta_ec 0.5234212E-02 Delta_et -0.5342591E-01 Pxc 0.5505083E+01 Qxc -0.2703475E+01 3,-1 156 3 +1 2.046914 2.008863 -2.047039 Rho 0.1203168E-01 |GRAD(Rho)| 0.9221925E-15 GRAD(Rho)x -0.5444182E-15 GRAD(Rho)y -0.5200752E-15 GRAD(Rho)z 0.5325125E-15 Laplacian 0.5452752E-01 (-1/4)Del**2(Rho)) -0.1363188E-01 Diamond 0.1626232E-02 Metallicity 0.7983764E+00 Ellipticity -0.1086355E+01 Gb(Abramov) 0.1090182E-01 Vb(Abramov) -0.8171750E-02 Hb(Abramov) 0.2730065E-02 Ex_ueg -0.2036198E-02 Ec_ueg -0.4610315E-03 Delta_ex -0.2518970E-02 Delta_ec 0.4164549E-03 Delta_et -0.3348282E-02 Pxc 0.4416613E+01 Qxc -0.6048602E+01 3,+1 157 3 -1 1.746941 -1.735737 0.554121 Rho 0.4072706E-01 |GRAD(Rho)| 0.1016374E-15 GRAD(Rho)x -0.5241080E-16 GRAD(Rho)y 0.6186877E-16 GRAD(Rho)z 0.6128241E-16 Laplacian 0.1624218E+00 (-1/4)Del**2(Rho)) -0.4060544E-01 Diamond 0.6112438E-01 Metallicity 0.2045380E+01 Ellipticity 0.1763048E-01 Gb(Abramov) 0.4091256E-01 Vb(Abramov) -0.4121967E-01 Hb(Abramov) -0.3071146E-03 Ex_ueg -0.1034894E-01 Ec_ueg -0.1909107E-02 Delta_ex -0.1263477E-01 Delta_ec 0.4727865E-02 Delta_et -0.4720021E-01 Pxc 0.5420828E+01 Qxc -0.2672405E+01 3,-1 158 3 -1 1.843769 2.808095 0.555051 Rho 0.1583917E+00 |GRAD(Rho)| 0.4584134E-15 GRAD(Rho)x -0.3204088E-15 GRAD(Rho)y 0.2585890E-15 GRAD(Rho)z 0.2015261E-15 Laplacian 0.6551447E+00 (-1/4)Del**2(Rho)) -0.1637862E+00 Diamond 0.1402409E+01 Metallicity 0.4877119E+01 Ellipticity 0.1192509E-01 Gb(Abramov) 0.2423249E+00 Vb(Abramov) -0.3208636E+00 Hb(Abramov) -0.7853873E-01 Ex_ueg -0.6329387E-01 Ec_ueg -0.8982851E-02 Delta_ex -0.7116916E-01 Delta_ec 0.1615032E-01 Delta_et -0.2159542E+00 Pxc 0.7046079E+01 Qxc -0.4406671E+01 3,-1 159 3 -1 2.027738 2.999488 -0.861825 Rho 0.1283343E+00 |GRAD(Rho)| 0.8424922E-16 GRAD(Rho)x -0.1237346E-16 GRAD(Rho)y -0.6800658E-16 GRAD(Rho)z 0.4816568E-16 Laplacian 0.5019397E+00 (-1/4)Del**2(Rho)) -0.1254849E+00 Diamond 0.8426222E+00 Metallicity 0.4482627E+01 Ellipticity 0.3287421E-01 Gb(Abramov) 0.1774070E+00 Vb(Abramov) -0.2293290E+00 Hb(Abramov) -0.5192205E-01 Ex_ueg -0.4780887E-01 Ec_ueg -0.7071383E-02 Delta_ex -0.5188754E-01 Delta_ec 0.1321156E-01 Delta_et -0.1717224E+00 Pxc 0.6760895E+01 Qxc -0.3927435E+01 3,-1 160 3 -1 1.824069 -0.592627 -2.824355 Rho 0.1135531E+00 |GRAD(Rho)| 0.1224947E-14 GRAD(Rho)x 0.8061585E-15 GRAD(Rho)y 0.9024221E-15 GRAD(Rho)z 0.1903656E-15 Laplacian 0.4908849E+00 (-1/4)Del**2(Rho)) -0.1227212E+00 Diamond 0.7347828E+00 Metallicity 0.3737935E+01 Ellipticity 0.1364184E-01 Gb(Abramov) 0.1582681E+00 Vb(Abramov) -0.1938150E+00 Hb(Abramov) -0.3554691E-01 Ex_ueg -0.4061162E-01 Ec_ueg -0.6153122E-02 Delta_ex -0.4962260E-01 Delta_ec 0.1390097E-01 Delta_et -0.1778104E+00 Pxc 0.6600165E+01 Qxc -0.3569722E+01 3,-1 161 3 -1 1.732350 -0.516774 1.772134 Rho 0.4226134E-01 |GRAD(Rho)| 0.2165237E-15 GRAD(Rho)x 0.1822709E-15 GRAD(Rho)y 0.8596749E-16 GRAD(Rho)z 0.7917979E-16 Laplacian 0.1815821E+00 (-1/4)Del**2(Rho)) -0.4539552E-01 Diamond 0.7906375E-01 Metallicity 0.1945863E+01 Ellipticity 0.1736593E-01 Gb(Abramov) 0.4498593E-01 Vb(Abramov) -0.4457633E-01 Hb(Abramov) 0.4095943E-03 Ex_ueg -0.1087200E-01 Ec_ueg -0.1991801E-02 Delta_ex -0.1464477E-01 Delta_ec 0.5977910E-02 Delta_et -0.6038002E-01 Pxc 0.5458377E+01 Qxc -0.2449815E+01 3,-1 162 3 -1 1.750308 0.531174 -1.744537 Rho 0.4256347E-01 |GRAD(Rho)| 0.1668609E-13 GRAD(Rho)x 0.1121367E-13 GRAD(Rho)y -0.5537365E-14 GRAD(Rho)z -0.1104611E-13 Laplacian 0.1828639E+00 (-1/4)Del**2(Rho)) -0.4571597E-01 Diamond 0.8015082E-01 Metallicity 0.1955301E+01 Ellipticity 0.1340324E-01 Gb(Abramov) 0.4537539E-01 Vb(Abramov) -0.4503481E-01 Hb(Abramov) 0.3405783E-03 Ex_ueg -0.1097575E-01 Ec_ueg -0.2008133E-02 Delta_ex -0.1476067E-01 Delta_ec 0.5996490E-02 Delta_et -0.6068260E-01 Pxc 0.5465651E+01 Qxc -0.2461551E+01 3,-1 163 3 -1 1.850807 0.600588 2.862136 Rho 0.1352135E+00 |GRAD(Rho)| 0.1003604E-11 GRAD(Rho)x 0.7165039E-12 GRAD(Rho)y -0.6728758E-12 GRAD(Rho)z -0.2026872E-12 Laplacian 0.5699835E+00 (-1/4)Del**2(Rho)) -0.1424959E+00 Diamond 0.1042775E+01 Metallicity 0.4306434E+01 Ellipticity 0.1361677E-01 Gb(Abramov) 0.1972721E+00 Vb(Abramov) -0.2520483E+00 Hb(Abramov) -0.5477622E-01 Ex_ueg -0.5125606E-01 Ec_ueg -0.7503796E-02 Delta_ex -0.5994371E-01 Delta_ec 0.1530540E-01 Delta_et -0.2015767E+00 Pxc 0.6830685E+01 Qxc -0.3916508E+01 3,-1 164 3 -1 2.014265 0.875260 -3.043994 Rho 0.1164865E+00 |GRAD(Rho)| 0.2220936E-13 GRAD(Rho)x 0.1294639E-13 GRAD(Rho)y -0.1568939E-13 GRAD(Rho)z 0.8915699E-14 Laplacian 0.4783837E+00 (-1/4)Del**2(Rho)) -0.1195959E+00 Diamond 0.7352188E+00 Metallicity 0.4002177E+01 Ellipticity 0.1853378E-01 Gb(Abramov) 0.1595046E+00 Vb(Abramov) -0.1994133E+00 Hb(Abramov) -0.3990870E-01 Ex_ueg -0.4201645E-01 Ec_ueg -0.6334142E-02 Delta_ex -0.4860504E-01 Delta_ec 0.1339011E-01 Delta_et -0.1719804E+00 Pxc 0.6633328E+01 Qxc -0.3629921E+01 3,-1 165 3 +3 1.974643 1.934567 -1.974081 Rho 0.1200670E-01 |GRAD(Rho)| 0.2801314E-13 GRAD(Rho)x -0.1636675E-13 GRAD(Rho)y -0.1595254E-13 GRAD(Rho)z 0.1619820E-13 Laplacian 0.5402768E-01 (-1/4)Del**2(Rho)) -0.1350692E-01 Diamond 0.1318871E-02 Metallicity 0.8029768E+00 Ellipticity -0.8825832E+00 Gb(Abramov) 0.1081224E-01 Vb(Abramov) -0.8117554E-02 Hb(Abramov) 0.2694683E-02 Ex_ueg -0.2030564E-02 Ec_ueg -0.4598783E-03 Delta_ex -0.2411310E-02 Delta_ec 0.2642473E-03 Delta_et -0.2317432E-02 Pxc 0.4415437E+01 Qxc -0.9125204E+01 3,+3 166 3 -1 2.022921 -3.041342 0.834967 Rho 0.1555383E+00 |GRAD(Rho)| 0.1106303E-14 GRAD(Rho)x 0.2236167E-17 GRAD(Rho)y 0.7169964E-15 GRAD(Rho)z -0.8425064E-15 Laplacian 0.6098204E+00 (-1/4)Del**2(Rho)) -0.1524551E+00 Diamond 0.1285145E+01 Metallicity 0.5083237E+01 Ellipticity 0.3140025E-01 Gb(Abramov) 0.2307976E+00 Vb(Abramov) -0.3091402E+00 Hb(Abramov) -0.7834253E-01 Ex_ueg -0.6177817E-01 Ec_ueg -0.8798986E-02 Delta_ex -0.6602295E-01 Delta_ec 0.1523718E-01 Delta_et -0.2036061E+00 Pxc 0.7021056E+01 Qxc -0.4333017E+01 3,-1 167 3 -1 2.837818 1.825813 0.558664 Rho 0.1604903E+00 |GRAD(Rho)| 0.2059119E-15 GRAD(Rho)x -0.1263638E-15 GRAD(Rho)y 0.2696953E-16 GRAD(Rho)z -0.1603264E-15 Laplacian 0.6546943E+00 (-1/4)Del**2(Rho)) -0.1636736E+00 Diamond 0.1428563E+01 Metallicity 0.4988722E+01 Ellipticity 0.1146823E-01 Gb(Abramov) 0.2452027E+00 Vb(Abramov) -0.3267318E+00 Hb(Abramov) -0.8152913E-01 Ex_ueg -0.6441448E-01 Ec_ueg -0.9118392E-02 Delta_ex -0.7139686E-01 Delta_ec 0.1616299E-01 Delta_et -0.2166782E+00 Pxc 0.7064236E+01 Qxc -0.4417304E+01 3,-1 168 3 +1 2.991517 -0.165412 0.147420 Rho 0.5083399E-02 |GRAD(Rho)| 0.1110656E-16 GRAD(Rho)x 0.7526053E-18 GRAD(Rho)y -0.4930809E-17 GRAD(Rho)z 0.9923531E-17 Laplacian 0.2020369E-01 (-1/4)Del**2(Rho)) -0.5050922E-02 Diamond 0.4578785E-03 Metallicity 0.5125933E+00 Ellipticity -0.2727689E+01 Gb(Abramov) 0.3798793E-02 Vb(Abramov) -0.2546664E-02 Hb(Abramov) 0.1252129E-02 Ex_ueg -0.6455413E-03 Ec_ueg -0.1505036E-03 Delta_ex -0.9860425E-03 Delta_ec 0.5974917E-03 Delta_et -0.3276659E-02 Pxc 0.4289209E+01 Qxc -0.1650303E+01 3,+1 169 3 -1 2.813918 -1.851559 -0.558905 Rho 0.1463459E+00 |GRAD(Rho)| 0.1785637E-15 GRAD(Rho)x -0.1325573E-15 GRAD(Rho)y -0.4199928E-16 GRAD(Rho)z 0.1120252E-15 Laplacian 0.6064949E+00 (-1/4)Del**2(Rho)) -0.1516237E+00 Diamond 0.1187748E+01 Metallicity 0.4617641E+01 Ellipticity 0.1266224E-01 Gb(Abramov) 0.2177731E+00 Vb(Abramov) -0.2839226E+00 Hb(Abramov) -0.6614942E-01 Ex_ueg -0.5695857E-01 Ec_ueg -0.8210010E-02 Delta_ex -0.6468282E-01 Delta_ec 0.1538241E-01 Delta_et -0.2038359E+00 Pxc 0.6937698E+01 Qxc -0.4204985E+01 3,-1 170 3 -1 3.047629 -2.036680 0.843628 Rho 0.1612050E+00 |GRAD(Rho)| 0.2299482E-12 GRAD(Rho)x -0.8792763E-13 GRAD(Rho)y -0.1353427E-12 GRAD(Rho)z -0.1637903E-12 Laplacian 0.6225015E+00 (-1/4)Del**2(Rho)) -0.1556254E+00 Diamond 0.1374053E+01 Metallicity 0.5285711E+01 Ellipticity 0.3280335E-01 Gb(Abramov) 0.2408487E+00 Vb(Abramov) -0.3260720E+00 Hb(Abramov) -0.8522333E-01 Ex_ueg -0.6479720E-01 Ec_ueg -0.9164608E-02 Delta_ex -0.6803776E-01 Delta_ec 0.1548763E-01 Delta_et -0.2080924E+00 Pxc 0.7070373E+01 Qxc -0.4393039E+01 3,-1 171 3 -1 3.234661 3.233842 0.070293 Rho 0.2304666E+00 |GRAD(Rho)| 0.9792531E-12 GRAD(Rho)x -0.6664097E-12 GRAD(Rho)y -0.6969668E-12 GRAD(Rho)z -0.1705048E-12 Laplacian 0.8447016E+00 (-1/4)Del**2(Rho)) -0.2111754E+00 Diamond 0.2846663E+01 Metallicity 0.7067347E+01 Ellipticity 0.2250144E-02 Gb(Abramov) 0.3895252E+00 Vb(Abramov) -0.5678751E+00 Hb(Abramov) -0.1783498E+00 Ex_ueg -0.1043588E+00 Ec_ueg -0.1378258E-01 Delta_ex -0.1009929E+00 Delta_ec 0.1889789E-01 Delta_et -0.2614105E+00 Pxc 0.7571786E+01 Qxc -0.5344134E+01 3,-1 172 3 -1 3.035097 -0.882933 2.006110 Rho 0.1005232E+00 |GRAD(Rho)| 0.1058860E-10 GRAD(Rho)x 0.8061126E-11 GRAD(Rho)y -0.5053435E-11 GRAD(Rho)z -0.4647527E-11 Laplacian 0.4175667E+00 (-1/4)Del**2(Rho)) -0.1043917E+00 Diamond 0.5390001E+00 Metallicity 0.3586450E+01 Ellipticity 0.6627729E-02 Gb(Abramov) 0.1319937E+00 Vb(Abramov) -0.1595957E+00 Hb(Abramov) -0.2760203E-01 Ex_ueg -0.3452024E-01 Ec_ueg -0.5356760E-02 Delta_ex -0.4102077E-01 Delta_ec 0.1212726E-01 Delta_et -0.1514137E+00 Pxc 0.6444238E+01 Qxc -0.3382526E+01 3,-1 173 3 -1 2.816724 -0.595657 -1.823952 Rho 0.1207765E+00 |GRAD(Rho)| 0.7787390E-15 GRAD(Rho)x -0.5690774E-15 GRAD(Rho)y 0.2154852E-16 GRAD(Rho)z -0.5311506E-15 Laplacian 0.5214986E+00 (-1/4)Del**2(Rho)) -0.1303747E+00 Diamond 0.8397203E+00 Metallicity 0.3899397E+01 Ellipticity 0.1246184E-01 Gb(Abramov) 0.1716469E+00 Vb(Abramov) -0.2129191E+00 Hb(Abramov) -0.4127220E-01 Ex_ueg -0.4409219E-01 Ec_ueg -0.6599973E-02 Delta_ex -0.5347456E-01 Delta_ec 0.1453851E-01 Delta_et -0.1880683E+00 Pxc 0.6680662E+01 Qxc -0.3678134E+01 3,-1 174 3 -1 3.262319 -0.066703 -3.250918 Rho 0.2087582E+00 |GRAD(Rho)| 0.2070800E-09 GRAD(Rho)x 0.1441884E-09 GRAD(Rho)y -0.3737135E-10 GRAD(Rho)z -0.1438582E-09 Laplacian 0.7870938E+00 (-1/4)Del**2(Rho)) -0.1967735E+00 Diamond 0.2353424E+01 Metallicity 0.6431704E+01 Ellipticity 0.2104741E-02 Gb(Abramov) 0.3421137E+00 Vb(Abramov) -0.4874540E+00 Hb(Abramov) -0.1453403E+00 Ex_ueg -0.9146253E-01 Ec_ueg -0.1230626E-01 Delta_ex -0.9171997E-01 Delta_ec 0.1809443E-01 Delta_et -0.2488136E+00 Pxc 0.7432197E+01 Qxc -0.5068961E+01 3,-1 175 3 -1 3.276601 0.054137 3.258126 Rho 0.2074767E+00 |GRAD(Rho)| 0.6702055E-15 GRAD(Rho)x -0.4082021E-15 GRAD(Rho)y -0.1668181E-15 GRAD(Rho)z -0.5046961E-15 Laplacian 0.7813802E+00 (-1/4)Del**2(Rho)) -0.1953450E+00 Diamond 0.2320592E+01 Metallicity 0.6412582E+01 Ellipticity 0.2539713E-02 Gb(Abramov) 0.3390077E+00 Vb(Abramov) -0.4826704E+00 Hb(Abramov) -0.1436627E+00 Ex_ueg -0.9071466E-01 Ec_ueg -0.1221992E-01 Delta_ex -0.9091985E-01 Delta_ec 0.1801107E-01 Delta_et -0.2476235E+00 Pxc 0.7423509E+01 Qxc -0.5047999E+01 3,-1 176 3 -1 3.045085 0.875960 -2.008621 Rho 0.1219008E+00 |GRAD(Rho)| 0.9403907E-16 GRAD(Rho)x -0.7533850E-16 GRAD(Rho)y -0.5216368E-16 GRAD(Rho)z 0.2112839E-16 Laplacian 0.4974702E+00 (-1/4)Del**2(Rho)) -0.1243675E+00 Diamond 0.8061488E+00 Metallicity 0.4151361E+01 Ellipticity 0.2389781E-01 Gb(Abramov) 0.1689608E+00 Vb(Abramov) -0.2135540E+00 Hb(Abramov) -0.4459324E-01 Ex_ueg -0.4464031E-01 Ec_ueg -0.6669854E-02 Delta_ex -0.5107197E-01 Delta_ec 0.1374871E-01 Delta_et -0.1780032E+00 Pxc 0.6692847E+01 Qxc -0.3714673E+01 3,-1 177 3 -1 2.830472 0.580694 1.826288 Rho 0.1047232E+00 |GRAD(Rho)| 0.1645307E-15 GRAD(Rho)x 0.1035718E-15 GRAD(Rho)y 0.1264451E-15 GRAD(Rho)z -0.1883801E-16 Laplacian 0.4535025E+00 (-1/4)Del**2(Rho)) -0.1133756E+00 Diamond 0.6178533E+00 Metallicity 0.3535396E+01 Ellipticity 0.1630357E-01 Gb(Abramov) 0.1423884E+00 Vb(Abramov) -0.1714011E+00 Hb(Abramov) -0.2901274E-01 Ex_ueg -0.3645654E-01 Ec_ueg -0.5612042E-02 Delta_ex -0.4502051E-01 Delta_ec 0.1313558E-01 Delta_et -0.1654678E+00 Pxc 0.6496127E+01 Qxc -0.3427371E+01 3,-1 178 3 -1 -4.252374 3.821725 -0.878468 Rho 0.3373691E+00 |GRAD(Rho)| 0.3498666E-12 GRAD(Rho)x 0.1968726E-12 GRAD(Rho)y 0.5321690E-13 GRAD(Rho)z 0.2842812E-12 Laplacian -0.1710921E+01 (-1/4)Del**2(Rho)) 0.4277302E+00 Diamond 0.6280691E+01 Metallicity -0.6585044E+01 Ellipticity 0.2155607E-03 Gb(Abramov) 0.1842836E+00 Vb(Abramov) -0.7962975E+00 Hb(Abramov) -0.6120139E+00 Ex_ueg -0.1734571E+00 Ec_ueg -0.2143077E-01 Delta_ex 0.1742498E+00 Delta_ec 0.5915502E-01 Delta_et -0.1436996E+01 Pxc 0.8093833E+01 Qxc 0.2945647E+01 3,-1 179 3 -1 -3.232966 0.053489 -3.287844 Rho 0.2094027E+00 |GRAD(Rho)| 0.2935931E-14 GRAD(Rho)x 0.2583654E-14 GRAD(Rho)y 0.6001872E-15 GRAD(Rho)z 0.1258650E-14 Laplacian 0.7899497E+00 (-1/4)Del**2(Rho)) -0.1974874E+00 Diamond 0.2371662E+01 Metallicity 0.6441457E+01 Ellipticity 0.1957082E-02 Gb(Abramov) 0.3436761E+00 Vb(Abramov) -0.4898648E+00 Hb(Abramov) -0.1461887E+00 Ex_ueg -0.9183920E-01 Ec_ueg -0.1234971E-01 Delta_ex -0.9213165E-01 Delta_ec 0.1815505E-01 Delta_et -0.2497392E+00 Pxc 0.7436547E+01 Qxc -0.5074711E+01 3,-1 180 3 -1 -3.286893 -0.048622 3.297568 Rho 0.2084757E+00 |GRAD(Rho)| 0.3706709E-15 GRAD(Rho)x 0.2912167E-15 GRAD(Rho)y -0.3889575E-16 GRAD(Rho)z 0.2260019E-15 Laplacian 0.7799362E+00 (-1/4)Del**2(Rho)) -0.1949840E+00 Diamond 0.2333782E+01 Metallicity 0.6476094E+01 Ellipticity 0.2739882E-02 Gb(Abramov) 0.3404452E+00 Vb(Abramov) -0.4859063E+00 Hb(Abramov) -0.1454611E+00 Ex_ueg -0.9129751E-01 Ec_ueg -0.1228721E-01 Delta_ex -0.9088994E-01 Delta_ec 0.1800034E-01 Delta_et -0.2477310E+00 Pxc 0.7430286E+01 Qxc -0.5049345E+01 3,-1 181 3 -1 -3.020128 -0.878893 -2.032594 Rho 0.1188811E+00 |GRAD(Rho)| 0.5462520E-15 GRAD(Rho)x 0.1419221E-15 GRAD(Rho)y 0.5263530E-15 GRAD(Rho)z -0.3466736E-16 Laplacian 0.4840457E+00 (-1/4)Del**2(Rho)) -0.1210114E+00 Diamond 0.7628176E+00 Metallicity 0.4091801E+01 Ellipticity 0.1828263E-01 Gb(Abramov) 0.1632001E+00 Vb(Abramov) -0.2053887E+00 Hb(Abramov) -0.4218865E-01 Ex_ueg -0.4317198E-01 Ec_ueg -0.6482361E-02 Delta_ex -0.4942315E-01 Delta_ec 0.1349707E-01 Delta_et -0.1740217E+00 Pxc 0.6659915E+01 Qxc -0.3661770E+01 3,-1 182 3 -1 -2.819304 0.594173 -1.862761 Rho 0.1261690E+00 |GRAD(Rho)| 0.2106907E-15 GRAD(Rho)x -0.4459459E-16 GRAD(Rho)y -0.1362707E-15 GRAD(Rho)z -0.1543768E-15 Laplacian 0.5296814E+00 (-1/4)Del**2(Rho)) -0.1324203E+00 Diamond 0.8986734E+00 Metallicity 0.4129077E+01 Ellipticity 0.6311494E-02 Gb(Abramov) 0.1794092E+00 Vb(Abramov) -0.2263981E+00 Hb(Abramov) -0.4698886E-01 Ex_ueg -0.4673641E-01 Ec_ueg -0.6935931E-02 Delta_ex -0.5487649E-01 Delta_ec 0.1461374E-01 Delta_et -0.1905110E+00 Pxc 0.6738304E+01 Qxc -0.3755131E+01 3,-1 183 3 -1 -2.008368 -2.992415 -0.850521 Rho 0.1229964E+00 |GRAD(Rho)| 0.1579613E-11 GRAD(Rho)x -0.1148305E-11 GRAD(Rho)y -0.6468879E-12 GRAD(Rho)z 0.8706952E-12 Laplacian 0.4795508E+00 (-1/4)Del**2(Rho)) -0.1198877E+00 Diamond 0.7657541E+00 Metallicity 0.4371187E+01 Ellipticity 0.2541838E-01 Gb(Abramov) 0.1672670E+00 Vb(Abramov) -0.2146464E+00 Hb(Abramov) -0.4737935E-01 Ex_ueg -0.4517606E-01 Ec_ueg -0.6738034E-02 Delta_ex -0.4908043E-01 Delta_ec 0.1276816E-01 Delta_et -0.1648156E+00 Pxc 0.6704635E+01 Qxc -0.3843971E+01 3,-1 184 3 -1 0.077910 -3.257265 -3.199246 Rho 0.2316205E+00 |GRAD(Rho)| 0.7460152E-15 GRAD(Rho)x -0.7684283E-16 GRAD(Rho)y 0.3511189E-15 GRAD(Rho)z 0.6537197E-15 Laplacian 0.8492825E+00 (-1/4)Del**2(Rho)) -0.2123206E+00 Diamond 0.2879135E+01 Metallicity 0.7087982E+01 Ellipticity 0.1279079E-02 Gb(Abramov) 0.3923679E+00 Vb(Abramov) -0.5724151E+00 Hb(Abramov) -0.1800472E+00 Ex_ueg -0.1050560E+00 Ec_ueg -0.1386179E-01 Delta_ex -0.1016713E+00 Delta_ec 0.1897060E-01 Delta_et -0.2624654E+00 Pxc 0.7578825E+01 Qxc -0.5359413E+01 3,-1 185 3 -1 3.039203 2.017925 -0.847175 Rho 0.1385521E+00 |GRAD(Rho)| 0.1426635E-15 GRAD(Rho)x 0.1572093E-17 GRAD(Rho)y 0.8600434E-16 GRAD(Rho)z 0.1138141E-15 Laplacian 0.5407241E+00 (-1/4)Del**2(Rho)) -0.1351810E+00 Diamond 0.9922904E+00 Metallicity 0.4727804E+01 Ellipticity 0.2045952E-01 Gb(Abramov) 0.1966389E+00 Vb(Abramov) -0.2580968E+00 Hb(Abramov) -0.6145788E-01 Ex_ueg -0.5295041E-01 Ec_ueg -0.7714762E-02 Delta_ex -0.5691003E-01 Delta_ec 0.1391403E-01 Delta_et -0.1829368E+00 Pxc 0.6863518E+01 Qxc -0.4090117E+01 3,-1 186 3 -1 3.228939 -3.250550 -0.078856 Rho 0.2313757E+00 |GRAD(Rho)| 0.1123271E-11 GRAD(Rho)x -0.7574256E-12 GRAD(Rho)y 0.7918196E-12 GRAD(Rho)z 0.2471142E-12 Laplacian 0.8437325E+00 (-1/4)Del**2(Rho)) -0.2109331E+00 Diamond 0.2859815E+01 Metallicity 0.7122045E+01 Ellipticity 0.2212357E-02 Gb(Abramov) 0.3910013E+00 Vb(Abramov) -0.5710694E+00 Hb(Abramov) -0.1800681E+00 Ex_ueg -0.1049080E+00 Ec_ueg -0.1384498E-01 Delta_ex -0.1009966E+00 Delta_ec 0.1888369E-01 Delta_et -0.2613825E+00 Pxc 0.7577335E+01 Qxc -0.5348351E+01 3,-1 187 3 -1 1.818949 -2.795166 -0.554139 Rho 0.1275518E+00 |GRAD(Rho)| 0.1896328E-15 GRAD(Rho)x -0.1856832E-15 GRAD(Rho)y -0.3099802E-16 GRAD(Rho)z -0.2283601E-16 Laplacian 0.5285292E+00 (-1/4)Del**2(Rho)) -0.1321323E+00 Diamond 0.8807338E+00 Metallicity 0.4213941E+01 Ellipticity 0.1180219E-01 Gb(Abramov) 0.1808878E+00 Vb(Abramov) -0.2296433E+00 Hb(Abramov) -0.4875551E-01 Ex_ueg -0.4742061E-01 Ec_ueg -0.7022397E-02 Delta_ex -0.5455551E-01 Delta_ec 0.1393106E-01 Delta_et -0.1808912E+00 Pxc 0.6752766E+01 Qxc -0.3916106E+01 3,-1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 151 116 79 152 143 129 115 149 144 113 107 184 139 127 118 147 148 133 124 146 81 109 120 134 157 169 187 170 166 186 155 167 158 185 159 171 93 72 99 73 101 74 98 76 94 71 183 70 86 182 89 181 84 179 68 85 83 69 92 180 161 177 163 172 145 175 162 173 160 176 164 174 138 112 140 125 122 132 128 178 1 1 1 1 1 1 2 2 2 2 2 2 3 3 3 3 3 3 4 4 4 4 4 4 5 5 5 5 5 5 6 6 6 6 6 6 7 7 7 7 7 7 8 8 8 8 8 8 9 9 9 9 9 9 10 10 10 10 10 10 11 11 11 11 11 11 12 12 12 12 12 12 13 14 15 16 21 25 26 47 13 24 26 33 39 41 14 21 28 36 37 42 15 23 25 34 40 43 16 22 27 35 38 44 13 18 28 29 39 45 15 20 27 31 40 46 16 19 25 32 38 47 14 17 26 30 37 48 14 19 23 30 36 49 16 17 24 32 35 50 13 20 22 29 33 51 15 18 21 31 34 52 53 53 53 53 23 27 28 54 2.440430 1.962359 2.038659 1.986629 2.054790 1.799855 2.415816 1.910303 1.936424 1.923800 1.948004 1.756855 2.410525 1.912959 1.908252 1.937321 1.964099 1.757242 2.477041 1.983008 2.050435 1.987539 2.025810 1.797649 2.452096 1.925943 1.978678 1.897548 1.911265 1.757413 2.416837 1.890674 1.895110 1.958144 1.987742 1.758830 2.299438 1.955203 2.022842 1.937879 1.950319 1.966715 2.420055 1.882265 1.897028 1.949891 2.005046 1.758754 2.425813 1.982219 2.017373 2.011813 2.035619 1.795571 2.469351 2.070529 1.971394 2.030176 1.980017 1.797622 2.424851 2.049518 1.953127 2.075760 1.982108 1.799311 2.423243 1.993896 2.017956 2.001659 2.018909 1.796843 1.700414 1.706158 1.706116 1.712964 3.311808 3.249107 3.252059 0.976077 2.442422 1.962538 2.038866 1.986922 2.055077 1.799861 2.417412 1.910649 1.936890 1.924273 1.948584 1.756865 2.412205 1.913290 1.908592 1.937835 1.964654 1.757249 2.478753 1.983174 2.050637 1.987844 2.025975 1.797655 2.453691 1.926312 1.979075 1.897969 1.911761 1.757422 2.418318 1.890969 1.895426 1.958661 1.988283 1.758841 2.301289 1.955468 2.023146 1.938224 1.950660 1.967917 2.421568 1.882555 1.897344 1.950421 2.005589 1.758767 2.427883 1.982345 2.017676 2.012154 2.035908 1.795578 2.471175 2.070725 1.971576 2.030361 1.980316 1.797627 2.426907 2.049716 1.953314 2.076060 1.982404 1.799316 2.425306 1.994180 2.018246 2.001993 2.019243 1.796847 1.700420 1.706159 1.706119 1.712980 3.315948 3.253010 3.257697 0.976203 27 27 27 26 26 24 30 27 27 27 27 21 31 28 27 26 28 23 32 26 24 27 27 27 27 25 24 26 25 21 27 26 27 24 23 24 28 26 28 25 27 25 30 28 29 26 24 24 27 25 25 24 27 23 29 29 25 25 27 22 27 24 25 25 28 23 27 25 25 25 24 22 24 23 22 24 35 35 35 17 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 Ta W W Ta W W Ta W Ta Ta Ta 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 O As H 2.1952 2.4254 2.4278 2.1746 2.4157 2.4215 2.3785 2.4224 2.2113 2.1838 2.1942 2.2095 -1.1084 -1.1170 -1.1177 -1.1190 -0.9766 -0.9912 -1.0108 -0.9807 -0.9845 -1.0201 -0.9883 -1.0213 -0.9769 -0.9818 -0.9798 -0.9748 -1.0013 -1.0184 -1.0189 -1.0307 -1.0445 -1.0136 -1.0442 -1.0092 -0.9998 -1.0340 -1.0076 -1.0020 -0.9604 -0.8579 -0.8612 -0.9578 -0.8616 -0.8653 -0.8338 -0.8649 -0.9490 -0.9570 -0.9582 -0.9505 2.5134 0.2776 2.1131 2.1049 2.1044 2.1233 2.1103 2.1074 2.1020 2.1076 2.1067 2.1184 2.1138 2.1054 1.9388 1.9373 1.9370 1.9355 1.9293 1.9265 1.9263 1.9287 1.9274 1.9222 1.9271 1.9221 1.9288 1.9283 1.9283 1.9281 1.9359 1.9333 1.9331 1.9297 1.9287 1.9342 1.9280 1.9346 1.9357 1.9304 1.9347 1.9355 1.9387 1.9557 1.9555 1.9395 1.9555 1.9550 1.8713 1.9552 1.9403 1.9396 1.9390 1.9397 0.8349 0.6117 6.0828 6.1001 6.1005 6.0903 6.1040 6.1028 6.0769 6.1026 6.0788 6.0863 6.0828 6.0769 5.1329 5.1420 5.1428 5.1472 5.0202 5.0381 5.0600 5.0249 5.0303 5.0738 5.0345 5.0751 5.0212 5.0265 5.0247 5.0186 5.0374 5.0580 5.0586 5.0751 5.0905 5.0518 5.0909 5.0467 5.0353 5.0784 5.0452 5.0377 4.9961 4.8699 4.8735 4.9924 4.8739 4.8783 4.9342 4.8777 4.9826 4.9916 4.9936 4.9847 1.1119 0.1107 2.5745 3.3399 3.3377 2.5777 3.3404 3.3387 2.4056 3.3379 2.5690 2.5774 2.5750 2.5738 0.0367 0.0377 0.0379 0.0363 0.0271 0.0266 0.0244 0.0271 0.0268 0.0241 0.0267 0.0241 0.0269 0.0271 0.0268 0.0282 0.0281 0.0271 0.0272 0.0259 0.0254 0.0277 0.0253 0.0279 0.0288 0.0253 0.0277 0.0287 0.0256 0.0323 0.0322 0.0258 0.0322 0.0320 0.0283 0.0320 0.0262 0.0258 0.0257 0.0260 10.5399 0.0000 14.0343 14.0296 14.0296 14.0341 14.0296 14.0296 14.0370 14.0295 14.0342 14.0341 14.0342 14.0345 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 Ta W W Ta W W Ta W Ta Ta Ta 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 O As H 2.359327 2.497900 2.496409 2.354569 2.495333 2.493230 2.420732 2.492749 2.362618 2.354536 2.359353 2.363791 -1.094215 -1.094177 -1.093537 -1.096730 -1.011231 -1.018632 -1.032930 -1.012712 -1.014215 -1.056805 -1.018639 -1.057708 -1.009370 -1.013163 -1.013940 -0.998777 -1.011423 -1.023839 -1.024914 -1.048289 -1.058909 -1.019396 -1.063633 -1.015808 -1.000137 -1.046727 -1.016986 -1.002247 -1.051958 -0.908456 -0.911065 -1.048877 -0.912721 -0.917182 -0.646077 -0.916624 -1.034991 -1.047822 -1.049134 -1.038547 2.317916 0.084083 1.836997 1.925825 1.925014 1.837185 1.928910 1.924083 1.744021 1.924433 1.837670 1.837572 1.840266 1.839121 -0.716525 -0.715600 -0.712556 -0.704605 -0.782773 -0.771915 -0.753200 -0.778086 -0.778103 -0.813423 -0.782471 -0.811133 -0.740189 -0.772600 -0.775409 -0.740726 -0.858579 -0.867069 -0.865711 -0.871218 -0.902860 -0.864276 -0.904886 -0.862616 -0.835130 -0.865351 -0.860596 -0.835076 -0.999336 -0.830726 -0.832548 -0.995650 -0.834344 -0.840764 -0.864195 -0.839587 -0.976536 -0.994298 -0.995412 -0.981591 1.741702 0.384868 1.961629 2.040905 2.041047 1.960865 2.042023 2.040908 1.932152 2.041286 1.958388 1.964399 1.964797 1.960338 -0.797374 -0.793041 -0.792652 -0.789621 -0.858090 -0.859337 -0.872513 -0.854162 -0.859238 -0.907041 -0.860482 -0.905907 -0.840312 -0.850498 -0.855421 -0.827238 -0.883577 -0.907746 -0.902436 -0.912570 -0.945961 -0.894971 -0.950520 -0.890564 -0.871163 -0.906523 -0.889511 -0.874878 -0.971708 -0.795028 -0.795740 -0.967381 -0.799918 -0.803536 -0.849923 -0.802246 -0.949761 -0.964514 -0.967355 -0.955811 1.668319 0.399211 -5.59921080 3.94590958 -10.23224526 12.31341574 14.59367320 -25.43603315 10.90319584 25.57929469 -8.21969298 -40.17296790 -383.7070 434.3678 -2.5066 -443.1124 -95.5555 -490.5138 Jun21-2024 16:27:37 Nodes: 1 Procs: 1 Jun21-2024 16:27:42 Nodes: 1 Procs: 1 0 Jun21-2024 16:27:53 Nodes: 1 Procs: 1 Jun21-2024 16:27:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun21-2024 16:27:58 Nodes: 1 Procs: 1 Jun21-2024 16:28:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun21-2024 16:28:05 Nodes: 1 Procs: 1 Jun21-2024 16:28:07 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun21-2024 16:28:09 Nodes: 1 Procs: 1 Jun21-2024 16:28:12 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Jun21-2024 16:28:17 Nodes: 1 Procs: 5 *** (NO TITLE) *** -9 -17.62814055 -17.90737698 -17.92642724 -18.00881300 -18.01666953 -18.02069841 -18.02216341 -18.02309608 -18.02517753 -18.02531843 -18.02569686 -18.02580894 -18.02594941 -18.02599874 -18.02601813 -18.02602438 -18.02603429 -18.02604258 -18.02605248 GEOMETRY CONVERGED