ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:18:48 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.70 0.04 1.46 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 Jun19-2024 22:18:48 Nodes: 1 Procs: 1 Jun19-2024 22:18:50 Nodes: 1 Procs: 1 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:18:53 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.37 0.05 1.93 1 2 3 1 2 3 1 2 3 4 2.000 0.000 0.000 3.000 0.000 0.000 10.000 0.000 0.000 0.000 -14.453 3.868 46.848 -5.206 2.716 28.135 -40.711 6.242 57.060 417.392 S S S P P P D D D D D S P P S D P S D D 1 1 1 2 2 2 3 3 3 4 10.00 2.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -40.7110 -14.4532 -5.2063 2.7160 3.8682 6.2422 28.1350 46.8475 57.0600 417.3918 1 As 0.0000 2.0000 3.0000 10.0000 0.0000 Jun19-2024 22:18:48 Nodes: 1 Procs: 1 Jun19-2024 22:18:50 Nodes: 1 Procs: 1 0 Jun19-2024 22:18:53 Nodes: 1 Procs: 1 Jun19-2024 22:18:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:18:58 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.44 0.09 3.55 1 2 3 4 5 6 1 2 3 4 1 2 3 1 2 3 2.000 2.000 0.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 3.000 0.000 0.000 14.000 0.000 0.000 -72.755 -5.438 1.149 14.442 84.369 82466.595 -39.462 -0.588 19.371 119.253 -3.592 3.193 26.757 -25.167 53.137 407.274 S S S S S S P P P P D D D F F F S P F S D P S D S P D F S P F S 1 1 1 2 1 2 3 2 4 3 3 2 5 4 3 6 2.00 6.00 14.00 2.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -72.7547 -39.4619 -25.1674 -5.4383 -3.5916 -0.5880 1.1490 3.1925 14.4417 19.3711 26.7574 53.1371 84.3692 119.2525 407.2740 82466.5951 1 Ta -0.0000 4.0000 6.0000 3.0000 14.0000 Jun19-2024 22:18:48 Nodes: 1 Procs: 1 Jun19-2024 22:18:50 Nodes: 1 Procs: 1 0 Jun19-2024 22:18:53 Nodes: 1 Procs: 1 Jun19-2024 22:18:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun19-2024 22:18:58 Nodes: 1 Procs: 1 Jun19-2024 22:19:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:19:05 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.91 0.04 1.55 1 2 3 1 2 3 1 2.000 0.000 0.000 4.000 0.000 0.000 0.000 -24.020 24.654 804.880 -9.089 9.585 104.336 29.005 S S S P P P D S P P S D P S 1 1 2 2 1 3 3 2.00 4.00 0.00 0.00 0.00 0.00 0.00 -24.0201 -9.0888 9.5852 24.6539 29.0045 104.3364 804.8804 1 O -0.0000 2.0000 4.0000 0.0000 0.0000 Jun19-2024 22:18:48 Nodes: 1 Procs: 1 Jun19-2024 22:18:50 Nodes: 1 Procs: 1 0 Jun19-2024 22:18:53 Nodes: 1 Procs: 1 Jun19-2024 22:18:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun19-2024 22:18:58 Nodes: 1 Procs: 1 Jun19-2024 22:19:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun19-2024 22:19:05 Nodes: 1 Procs: 1 Jun19-2024 22:19:06 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:19:08 Hydrogen (TZP) c1-19 c1-19 c1-19 c1-19 c1-19 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.45 0.07 3.04 1 2 3 4 5 6 1 2 3 4 1 2 3 1 2 3 2.000 2.000 0.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 4.000 0.000 0.000 14.000 0.000 0.000 -78.652 -5.688 1.231 15.256 90.545 82874.614 -43.195 -0.500 20.662 126.921 -4.498 4.055 33.318 -33.668 62.370 473.510 S S S S S S P P P P D D D F F F S P F S D P S D S P D F S P F S 1 1 1 2 1 2 3 2 4 3 3 2 5 4 3 6 2.00 6.00 14.00 2.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -78.6522 -43.1946 -33.6680 -5.6882 -4.4976 -0.5002 1.2309 4.0549 15.2562 20.6620 33.3183 62.3697 90.5446 126.9207 473.5096 82874.6143 1 W -0.0000 4.0000 6.0000 4.0000 14.0000 Jun19-2024 22:18:48 Nodes: 1 Procs: 1 Jun19-2024 22:18:50 Nodes: 1 Procs: 1 0 Jun19-2024 22:18:53 Nodes: 1 Procs: 1 Jun19-2024 22:18:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun19-2024 22:18:58 Nodes: 1 Procs: 1 Jun19-2024 22:19:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun19-2024 22:19:05 Nodes: 1 Procs: 1 Jun19-2024 22:19:06 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun19-2024 22:19:08 Nodes: 1 Procs: 1 Jun19-2024 22:19:11 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun19-2024 22:19:16 Hydrogen (TZP) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP TZP 2709.5698000000057 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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.W ADF 2019.304 Jun19-2024 22:19:11 1 1 Tungsten TZP 4d t21.As ADF 2019.304 Jun19-2024 22:18:55 1 1 Arsenic TZP 3p t21.Ta ADF 2019.304 Jun19-2024 22:19:01 1 1 Tantalum TZP 4d t21.O ADF 2019.304 Jun19-2024 22:19:06 1 1 Oxygen TZP 1s t21.H ADF 2019.304 Jun19-2024 22:18:50 1 1 Hydrogen TZP 1 1 -16.83255875 0.22976327 0.00100000 F 0.09155293 0.00066667 F 0.22976327 0.09155293 0.29957843 0.01000000 F 0.06800697 0.00666667 F Cartesian 2709.5698000000057 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0.3190341E+03 3,-3 14 3 -3 -1.111251 -0.947174 -0.971709 Rho 0.3190372E+03 3,-3 15 3 -3 0.964803 0.941799 -0.993389 Rho 0.3190253E+03 3,-3 16 3 -3 -0.994050 0.992655 1.010324 Rho 0.3189856E+03 3,-3 17 3 -3 -3.048178 -1.132760 1.167318 Rho 0.3188782E+03 3,-3 18 3 -3 3.208345 -1.237229 -1.194923 Rho 0.3187986E+03 3,-3 19 3 -3 -3.076527 1.102165 -1.091052 Rho 0.3188827E+03 3,-3 20 3 -3 3.095450 1.177984 1.253779 Rho 0.3188350E+03 3,-3 21 3 -3 1.354685 -1.276327 -3.187434 Rho 0.3186575E+03 3,-3 22 3 -3 1.169288 1.110285 3.067141 Rho 0.3188373E+03 3,-3 23 3 -3 -1.215308 1.083800 -2.997915 Rho 0.3188744E+03 3,-3 24 3 -3 -1.214463 -1.134138 3.034436 Rho 0.3188730E+03 3,-3 25 3 -3 -1.199448 2.917663 -1.150555 Rho 0.3188655E+03 3,-3 26 3 -3 -1.196002 -2.970563 1.201549 Rho 0.3188566E+03 3,-3 27 3 -3 1.160887 3.094808 1.180990 Rho 0.3188283E+03 3,-3 28 3 -3 1.114799 -3.138325 -1.198432 Rho 0.3189764E+03 3,-3 29 3 -3 3.370274 -1.533943 1.611402 Rho 0.3189766E+03 3,-3 30 3 -3 -3.494578 -1.553791 -1.483832 Rho 0.3189358E+03 3,-3 31 3 -3 3.470580 1.574714 -1.534412 Rho 0.3188659E+03 3,-3 32 3 -3 -3.466510 1.504268 1.521423 Rho 0.3189274E+03 3,-3 33 3 -3 1.438625 -1.501293 3.474405 Rho 0.3189310E+03 3,-3 34 3 -3 1.455174 1.504325 -3.479513 Rho 0.3189525E+03 3,-3 35 3 -3 -1.618418 1.514395 3.480740 Rho 0.3189413E+03 3,-3 36 3 -3 -1.868529 -1.569263 -3.557900 Rho 0.3187129E+03 3,-3 37 3 -3 -1.491117 -3.494429 -1.394729 Rho 0.3187320E+03 3,-3 38 3 -3 -1.603293 3.461872 1.517014 Rho 0.3189401E+03 3,-3 39 3 -3 1.429943 -3.478922 1.617889 Rho 0.3189516E+03 3,-3 40 3 -3 1.430576 3.461020 -1.577189 Rho 0.3189233E+03 3,-3 41 3 -3 -0.278859 -3.722206 3.828638 Rho 0.3192546E+03 3,-3 42 3 -3 3.964078 -0.127548 -3.861169 Rho 0.3190914E+03 3,-3 43 3 -3 -0.295632 3.680545 -3.779289 Rho 0.3192581E+03 3,-3 44 3 -3 0.220586 3.796265 3.866566 Rho 0.3191084E+03 3,-3 45 3 -3 3.727339 -3.961293 -0.190591 Rho 0.3190736E+03 3,-3 46 3 -3 3.808500 3.881375 0.194239 Rho 0.3191137E+03 3,-3 47 3 -3 -3.781055 3.739020 -0.231640 Rho 0.3192584E+03 3,-3 48 3 -3 -3.796231 -3.719708 0.247047 Rho 0.3192601E+03 3,-3 49 3 -3 -3.872374 0.337304 -3.663485 Rho 0.3192638E+03 3,-3 50 3 -3 -3.818268 -0.222727 3.771983 Rho 0.3192558E+03 3,-3 51 3 -3 3.765747 0.154524 3.824321 Rho 0.3192366E+03 3,-3 52 3 -3 -1.510876 -2.264830 -2.949422 Rho 0.4508065E+00 3,-3 53 3 -3 -0.473152 -3.330386 -1.281432 Rho 0.4008361E+00 3,-3 54 3 -3 1.129648 -1.953407 -2.480045 Rho 0.4334169E+00 3,-3 55 3 -1 1.801508 0.475263 -1.752547 Rho 0.3311534E-01 |GRAD(Rho)| 0.3184533E-11 GRAD(Rho)x -0.2339000E-11 GRAD(Rho)y -0.1325142E-12 GRAD(Rho)z 0.2157028E-11 Laplacian 0.1383611E+00 (-1/4)Del**2(Rho)) -0.3459027E-01 Diamond 0.4280385E-01 Metallicity 0.1700779E+01 Ellipticity 0.3621032E-01 Gb(Abramov) 0.3286525E-01 Vb(Abramov) -0.3114023E-01 Hb(Abramov) 0.1725024E-02 Ex_ueg -0.7853996E-02 Ec_ueg -0.1505391E-02 Delta_ex -0.1048785E-01 Delta_ec 0.4499995E-02 Delta_et -0.4247728E-01 Pxc 0.5217245E+01 Qxc -0.2330635E+01 3,-1 56 3 +1 -2.283712 -1.150550 -1.279842 Rho 0.3117717E-01 |GRAD(Rho)| 0.2841675E-12 GRAD(Rho)x -0.2331258E-12 GRAD(Rho)y -0.1012134E-12 GRAD(Rho)z -0.1271195E-12 Laplacian 0.1291346E+00 (-1/4)Del**2(Rho)) -0.3228365E-01 Diamond 0.2366512E-01 Metallicity 0.1648030E+01 Ellipticity -0.5410247E+01 Gb(Abramov) 0.3038984E-01 Vb(Abramov) -0.2849602E-01 Hb(Abramov) 0.1893814E-02 Ex_ueg -0.7247152E-02 Ec_ueg -0.1404486E-02 Delta_ex -0.8585224E-02 Delta_ec 0.2302591E-02 Delta_et -0.2142486E-01 Pxc 0.5160004E+01 Qxc -0.3728506E+01 3,+1 57 3 +3 -2.352278 0.069797 0.111013 Rho 0.5188775E-02 |GRAD(Rho)| 0.3618943E-15 GRAD(Rho)x 0.2635120E-15 GRAD(Rho)y -0.1601733E-15 GRAD(Rho)z -0.1894027E-15 Laplacian 0.2169817E-01 (-1/4)Del**2(Rho)) -0.5424541E-02 Diamond 0.2098177E-03 Metallicity 0.4938915E+00 Ellipticity -0.3989135E+00 Gb(Abramov) 0.4062883E-02 Vb(Abramov) -0.2701225E-02 Hb(Abramov) 0.1361658E-02 Ex_ueg -0.6634449E-03 Ec_ueg -0.1550456E-03 Delta_ex -0.8019607E-03 Delta_ec 0.1751073E-03 Delta_et -0.1166190E-02 Pxc 0.4279031E+01 Qxc -0.4579824E+01 3,+3 58 3 -1 -1.802785 -1.689188 -0.511522 Rho 0.5617782E-01 |GRAD(Rho)| 0.8185622E-13 GRAD(Rho)x 0.2097984E-13 GRAD(Rho)y -0.6914868E-13 GRAD(Rho)z -0.3845449E-13 Laplacian 0.2263053E+00 (-1/4)Del**2(Rho)) -0.5657633E-01 Diamond 0.1336525E+00 Metallicity 0.2509150E+01 Ellipticity 0.1748872E-01 Gb(Abramov) 0.6137730E-01 Vb(Abramov) -0.6617827E-01 Hb(Abramov) -0.4800970E-02 Ex_ueg -0.1589053E-01 Ec_ueg -0.2759103E-02 Delta_ex -0.1915679E-01 Delta_ec 0.6687318E-02 Delta_et -0.7265396E-01 Pxc 0.5759308E+01 Qxc -0.2864645E+01 3,-1 59 3 -1 -1.834816 -2.740113 0.602456 Rho 0.1423428E+00 |GRAD(Rho)| 0.9869128E-14 GRAD(Rho)x 0.6539189E-14 GRAD(Rho)y -0.7383695E-14 GRAD(Rho)z 0.3460502E-15 Laplacian 0.5995892E+00 (-1/4)Del**2(Rho)) -0.1498973E+00 Diamond 0.1140394E+01 Metallicity 0.4459834E+01 Ellipticity 0.1230659E-01 Gb(Abramov) 0.2113511E+00 Vb(Abramov) -0.2728048E+00 Hb(Abramov) -0.6145375E-01 Ex_ueg -0.5489076E-01 Ec_ueg -0.7955162E-02 Delta_ex -0.6356310E-01 Delta_ec 0.1540010E-01 Delta_et -0.2034468E+00 Pxc 0.6900018E+01 Qxc -0.4127446E+01 3,-1 60 3 +1 -1.723559 -0.475019 0.587462 Rho 0.9263029E-02 |GRAD(Rho)| 0.4734760E-13 GRAD(Rho)x -0.2346156E-13 GRAD(Rho)y -0.4112359E-13 GRAD(Rho)z -0.4479966E-15 Laplacian 0.3605329E-01 (-1/4)Del**2(Rho)) -0.9013322E-02 Diamond 0.1042989E-02 Metallicity 0.7808902E+00 Ellipticity -0.1452497E+01 Gb(Abramov) 0.7181951E-02 Vb(Abramov) -0.5350579E-02 Hb(Abramov) 0.1831372E-02 Ex_ueg -0.1436776E-02 Ec_ueg -0.3347426E-03 Delta_ex -0.1668351E-02 Delta_ec 0.4893503E-03 Delta_et -0.3423266E-02 Pxc 0.4292182E+01 Qxc -0.3409318E+01 3,+1 61 3 -1 -3.044881 -1.991370 -0.827647 Rho 0.1459034E+00 |GRAD(Rho)| 0.4500615E-15 GRAD(Rho)x -0.2280484E-15 GRAD(Rho)y 0.2697088E-15 GRAD(Rho)z -0.2789381E-15 Laplacian 0.5762789E+00 (-1/4)Del**2(Rho)) -0.1440697E+00 Diamond 0.1128895E+01 Metallicity 0.4835293E+01 Ellipticity 0.6594191E-01 Gb(Abramov) 0.2121497E+00 Vb(Abramov) -0.2802297E+00 Hb(Abramov) -0.6807997E-01 Ex_ueg -0.5672906E-01 Ec_ueg -0.8181790E-02 Delta_ex -0.6146032E-01 Delta_ec 0.1470855E-01 Delta_et -0.1950044E+00 Pxc 0.6933576E+01 Qxc -0.4178544E+01 3,-1 62 3 +1 -2.146885 -2.176337 -2.056651 Rho 0.1114803E-01 |GRAD(Rho)| 0.1100832E-16 GRAD(Rho)x -0.6028790E-17 GRAD(Rho)y 0.8972421E-17 GRAD(Rho)z -0.2081469E-17 Laplacian 0.4919883E-01 (-1/4)Del**2(Rho)) -0.1229971E-01 Diamond 0.1582389E-02 Metallicity 0.7792108E+00 Ellipticity -0.1249406E+01 Gb(Abramov) 0.9797149E-02 Vb(Abramov) -0.7294591E-02 Hb(Abramov) 0.2502558E-02 Ex_ueg -0.1839285E-02 Ec_ueg -0.4203831E-03 Delta_ex -0.2308273E-02 Delta_ec 0.5249144E-03 Delta_et -0.3956128E-02 Pxc 0.4375259E+01 Qxc -0.4397428E+01 3,+1 63 3 -1 -3.065805 -0.860326 -1.958155 Rho 0.1254764E+00 |GRAD(Rho)| 0.5918465E-13 GRAD(Rho)x 0.2118275E-13 GRAD(Rho)y 0.4325040E-13 GRAD(Rho)z -0.3440229E-13 Laplacian 0.4788001E+00 (-1/4)Del**2(Rho)) -0.1197000E+00 Diamond 0.7888362E+00 Metallicity 0.4526149E+01 Ellipticity 0.1740254E-01 Gb(Abramov) 0.1700967E+00 Vb(Abramov) -0.2204934E+00 Hb(Abramov) -0.5039668E-01 Ex_ueg -0.4639462E-01 Ec_ueg -0.6892668E-02 Delta_ex -0.4931074E-01 Delta_ec 0.1281722E-01 Delta_et -0.1662362E+00 Pxc 0.6731011E+01 Qxc -0.3847225E+01 3,-1 64 3 +1 -2.966289 -0.237082 -0.187471 Rho 0.6276246E-02 |GRAD(Rho)| 0.4757796E-17 GRAD(Rho)x 0.1484749E-17 GRAD(Rho)y 0.2894495E-17 GRAD(Rho)z -0.3471892E-17 Laplacian 0.2647162E-01 (-1/4)Del**2(Rho)) -0.6617905E-02 Diamond 0.7174716E-03 Metallicity 0.5559032E+00 Ellipticity -0.2025143E+01 Gb(Abramov) 0.5025089E-02 Vb(Abramov) -0.3432273E-02 Hb(Abramov) 0.1592816E-02 Ex_ueg -0.8550371E-03 Ec_ueg -0.2022416E-03 Delta_ex -0.1293420E-02 Delta_ec 0.6857916E-03 Delta_et -0.4044775E-02 Pxc 0.4227800E+01 Qxc -0.1886024E+01 3,+1 65 3 -1 -3.211594 3.197817 -0.053513 Rho 0.2354121E+00 |GRAD(Rho)| 0.3128962E-10 GRAD(Rho)x -0.2214232E-10 GRAD(Rho)y 0.2100822E-10 GRAD(Rho)z -0.6885705E-11 Laplacian 0.8718108E+00 (-1/4)Del**2(Rho)) -0.2179527E+00 Diamond 0.3001689E+01 Metallicity 0.7094234E+01 Ellipticity 0.1782497E-02 Gb(Abramov) 0.4030031E+00 Vb(Abramov) -0.5880534E+00 Hb(Abramov) -0.1850504E+00 Ex_ueg -0.1073553E+00 Ec_ueg -0.1412254E-01 Delta_ex -0.1047441E+00 Delta_ec 0.1926319E-01 Delta_et -0.2661841E+00 Pxc 0.7601697E+01 Qxc -0.5437525E+01 3,-1 66 3 +1 -1.732944 0.576580 -0.447332 Rho 0.9517827E-02 |GRAD(Rho)| 0.1128250E-16 GRAD(Rho)x 0.8543492E-17 GRAD(Rho)y -0.6121064E-17 GRAD(Rho)z 0.4103196E-17 Laplacian 0.3747753E-01 (-1/4)Del**2(Rho)) -0.9369383E-02 Diamond 0.1115781E-02 Metallicity 0.7859685E+00 Ellipticity -0.1440869E+01 Gb(Abramov) 0.7473596E-02 Vb(Abramov) -0.5577808E-02 Hb(Abramov) 0.1895788E-02 Ex_ueg -0.1489711E-02 Ec_ueg -0.3462310E-03 Delta_ex -0.1742706E-02 Delta_ec 0.5021236E-03 Delta_et -0.3542166E-02 Pxc 0.4302651E+01 Qxc -0.3470671E+01 3,+1 67 3 -1 -2.993582 -0.038076 0.012314 Rho 0.6373264E-02 |GRAD(Rho)| 0.5465522E-17 GRAD(Rho)x 0.2714667E-17 GRAD(Rho)y -0.3289984E-17 GRAD(Rho)z 0.3417386E-17 Laplacian 0.2555766E-01 (-1/4)Del**2(Rho)) -0.6389414E-02 Diamond 0.9550023E-03 Metallicity 0.5906931E+00 Ellipticity 0.1410554E+01 Gb(Abramov) 0.4888640E-02 Vb(Abramov) -0.3387866E-02 Hb(Abramov) 0.1500774E-02 Ex_ueg -0.8727052E-03 Ec_ueg -0.2064803E-03 Delta_ex -0.1419347E-02 Delta_ec 0.9593952E-03 Delta_et -0.5542852E-02 Pxc 0.4226578E+01 Qxc -0.1479418E+01 3,-1 68 3 +3 -1.140945 -1.082152 1.162400 Rho 0.5280472E-02 |GRAD(Rho)| 0.3131689E-12 GRAD(Rho)x -0.1540918E-12 GRAD(Rho)y 0.2507238E-12 GRAD(Rho)z -0.1070888E-12 Laplacian 0.2067204E-01 (-1/4)Del**2(Rho)) -0.5168010E-02 Diamond 0.1548261E-03 Metallicity 0.5337662E+00 Ellipticity -0.7772614E-01 Gb(Abramov) 0.3905092E-02 Vb(Abramov) -0.2642173E-02 Hb(Abramov) 0.1262918E-02 Ex_ueg -0.6791235E-03 Ec_ueg -0.1590026E-03 Delta_ex -0.7244841E-03 Delta_ec 0.8991083E-04 Delta_et -0.7217321E-03 Pxc 0.4271148E+01 Qxc -0.8057807E+01 3,+3 69 3 -1 -3.239572 -0.056965 3.236982 Rho 0.2355137E+00 |GRAD(Rho)| 0.3564608E-15 GRAD(Rho)x 0.2894820E-15 GRAD(Rho)y -0.9419006E-16 GRAD(Rho)z 0.1854528E-15 Laplacian 0.8669046E+00 (-1/4)Del**2(Rho)) -0.2167261E+00 Diamond 0.2990982E+01 Metallicity 0.7139517E+01 Ellipticity 0.1749460E-02 Gb(Abramov) 0.4023707E+00 Vb(Abramov) -0.5880153E+00 Hb(Abramov) -0.1856446E+00 Ex_ueg -0.1074171E+00 Ec_ueg -0.1412954E-01 Delta_ex -0.1041916E+00 Delta_ec 0.1919752E-01 Delta_et -0.2654767E+00 Pxc 0.7602305E+01 Qxc -0.5427349E+01 3,-1 70 3 -1 -3.296256 0.143554 -3.135282 Rho 0.2357630E+00 |GRAD(Rho)| 0.9953555E-15 GRAD(Rho)x 0.5964196E-15 GRAD(Rho)y -0.3217912E-15 GRAD(Rho)z 0.7290175E-15 Laplacian 0.8820443E+00 (-1/4)Del**2(Rho)) -0.2205111E+00 Diamond 0.3036535E+01 Metallicity 0.7029354E+01 Ellipticity 0.4185015E-02 Gb(Abramov) 0.4053491E+00 Vb(Abramov) -0.5901872E+00 Hb(Abramov) -0.1848380E+00 Ex_ueg -0.1075687E+00 Ec_ueg -0.1414671E-01 Delta_ex -0.1059830E+00 Delta_ec 0.1942394E-01 Delta_et -0.2681735E+00 Pxc 0.7603794E+01 Qxc -0.5456305E+01 3,-1 71 3 +1 -3.010182 0.215334 0.264156 Rho 0.6183178E-02 |GRAD(Rho)| 0.9473809E-16 GRAD(Rho)x -0.1294897E-16 GRAD(Rho)y 0.7279776E-16 GRAD(Rho)z 0.5922935E-16 Laplacian 0.2593593E-01 (-1/4)Del**2(Rho)) -0.6483983E-02 Diamond 0.6722627E-03 Metallicity 0.5534319E+00 Ellipticity -0.1876458E+01 Gb(Abramov) 0.4920729E-02 Vb(Abramov) -0.3357475E-02 Hb(Abramov) 0.1563254E-02 Ex_ueg -0.8381737E-03 Ec_ueg -0.1981798E-03 Delta_ex -0.1251574E-02 Delta_ec 0.6510930E-03 Delta_et -0.3833331E-02 Pxc 0.4229360E+01 Qxc -0.1922267E+01 3,+1 72 3 -1 -2.848286 0.550404 -1.752081 Rho 0.1527039E+00 |GRAD(Rho)| 0.2838617E-15 GRAD(Rho)x -0.4421512E-16 GRAD(Rho)y 0.2730157E-15 GRAD(Rho)z 0.6391372E-16 Laplacian 0.6441811E+00 (-1/4)Del**2(Rho)) -0.1610453E+00 Diamond 0.1328869E+01 Metallicity 0.4666833E+01 Ellipticity 0.1665620E-01 Gb(Abramov) 0.2326254E+00 Vb(Abramov) -0.3042056E+00 Hb(Abramov) -0.7158015E-01 Ex_ueg -0.6028169E-01 Ec_ueg -0.8616830E-02 Delta_ex -0.6943637E-01 Delta_ec 0.1618707E-01 Delta_et -0.2158116E+00 Pxc 0.6995808E+01 Qxc -0.4289618E+01 3,-1 73 3 -1 -3.023989 0.861052 2.019726 Rho 0.1342698E+00 |GRAD(Rho)| 0.2173247E-15 GRAD(Rho)x -0.5421011E-19 GRAD(Rho)y 0.2172741E-15 GRAD(Rho)z 0.4689174E-17 Laplacian 0.5247751E+00 (-1/4)Del**2(Rho)) -0.1311938E+00 Diamond 0.9320397E+00 Metallicity 0.4623144E+01 Ellipticity 0.3725519E-01 Gb(Abramov) 0.1885505E+00 Vb(Abramov) -0.2459072E+00 Hb(Abramov) -0.5735669E-01 Ex_ueg -0.5077965E-01 Ec_ueg -0.7444295E-02 Delta_ex -0.5486559E-01 Delta_ec 0.1370297E-01 Delta_et -0.1794842E+00 Pxc 0.6821284E+01 Qxc -0.4003919E+01 3,-1 74 3 +1 -2.204987 1.185588 1.303639 Rho 0.2849203E-01 |GRAD(Rho)| 0.6040979E-14 GRAD(Rho)x 0.4983581E-14 GRAD(Rho)y -0.3318743E-14 GRAD(Rho)z 0.8020504E-15 Laplacian 0.1140088E+00 (-1/4)Del**2(Rho)) -0.2850221E-01 Diamond 0.1853061E-01 Metallicity 0.1606499E+01 Ellipticity -0.5619488E+01 Gb(Abramov) 0.2663293E-01 Vb(Abramov) -0.2476366E-01 Hb(Abramov) 0.1869276E-02 Ex_ueg -0.6427119E-02 Ec_ueg -0.1266090E-02 Delta_ex -0.7405593E-02 Delta_ec 0.2044961E-02 Delta_et -0.1861669E-01 Pxc 0.5076352E+01 Qxc -0.3621386E+01 3,+1 75 3 -1 -3.232195 -3.164337 0.095213 Rho 0.2349052E+00 |GRAD(Rho)| 0.1525139E-12 GRAD(Rho)x 0.1068239E-12 GRAD(Rho)y 0.1050958E-12 GRAD(Rho)z -0.2835538E-13 Laplacian 0.8789381E+00 (-1/4)Del**2(Rho)) -0.2197345E+00 Diamond 0.3013408E+01 Metallicity 0.7011471E+01 Ellipticity 0.6341655E-03 Gb(Abramov) 0.4032668E+00 Vb(Abramov) -0.5867990E+00 Hb(Abramov) -0.1835322E+00 Ex_ueg -0.1070472E+00 Ec_ueg -0.1408763E-01 Delta_ex -0.1055138E+00 Delta_ec 0.1938430E-01 Delta_et -0.2676259E+00 Pxc 0.7598662E+01 Qxc -0.5443258E+01 3,-1 76 3 +1 -1.799502 -1.723437 1.783894 Rho 0.1258508E-01 |GRAD(Rho)| 0.1761895E-16 GRAD(Rho)x 0.5549884E-17 GRAD(Rho)y 0.4312599E-17 GRAD(Rho)z 0.1615635E-16 Laplacian 0.6322732E-01 (-1/4)Del**2(Rho)) -0.1580683E-01 Diamond 0.2657718E-02 Metallicity 0.7421097E+00 Ellipticity -0.1250095E+01 Gb(Abramov) 0.1249295E-01 Vb(Abramov) -0.9179078E-02 Hb(Abramov) 0.3313877E-02 Ex_ueg -0.2162019E-02 Ec_ueg -0.4866451E-03 Delta_ex -0.3134556E-02 Delta_ec 0.7980298E-03 Delta_et -0.6070770E-02 Pxc 0.4442702E+01 Qxc -0.3927868E+01 3,+1 77 3 -1 -2.807319 -1.774501 0.587194 Rho 0.1479198E+00 |GRAD(Rho)| 0.2063319E-15 GRAD(Rho)x 0.1113476E-15 GRAD(Rho)y 0.1543091E-15 GRAD(Rho)z -0.7977017E-16 Laplacian 0.6142799E+00 (-1/4)Del**2(Rho)) -0.1535700E+00 Diamond 0.1219734E+01 Metallicity 0.4641134E+01 Ellipticity 0.1638360E-01 Gb(Abramov) 0.2211698E+00 Vb(Abramov) -0.2887696E+00 Hb(Abramov) -0.6759982E-01 Ex_ueg -0.5777681E-01 Ec_ueg -0.8310485E-02 Delta_ex -0.6569737E-01 Delta_ec 0.1556005E-01 Delta_et -0.2065494E+00 Pxc 0.6952278E+01 Qxc -0.4222183E+01 3,-1 78 3 -1 -3.017031 1.988328 0.878956 Rho 0.1373745E+00 |GRAD(Rho)| 0.2177306E-15 GRAD(Rho)x 0.1648665E-15 GRAD(Rho)y -0.9780859E-16 GRAD(Rho)z 0.1032432E-15 Laplacian 0.5332400E+00 (-1/4)Del**2(Rho)) -0.1333100E+00 Diamond 0.9749911E+00 Metallicity 0.4726438E+01 Ellipticity 0.3643182E-01 Gb(Abramov) 0.1938869E+00 Vb(Abramov) -0.2544638E+00 Hb(Abramov) -0.6057690E-01 Ex_ueg -0.5235119E-01 Ec_ueg -0.7640266E-02 Delta_ex -0.5607778E-01 Delta_ec 0.1387831E-01 Delta_et -0.1824923E+00 Pxc 0.6852011E+01 Qxc -0.4040677E+01 3,-1 79 3 +3 -0.004995 -0.024062 2.326484 Rho 0.4538775E-02 |GRAD(Rho)| 0.1873311E-17 GRAD(Rho)x -0.9583793E-18 GRAD(Rho)y 0.1378115E-17 GRAD(Rho)z -0.8316273E-18 Laplacian 0.1840201E-01 (-1/4)Del**2(Rho)) -0.4600502E-02 Diamond 0.1502916E-03 Metallicity 0.4659211E+00 Ellipticity -0.2924756E+00 Gb(Abramov) 0.3424247E-02 Vb(Abramov) -0.2247991E-02 Hb(Abramov) 0.1176256E-02 Ex_ueg -0.5550132E-03 Ec_ueg -0.1271187E-03 Delta_ex -0.6588316E-03 Delta_ec 0.1522215E-03 Delta_et -0.9773634E-03 Pxc 0.4366101E+01 Qxc -0.4328110E+01 3,+3 80 3 -1 -2.031441 3.028345 0.883176 Rho 0.1665436E+00 |GRAD(Rho)| 0.2999833E-11 GRAD(Rho)x 0.1511579E-11 GRAD(Rho)y 0.1369719E-11 GRAD(Rho)z 0.2199545E-11 Laplacian 0.6501610E+00 (-1/4)Del**2(Rho)) -0.1625402E+00 Diamond 0.1486662E+01 Metallicity 0.5343250E+01 Ellipticity 0.4832061E-01 Gb(Abramov) 0.2531090E+00 Vb(Abramov) -0.3436778E+00 Hb(Abramov) -0.9056878E-01 Ex_ueg -0.6767407E-01 Ec_ueg -0.9510821E-02 Delta_ex -0.7158965E-01 Delta_ec 0.1595344E-01 Delta_et -0.2149742E+00 Pxc 0.7115482E+01 Qxc -0.4487410E+01 3,-1 81 3 +3 -1.866368 -1.959610 -1.920678 Rho 0.1054143E-01 |GRAD(Rho)| 0.3741515E-15 GRAD(Rho)x -0.3642260E-15 GRAD(Rho)y -0.3908635E-16 GRAD(Rho)z -0.7616473E-16 Laplacian 0.4761455E-01 (-1/4)Del**2(Rho)) -0.1190364E-01 Diamond 0.9272023E-03 Metallicity 0.7334534E+00 Ellipticity -0.6215902E+00 Gb(Abramov) 0.9390885E-02 Vb(Abramov) -0.6878133E-02 Hb(Abramov) 0.2512752E-02 Ex_ueg -0.1707068E-02 Ec_ueg -0.3926619E-03 Delta_ex -0.2031957E-02 Delta_ec 0.2069447E-03 Delta_et -0.1839176E-02 Pxc 0.4347426E+01 Qxc -0.9818842E+01 3,+3 82 3 -1 -2.213568 -0.880810 -3.042262 Rho 0.1380652E+00 |GRAD(Rho)| 0.2751911E-09 GRAD(Rho)x 0.1076293E-09 GRAD(Rho)y -0.2115698E-09 GRAD(Rho)z -0.1392274E-09 Laplacian 0.5201058E+00 (-1/4)Del**2(Rho)) -0.1300265E+00 Diamond 0.9723161E+00 Metallicity 0.4886467E+01 Ellipticity 0.1190371E+00 Gb(Abramov) 0.1925793E+00 Vb(Abramov) -0.2551322E+00 Hb(Abramov) -0.6255285E-01 Ex_ueg -0.5270242E-01 Ec_ueg -0.7683947E-02 Delta_ex -0.5493666E-01 Delta_ec 0.1382979E-01 Delta_et -0.1826247E+00 Pxc 0.6858770E+01 Qxc -0.3972341E+01 3,-1 83 3 -1 -1.838781 -0.543290 2.818720 Rho 0.1560811E+00 |GRAD(Rho)| 0.6907998E-09 GRAD(Rho)x 0.4921683E-09 GRAD(Rho)y -0.4632511E-09 GRAD(Rho)z 0.1427346E-09 Laplacian 0.6492166E+00 (-1/4)Del**2(Rho)) -0.1623042E+00 Diamond 0.1373430E+01 Metallicity 0.4802573E+01 Ellipticity 0.1697259E-01 Gb(Abramov) 0.2381157E+00 Vb(Abramov) -0.3139272E+00 Hb(Abramov) -0.7581153E-01 Ex_ueg -0.6206576E-01 Ec_ueg -0.8833920E-02 Delta_ex -0.7034432E-01 Delta_ec 0.1619929E-01 Delta_et -0.2165413E+00 Pxc 0.7025846E+01 Qxc -0.4342432E+01 3,-1 84 3 -1 -1.828514 -0.502044 -1.702748 Rho 0.5492865E-01 |GRAD(Rho)| 0.3809862E-16 GRAD(Rho)x -0.1839840E-16 GRAD(Rho)y 0.8967538E-17 GRAD(Rho)z -0.3213389E-16 Laplacian 0.2217363E+00 (-1/4)Del**2(Rho)) -0.5543407E-01 Diamond 0.1284043E+00 Metallicity 0.2466652E+01 Ellipticity 0.1872754E-01 Gb(Abramov) 0.5974547E-01 Vb(Abramov) -0.6405688E-01 Hb(Abramov) -0.4311406E-02 Ex_ueg -0.1542116E-01 Ec_ueg -0.2689069E-02 Delta_ex -0.1871606E-01 Delta_ec 0.6648033E-02 Delta_et -0.7184778E-01 Pxc 0.5734756E+01 Qxc -0.2815278E+01 3,-1 85 3 -1 -1.866024 0.541659 -2.757717 Rho 0.1603154E+00 |GRAD(Rho)| 0.5368028E-12 GRAD(Rho)x -0.4091108E-12 GRAD(Rho)y -0.3398434E-12 GRAD(Rho)z 0.7274655E-13 Laplacian 0.6679293E+00 (-1/4)Del**2(Rho)) -0.1669823E+00 Diamond 0.1459955E+01 Metallicity 0.4880991E+01 Ellipticity 0.1747188E-01 Gb(Abramov) 0.2471614E+00 Vb(Abramov) -0.3273405E+00 Hb(Abramov) -0.8017909E-01 Ex_ueg -0.6432088E-01 Ec_ueg -0.9107084E-02 Delta_ex -0.7286073E-01 Delta_ec 0.1656625E-01 Delta_et -0.2222386E+00 Pxc 0.7062731E+01 Qxc -0.4398143E+01 3,-1 86 3 +1 -0.574676 0.547179 -1.651517 Rho 0.9119351E-02 |GRAD(Rho)| 0.1131655E-14 GRAD(Rho)x 0.3373440E-15 GRAD(Rho)y 0.9645287E-15 GRAD(Rho)z -0.4863408E-15 Laplacian 0.3579066E-01 (-1/4)Del**2(Rho)) -0.8947664E-02 Diamond 0.1057167E-02 Metallicity 0.7663903E+00 Ellipticity -0.1485768E+01 Gb(Abramov) 0.7108010E-02 Vb(Abramov) -0.5268356E-02 Hb(Abramov) 0.1839654E-02 Ex_ueg -0.1407139E-02 Ec_ueg -0.3282767E-03 Delta_ex -0.1667759E-02 Delta_ec 0.5182481E-03 Delta_et -0.3584256E-02 Pxc 0.4286441E+01 Qxc -0.3218072E+01 3,+1 87 3 +1 -0.561489 -0.545070 1.681639 Rho 0.8418375E-02 |GRAD(Rho)| 0.1362510E-12 GRAD(Rho)x 0.1159887E-12 GRAD(Rho)y 0.3500405E-13 GRAD(Rho)z 0.6233521E-13 Laplacian 0.3285914E-01 (-1/4)Del**2(Rho)) -0.8214784E-02 Diamond 0.8523957E-03 Metallicity 0.7305851E+00 Ellipticity -0.1432774E+01 Gb(Abramov) 0.6476789E-02 Vb(Abramov) -0.4738794E-02 Hb(Abramov) 0.1737995E-02 Ex_ueg -0.1264803E-02 Ec_ueg -0.2968611E-03 Delta_ex -0.1492241E-02 Delta_ec 0.4609347E-03 Delta_et -0.3134395E-02 Pxc 0.4260588E+01 Qxc -0.3237425E+01 3,+1 88 3 +3 -1.170469 1.086312 -1.118764 Rho 0.5559666E-02 |GRAD(Rho)| 0.2381108E-15 GRAD(Rho)x -0.5138005E-16 GRAD(Rho)y -0.1422632E-15 GRAD(Rho)z 0.1838968E-15 Laplacian 0.2186825E-01 (-1/4)Del**2(Rho)) -0.5467063E-02 Diamond 0.1757156E-03 Metallicity 0.5498111E+00 Ellipticity -0.2776235E+00 Gb(Abramov) 0.4145684E-02 Vb(Abramov) -0.2824305E-02 Hb(Abramov) 0.1321379E-02 Ex_ueg -0.7274167E-03 Ec_ueg -0.1710764E-03 Delta_ex -0.7774621E-03 Delta_ec 0.9501308E-04 Delta_et -0.7695248E-03 Pxc 0.4251998E+01 Qxc -0.8182685E+01 3,+3 89 3 -1 0.217066 -1.218600 -1.917296 Rho 0.5399082E-02 |GRAD(Rho)| 0.7033286E-15 GRAD(Rho)x 0.5610801E-15 GRAD(Rho)y -0.3770484E-15 GRAD(Rho)z -0.1941514E-15 Laplacian 0.2107536E-01 (-1/4)Del**2(Rho)) -0.5268840E-02 Diamond 0.6335418E-03 Metallicity 0.5432980E+00 Ellipticity 0.7296633E+00 Gb(Abramov) 0.3989652E-02 Vb(Abramov) -0.2710463E-02 Hb(Abramov) 0.1279188E-02 Ex_ueg -0.6995385E-03 Ec_ueg -0.1641272E-03 Delta_ex -0.1137843E-02 Delta_ec 0.7962433E-03 Delta_et -0.4371956E-02 Pxc 0.4262174E+01 Qxc -0.1429015E+01 3,-1 90 3 +1 -0.562947 1.606090 -0.547803 Rho 0.9424161E-02 |GRAD(Rho)| 0.5283914E-14 GRAD(Rho)x 0.5175201E-14 GRAD(Rho)y -0.9334550E-15 GRAD(Rho)z 0.5154624E-15 Laplacian 0.3631817E-01 (-1/4)Del**2(Rho)) -0.9079543E-02 Diamond 0.1109794E-02 Metallicity 0.7977994E+00 Ellipticity -0.1509648E+01 Gb(Abramov) 0.7260305E-02 Vb(Abramov) -0.5441066E-02 Hb(Abramov) 0.1819239E-02 Ex_ueg -0.1470196E-02 Ec_ueg -0.3420046E-03 Delta_ex -0.1701666E-02 Delta_ec 0.5172352E-03 Delta_et -0.3614321E-02 Pxc 0.4298763E+01 Qxc -0.3289926E+01 3,+1 91 3 -1 -1.744230 0.553318 1.772234 Rho 0.4693774E-01 |GRAD(Rho)| 0.4152324E-12 GRAD(Rho)x 0.2725335E-12 GRAD(Rho)y 0.1408719E-12 GRAD(Rho)z -0.2798187E-12 Laplacian 0.1876281E+00 (-1/4)Del**2(Rho)) -0.4690703E-01 Diamond 0.8605957E-01 Metallicity 0.2243118E+01 Ellipticity 0.1512893E-01 Gb(Abramov) 0.4880769E-01 Vb(Abramov) -0.5070835E-01 Hb(Abramov) -0.1900657E-02 Ex_ueg -0.1250493E-01 Ec_ueg -0.2246316E-02 Delta_ex -0.1514351E-01 Delta_ec 0.5490774E-02 Delta_et -0.5692308E-01 Pxc 0.5566862E+01 Qxc -0.2757992E+01 3,-1 92 3 -1 -2.047275 0.873091 3.060133 Rho 0.1671967E+00 |GRAD(Rho)| 0.2524376E-13 GRAD(Rho)x -0.1736569E-13 GRAD(Rho)y 0.4553161E-14 GRAD(Rho)z -0.1774680E-13 Laplacian 0.6498954E+00 (-1/4)Del**2(Rho)) -0.1624738E+00 Diamond 0.1495650E+01 Metallicity 0.5380414E+01 Ellipticity 0.4008307E-01 Gb(Abramov) 0.2540120E+00 Vb(Abramov) -0.3455501E+00 Hb(Abramov) -0.9153815E-01 Ex_ueg -0.6802813E-01 Ec_ueg -0.9553288E-02 Delta_ex -0.7165270E-01 Delta_ec 0.1597079E-01 Delta_et -0.2154155E+00 Pxc 0.7120913E+01 Qxc -0.4486485E+01 3,-1 93 3 -1 -1.978243 -3.018648 -0.768182 Rho 0.1394113E+00 |GRAD(Rho)| 0.2823418E-09 GRAD(Rho)x 0.1609195E-09 GRAD(Rho)y -0.1373437E-09 GRAD(Rho)z -0.1869719E-09 Laplacian 0.5133833E+00 (-1/4)Del**2(Rho)) -0.1283458E+00 Diamond 0.9687039E+00 Metallicity 0.5031159E+01 Ellipticity 0.8836860E-01 Gb(Abramov) 0.1931853E+00 Vb(Abramov) -0.2580247E+00 Hb(Abramov) -0.6483942E-01 Ex_ueg -0.5338866E-01 Ec_ueg -0.7769169E-02 Delta_ex -0.5432877E-01 Delta_ec 0.1357424E-01 Delta_et -0.1794342E+00 Pxc 0.6871862E+01 Qxc -0.4002345E+01 3,-1 94 3 -1 -1.542753 -2.679640 -2.387551 Rho 0.2478749E-01 |GRAD(Rho)| 0.4857826E-16 GRAD(Rho)x -0.3220313E-17 GRAD(Rho)y 0.1566851E-16 GRAD(Rho)z -0.4586911E-16 Laplacian 0.7784560E-01 (-1/4)Del**2(Rho)) -0.1946140E-01 Diamond 0.2195955E-01 Metallicity 0.1865377E+01 Ellipticity 0.2775006E-01 Gb(Abramov) 0.1902474E-01 Vb(Abramov) -0.1858808E-01 Hb(Abramov) 0.4366595E-03 Ex_ueg -0.5337793E-02 Ec_ueg -0.1078020E-02 Delta_ex -0.6137438E-02 Delta_ec 0.3654312E-02 Delta_et -0.3163480E-01 Pxc 0.4951477E+01 Qxc -0.1679506E+01 3,-1 95 3 +1 -1.810616 1.680461 -1.733894 Rho 0.1231672E-01 |GRAD(Rho)| 0.1257327E-16 GRAD(Rho)x 0.1082157E-16 GRAD(Rho)y 0.5508332E-17 GRAD(Rho)z -0.3261770E-17 Laplacian 0.6102239E-01 (-1/4)Del**2(Rho)) -0.1525560E-01 Diamond 0.2500459E-02 Metallicity 0.7417926E+00 Ellipticity -0.1267126E+01 Gb(Abramov) 0.1205648E-01 Vb(Abramov) -0.8857362E-02 Hb(Abramov) 0.3199118E-02 Ex_ueg -0.2100770E-02 Ec_ueg -0.4742097E-03 Delta_ex -0.3010825E-02 Delta_ec 0.7752893E-03 Delta_et -0.5863204E-02 Pxc 0.4430045E+01 Qxc -0.3883485E+01 3,+1 96 3 -1 -1.734902 1.739709 0.570544 Rho 0.5055183E-01 |GRAD(Rho)| 0.1191932E-15 GRAD(Rho)x -0.6507119E-16 GRAD(Rho)y 0.9568296E-16 GRAD(Rho)z -0.2859244E-16 Laplacian 0.2031651E+00 (-1/4)Del**2(Rho)) -0.5079128E-01 Diamond 0.1033835E+00 Metallicity 0.2344187E+01 Ellipticity 0.1369010E-01 Gb(Abramov) 0.5370490E-01 Vb(Abramov) -0.5661851E-01 Hb(Abramov) -0.2913613E-02 Ex_ueg -0.1380493E-01 Ec_ueg -0.2445400E-02 Delta_ex -0.1672028E-01 Delta_ec 0.5965447E-02 Delta_et -0.6305908E-01 Pxc 0.5645266E+01 Qxc -0.2802854E+01 3,-1 97 3 +1 -0.313431 -1.307770 -2.562842 Rho 0.3737720E-02 |GRAD(Rho)| 0.1942123E-15 GRAD(Rho)x 0.1861008E-15 GRAD(Rho)y 0.4381787E-16 GRAD(Rho)z -0.3413084E-16 Laplacian 0.1450966E-01 (-1/4)Del**2(Rho)) -0.3627415E-02 Diamond 0.1489016E-03 Metallicity 0.4275306E+00 Ellipticity -0.1290561E+01 Gb(Abramov) 0.2676748E-02 Vb(Abramov) -0.1726082E-02 Hb(Abramov) 0.9506665E-03 Ex_ueg -0.4284111E-03 Ec_ueg -0.9300284E-04 Delta_ex -0.5733674E-03 Delta_ec 0.2613792E-03 Delta_et -0.1381182E-02 Pxc 0.4606430E+01 Qxc -0.2193623E+01 3,+1 98 3 +1 -1.040464 2.208769 1.470936 Rho 0.2592331E-01 |GRAD(Rho)| 0.1657266E-15 GRAD(Rho)x 0.9089826E-16 GRAD(Rho)y 0.7955242E-16 GRAD(Rho)z 0.1134647E-15 Laplacian 0.9890707E-01 (-1/4)Del**2(Rho)) -0.2472677E-01 Diamond 0.1133111E-01 Metallicity 0.1581989E+01 Ellipticity -0.2210976E+01 Gb(Abramov) 0.2300409E-01 Vb(Abramov) -0.2128141E-01 Hb(Abramov) 0.1722678E-02 Ex_ueg -0.5666381E-02 Ec_ueg -0.1135313E-02 Delta_ex -0.5976827E-02 Delta_ec 0.1259512E-02 Delta_et -0.1130293E-01 Pxc 0.4991029E+01 Qxc -0.4745351E+01 3,+1 99 3 +3 -0.079184 -2.299015 -0.080307 Rho 0.4318217E-02 |GRAD(Rho)| 0.1669570E-15 GRAD(Rho)x -0.1265036E-15 GRAD(Rho)y 0.1086040E-15 GRAD(Rho)z -0.8755040E-17 Laplacian 0.1723578E-01 (-1/4)Del**2(Rho)) -0.4308945E-02 Diamond 0.1203908E-03 Metallicity 0.4578148E+00 Ellipticity -0.2981921E+00 Gb(Abramov) 0.3201413E-02 Vb(Abramov) -0.2093881E-02 Hb(Abramov) 0.1107532E-02 Ex_ueg -0.5193471E-03 Ec_ueg -0.1176919E-03 Delta_ex -0.5965734E-03 Delta_ec 0.1200646E-03 Delta_et -0.7971265E-03 Pxc 0.4412767E+01 Qxc -0.4968770E+01 3,+3 100 3 +1 -0.282124 -0.507029 -3.078642 Rho 0.3122069E-02 |GRAD(Rho)| 0.3214725E-11 GRAD(Rho)x 0.1613046E-11 GRAD(Rho)y -0.2777823E-11 GRAD(Rho)z -0.1274340E-12 Laplacian 0.1184577E-01 (-1/4)Del**2(Rho)) -0.2961442E-02 Diamond 0.1155611E-03 Metallicity 0.3879605E+00 Ellipticity -0.1425383E+01 Gb(Abramov) 0.2165782E-02 Vb(Abramov) -0.1370121E-02 Hb(Abramov) 0.7956602E-03 Ex_ueg -0.3370092E-03 Ec_ueg -0.6701513E-04 Delta_ex -0.4852119E-03 Delta_ec 0.2759664E-03 Delta_et -0.1340444E-02 Pxc 0.5028853E+01 Qxc -0.1758228E+01 3,+1 101 3 +3 1.142223 1.111265 1.088405 Rho 0.4544495E-02 |GRAD(Rho)| 0.9873508E-16 GRAD(Rho)x 0.5891553E-16 GRAD(Rho)y -0.4860047E-16 GRAD(Rho)z 0.6257453E-16 Laplacian 0.1674403E-01 (-1/4)Del**2(Rho)) -0.4186008E-02 Diamond 0.1025035E-03 Metallicity 0.5131321E+00 Ellipticity -0.9196358E-01 Gb(Abramov) 0.3148668E-02 Vb(Abramov) -0.2111328E-02 Hb(Abramov) 0.1037340E-02 Ex_ueg -0.5559460E-03 Ec_ueg -0.1273635E-03 Delta_ex -0.5633011E-03 Delta_ec 0.7357640E-04 Delta_et -0.5734185E-03 Pxc 0.4365032E+01 Qxc -0.7656002E+01 3,+3 102 3 +1 -0.209675 0.181352 2.967934 Rho 0.5463460E-02 |GRAD(Rho)| 0.3121513E-13 GRAD(Rho)x -0.4745495E-14 GRAD(Rho)y -0.3056164E-13 GRAD(Rho)z 0.4225007E-14 Laplacian 0.2187090E-01 (-1/4)Del**2(Rho)) -0.5467725E-02 Diamond 0.5394617E-03 Metallicity 0.5339814E+00 Ellipticity -0.2830823E+01 Gb(Abramov) 0.4131760E-02 Vb(Abramov) -0.2795796E-02 Hb(Abramov) 0.1335964E-02 Ex_ueg -0.7106822E-03 Ec_ueg -0.1669116E-03 Delta_ex -0.1077294E-02 Delta_ec 0.6369418E-03 Delta_et -0.3573063E-02 Pxc 0.4257836E+01 Qxc -0.1691354E+01 3,+1 103 3 +1 0.511869 0.512620 1.694224 Rho 0.8129604E-02 |GRAD(Rho)| 0.2472203E-16 GRAD(Rho)x 0.1317958E-16 GRAD(Rho)y -0.1369959E-16 GRAD(Rho)z -0.1580502E-16 Laplacian 0.3122611E-01 (-1/4)Del**2(Rho)) -0.7806528E-02 Diamond 0.7579859E-03 Metallicity 0.7253443E+00 Ellipticity -0.1417373E+01 Gb(Abramov) 0.6148089E-02 Vb(Abramov) -0.4489650E-02 Hb(Abramov) 0.1658439E-02 Ex_ueg -0.1207288E-02 Ec_ueg -0.2839827E-03 Delta_ex -0.1398632E-02 Delta_ec 0.4255105E-03 Delta_et -0.2877981E-02 Pxc 0.4251273E+01 Qxc -0.3286951E+01 3,+1 104 3 -1 -0.700587 -3.365190 -1.304899 Rho 0.2805807E+00 |GRAD(Rho)| 0.6760689E-14 GRAD(Rho)x 0.4788157E-15 GRAD(Rho)y 0.6286245E-14 GRAD(Rho)z 0.2441470E-14 Laplacian -0.1313547E+01 (-1/4)Del**2(Rho)) 0.3283868E+00 Diamond 0.4186499E+01 Metallicity -0.6308563E+01 Ellipticity 0.2976363E-02 Gb(Abramov) 0.1263503E+00 Vb(Abramov) -0.5810874E+00 Hb(Abramov) -0.4547371E+00 Ex_ueg -0.1356632E+00 Ec_ueg -0.1728942E-01 Delta_ex 0.1230415E+00 Delta_ec 0.4792649E-01 Delta_et -0.1070706E+01 Pxc 0.7846601E+01 Qxc 0.2567295E+01 3,-1 105 3 +3 0.995325 -1.134356 -1.259468 Rho 0.4080422E-02 |GRAD(Rho)| 0.5184553E-17 GRAD(Rho)x 0.2769162E-17 GRAD(Rho)y 0.3771813E-17 GRAD(Rho)z 0.2232657E-17 Laplacian 0.1478492E-01 (-1/4)Del**2(Rho)) -0.3696229E-02 Diamond 0.1047123E-03 Metallicity 0.4856270E+00 Ellipticity -0.6367539E+00 Gb(Abramov) 0.2763318E-02 Vb(Abramov) -0.1830406E-02 Hb(Abramov) 0.9329117E-03 Ex_ueg -0.4815691E-03 Ec_ueg -0.1075568E-03 Delta_ex -0.5152529E-03 Delta_ec 0.1227609E-03 Delta_et -0.7681475E-03 Pxc 0.4477345E+01 Qxc -0.4197207E+01 3,+3 106 3 +1 0.137740 -2.987164 0.203618 Rho 0.5373180E-02 |GRAD(Rho)| 0.1231549E-15 GRAD(Rho)x -0.1210746E-15 GRAD(Rho)y -0.1269144E-16 GRAD(Rho)z 0.1862788E-16 Laplacian 0.2107820E-01 (-1/4)Del**2(Rho)) -0.5269549E-02 Diamond 0.4552044E-03 Metallicity 0.5388882E+00 Ellipticity -0.1988908E+01 Gb(Abramov) 0.3986316E-02 Vb(Abramov) -0.2703082E-02 Hb(Abramov) 0.1283233E-02 Ex_ueg -0.6950674E-03 Ec_ueg -0.1630074E-03 Delta_ex -0.9899259E-03 Delta_ec 0.5337647E-03 Delta_et -0.3014184E-02 Pxc 0.4264022E+01 Qxc -0.1854611E+01 3,+1 107 3 +1 1.440020 2.172048 -1.019131 Rho 0.2398834E-01 |GRAD(Rho)| 0.1658226E-11 GRAD(Rho)x -0.1253103E-11 GRAD(Rho)y -0.4373083E-12 GRAD(Rho)z -0.9940861E-12 Laplacian 0.9100640E-01 (-1/4)Del**2(Rho)) -0.2275160E-01 Diamond 0.9148066E-02 Metallicity 0.1510804E+01 Ellipticity -0.2048491E+01 Gb(Abramov) 0.2089660E-01 Vb(Abramov) -0.1904160E-01 Hb(Abramov) 0.1854999E-02 Ex_ueg -0.5109580E-02 Ec_ueg -0.1037914E-02 Delta_ex -0.5357476E-02 Delta_ec 0.1114727E-02 Delta_et -0.9852546E-02 Pxc 0.4922930E+01 Qxc -0.4806088E+01 3,+1 108 3 +1 1.702435 0.558490 0.549604 Rho 0.7067673E-02 |GRAD(Rho)| 0.8096166E-17 GRAD(Rho)x 0.6222574E-17 GRAD(Rho)y -0.1546970E-17 GRAD(Rho)z 0.4943113E-17 Laplacian 0.2657783E-01 (-1/4)Del**2(Rho)) -0.6644458E-02 Diamond 0.5478012E-03 Metallicity 0.6748714E+00 Ellipticity -0.1413743E+01 Gb(Abramov) 0.5176998E-02 Vb(Abramov) -0.3709537E-02 Hb(Abramov) 0.1467460E-02 Ex_ueg -0.1001737E-02 Ec_ueg -0.2369504E-03 Delta_ex -0.1157759E-02 Delta_ec 0.3773886E-03 Delta_et -0.2448826E-02 Pxc 0.4227623E+01 Qxc -0.3067818E+01 3,+1 109 3 -1 -0.574953 -2.760093 1.848209 Rho 0.1327413E+00 |GRAD(Rho)| 0.4793498E-14 GRAD(Rho)x 0.3254030E-14 GRAD(Rho)y 0.8758185E-15 GRAD(Rho)z 0.3409084E-14 Laplacian 0.5533577E+00 (-1/4)Del**2(Rho)) -0.1383394E+00 Diamond 0.9701807E+00 Metallicity 0.4301472E+01 Ellipticity 0.8453234E-02 Gb(Abramov) 0.1914035E+00 Vb(Abramov) -0.2444676E+00 Hb(Abramov) -0.5306406E-01 Ex_ueg -0.5001033E-01 Ec_ueg -0.7348038E-02 Delta_ex -0.5770334E-01 Delta_ec 0.1450596E-01 Delta_et -0.1896895E+00 Pxc 0.6805942E+01 Qxc -0.3977906E+01 3,-1 110 3 +1 -0.610603 -1.634047 0.548382 Rho 0.8972477E-02 |GRAD(Rho)| 0.6118452E-17 GRAD(Rho)x -0.3506855E-17 GRAD(Rho)y -0.4056785E-17 GRAD(Rho)z -0.2946169E-17 Laplacian 0.3441610E-01 (-1/4)Del**2(Rho)) -0.8604025E-02 Diamond 0.9805169E-03 Metallicity 0.7757209E+00 Ellipticity -0.1490018E+01 Gb(Abramov) 0.6848404E-02 Vb(Abramov) -0.5092782E-02 Hb(Abramov) 0.1755621E-02 Ex_ueg -0.1377003E-02 Ec_ueg -0.3216764E-03 Delta_ex -0.1591259E-02 Delta_ec 0.4878574E-03 Delta_et -0.3368125E-02 Pxc 0.4280709E+01 Qxc -0.3261730E+01 3,+1 111 3 -1 -0.581075 -1.801155 2.808025 Rho 0.1172368E+00 |GRAD(Rho)| 0.3374050E-15 GRAD(Rho)x -0.2366610E-15 GRAD(Rho)y 0.2386600E-15 GRAD(Rho)z -0.2958178E-16 Laplacian 0.4942697E+00 (-1/4)Del**2(Rho)) -0.1235674E+00 Diamond 0.7457234E+00 Metallicity 0.3915218E+01 Ellipticity 0.7250398E-02 Gb(Abramov) 0.1630105E+00 Vb(Abramov) -0.2024536E+00 Hb(Abramov) -0.3944310E-01 Ex_ueg -0.4237768E-01 Ec_ueg -0.6380542E-02 Delta_ex -0.5002115E-01 Delta_ec 0.1332541E-01 Delta_et -0.1706054E+00 Pxc 0.6641705E+01 Qxc -0.3753816E+01 3,-1 112 3 +1 0.106613 -0.151653 2.992413 Rho 0.5474069E-02 |GRAD(Rho)| 0.1251351E-16 GRAD(Rho)x -0.1039115E-16 GRAD(Rho)y -0.6945573E-17 GRAD(Rho)z -0.6090005E-18 Laplacian 0.2211393E-01 (-1/4)Del**2(Rho)) -0.5528482E-02 Diamond 0.5639500E-03 Metallicity 0.5298233E+00 Ellipticity -0.3084475E+01 Gb(Abramov) 0.4173841E-02 Vb(Abramov) -0.2819200E-02 Hb(Abramov) 0.1354641E-02 Ex_ueg -0.7125227E-03 Ec_ueg -0.1673706E-03 Delta_ex -0.1103735E-02 Delta_ec 0.6690966E-03 Delta_et -0.3744766E-02 Pxc 0.4257155E+01 Qxc -0.1649590E+01 3,+1 113 3 -1 -0.254304 -1.433430 -3.335450 Rho 0.5342555E-02 |GRAD(Rho)| 0.1176535E-15 GRAD(Rho)x -0.1123603E-15 GRAD(Rho)y 0.3449816E-16 GRAD(Rho)z 0.5234669E-17 Laplacian 0.1947045E-01 (-1/4)Del**2(Rho)) -0.4867613E-02 Diamond 0.6849810E-03 Metallicity 0.5778548E+00 Ellipticity 0.1966400E+00 Gb(Abramov) 0.3713871E-02 Vb(Abramov) -0.2560129E-02 Hb(Abramov) 0.1153742E-02 Ex_ueg -0.6897902E-03 Ec_ueg -0.1616840E-03 Delta_ex -0.1140901E-02 Delta_ec 0.8993668E-03 Delta_et -0.4867599E-02 Pxc 0.4266287E+01 Qxc -0.1268560E+01 3,-1 114 3 -1 -0.878319 2.005266 3.045735 Rho 0.9775590E-01 |GRAD(Rho)| 0.9821983E-16 GRAD(Rho)x 0.2398797E-17 GRAD(Rho)y 0.6382563E-16 GRAD(Rho)z -0.7461683E-16 Laplacian 0.4086866E+00 (-1/4)Del**2(Rho)) -0.1021716E+00 Diamond 0.5113218E+00 Metallicity 0.3497795E+01 Ellipticity 0.3406620E-02 Gb(Abramov) 0.1276770E+00 Vb(Abramov) -0.1531824E+00 Hb(Abramov) -0.2550537E-01 Ex_ueg -0.3325899E-01 Ec_ueg -0.5189314E-02 Delta_ex -0.3991347E-01 Delta_ec 0.1198074E-01 Delta_et -0.1487715E+00 Pxc 0.6409130E+01 Qxc -0.3331468E+01 3,-1 115 3 +3 0.033605 2.325486 0.000991 Rho 0.4467214E-02 |GRAD(Rho)| 0.4549130E-16 GRAD(Rho)x 0.2292536E-16 GRAD(Rho)y -0.3178033E-16 GRAD(Rho)z -0.2310622E-16 Laplacian 0.1782497E-01 (-1/4)Del**2(Rho)) -0.4456244E-02 Diamond 0.1502438E-03 Metallicity 0.4684308E+00 Ellipticity -0.3053478E+00 Gb(Abramov) 0.3318736E-02 Vb(Abramov) -0.2181228E-02 Hb(Abramov) 0.1137508E-02 Ex_ueg -0.5433763E-03 Ec_ueg -0.1240574E-03 Delta_ex -0.6439409E-03 Delta_ec 0.1624264E-03 Delta_et -0.1015742E-02 Pxc 0.4380040E+01 Qxc -0.3964510E+01 3,+3 116 3 +1 0.142083 2.927792 -0.155726 Rho 0.5109732E-02 |GRAD(Rho)| 0.2662681E-16 GRAD(Rho)x 0.1550293E-16 GRAD(Rho)y 0.3413673E-17 GRAD(Rho)z -0.2137739E-16 Laplacian 0.2020470E-01 (-1/4)Del**2(Rho)) -0.5051174E-02 Diamond 0.4480164E-03 Metallicity 0.5170005E+00 Ellipticity -0.2506971E+01 Gb(Abramov) 0.3802693E-02 Vb(Abramov) -0.2554211E-02 Hb(Abramov) 0.1248481E-02 Ex_ueg -0.6500037E-03 Ec_ueg -0.1516381E-03 Delta_ex -0.9753023E-03 Delta_ec 0.5764584E-03 Delta_et -0.3175232E-02 Pxc 0.4286548E+01 Qxc -0.1691887E+01 3,+1 117 3 -1 -0.559245 2.702248 -1.818128 Rho 0.1161016E+00 |GRAD(Rho)| 0.2018113E-12 GRAD(Rho)x 0.1388844E-12 GRAD(Rho)y -0.1451945E-13 GRAD(Rho)z -0.1456988E-12 Laplacian 0.4866449E+00 (-1/4)Del**2(Rho)) -0.1216612E+00 Diamond 0.7244510E+00 Metallicity 0.3912592E+01 Ellipticity 0.6482521E-02 Gb(Abramov) 0.1604426E+00 Vb(Abramov) -0.1992240E+00 Hb(Abramov) -0.3878138E-01 Ex_ueg -0.4183142E-01 Ec_ueg -0.6310353E-02 Delta_ex -0.4911865E-01 Delta_ec 0.1311878E-01 Delta_et -0.1676205E+00 Pxc 0.6629014E+01 Qxc -0.3744149E+01 3,-1 118 3 -1 -0.870456 3.025944 2.016794 Rho 0.9844030E-01 |GRAD(Rho)| 0.1749420E-15 GRAD(Rho)x 0.1740890E-15 GRAD(Rho)y -0.1228537E-16 GRAD(Rho)z -0.1211596E-16 Laplacian 0.4068739E+00 (-1/4)Del**2(Rho)) -0.1017185E+00 Diamond 0.5146271E+00 Metallicity 0.3554470E+01 Ellipticity 0.7288769E-02 Gb(Abramov) 0.1280715E+00 Vb(Abramov) -0.1544246E+00 Hb(Abramov) -0.2635306E-01 Ex_ueg -0.3356982E-01 Ec_ueg -0.5230668E-02 Delta_ex -0.3982231E-01 Delta_ec 0.1194929E-01 Delta_et -0.1486410E+00 Pxc 0.6417883E+01 Qxc -0.3332608E+01 3,-1 119 3 -1 0.596590 1.790563 2.829953 Rho 0.1310795E+00 |GRAD(Rho)| 0.7565925E-16 GRAD(Rho)x 0.8199279E-17 GRAD(Rho)y -0.1387779E-16 GRAD(Rho)z -0.7392226E-16 Laplacian 0.5583526E+00 (-1/4)Del**2(Rho)) -0.1395881E+00 Diamond 0.9878290E+00 Metallicity 0.4174416E+01 Ellipticity 0.1602389E-01 Gb(Abramov) 0.1901753E+00 Vb(Abramov) -0.2407624E+00 Hb(Abramov) -0.5058712E-01 Ex_ueg -0.4917729E-01 Ec_ueg -0.7243566E-02 Delta_ex -0.5832873E-01 Delta_ec 0.1518345E-01 Delta_et -0.1990928E+00 Pxc 0.6789100E+01 Qxc -0.3841598E+01 3,-1 120 3 +1 0.454656 -0.807778 -1.786098 Rho 0.5027979E-02 |GRAD(Rho)| 0.7080297E-17 GRAD(Rho)x -0.3996276E-17 GRAD(Rho)y -0.1067003E-17 GRAD(Rho)z 0.5746468E-17 Laplacian 0.1926012E-01 (-1/4)Del**2(Rho)) -0.4815030E-02 Diamond 0.3526901E-03 Metallicity 0.5279708E+00 Ellipticity -0.1717790E+01 Gb(Abramov) 0.3633719E-02 Vb(Abramov) -0.2452408E-02 Hb(Abramov) 0.1181311E-02 Ex_ueg -0.6361746E-03 Ec_ueg -0.1481170E-03 Delta_ex -0.8666060E-03 Delta_ec 0.4421933E-03 Delta_et -0.2471891E-02 Pxc 0.4295080E+01 Qxc -0.1959790E+01 3,+1 121 3 +3 2.408318 -0.020260 -0.004069 Rho 0.3577445E-02 |GRAD(Rho)| 0.2523730E-16 GRAD(Rho)x -0.1832270E-16 GRAD(Rho)y -0.1129524E-16 GRAD(Rho)z 0.1317639E-16 Laplacian 0.1396020E-01 (-1/4)Del**2(Rho)) -0.3490051E-02 Diamond 0.8632016E-04 Metallicity 0.4130567E+00 Ellipticity -0.1902491E+00 Gb(Abramov) 0.2566965E-02 Vb(Abramov) -0.1643880E-02 Hb(Abramov) 0.9230855E-03 Ex_ueg -0.4040940E-03 Ec_ueg -0.8621770E-04 Delta_ex -0.4756723E-03 Delta_ec 0.1252275E-03 Delta_et -0.7449356E-03 Pxc 0.4686903E+01 Qxc -0.3798466E+01 3,+3 122 3 -1 -0.569952 -0.464197 -0.480183 Rho 0.1875114E+00 |GRAD(Rho)| 0.4404969E-13 GRAD(Rho)x 0.2444225E-13 GRAD(Rho)y 0.2766537E-13 GRAD(Rho)z 0.2403286E-13 Laplacian 0.5095391E+00 (-1/4)Del**2(Rho)) -0.1273848E+00 Diamond 0.1364727E+01 Metallicity 0.8307720E+01 Ellipticity 0.2375742E-01 Gb(Abramov) 0.2613027E+00 Vb(Abramov) -0.3952206E+00 Hb(Abramov) -0.1339179E+00 Ex_ueg -0.7926632E-01 Ec_ueg -0.1088665E-01 Delta_ex -0.5796104E-01 Delta_ec 0.1240063E-01 Delta_et -0.1701182E+00 Pxc 0.7281054E+01 Qxc -0.4674039E+01 3,-1 123 3 +3 -0.247520 -0.524535 -2.695920 Rho 0.3017694E-02 |GRAD(Rho)| 0.7013490E-18 GRAD(Rho)x -0.5362739E-19 GRAD(Rho)y 0.6345580E-18 GRAD(Rho)z -0.2938548E-18 Laplacian 0.1173036E-01 (-1/4)Del**2(Rho)) -0.2932590E-02 Diamond 0.8572042E-04 Metallicity 0.3701921E+00 Ellipticity -0.7310700E+00 Gb(Abramov) 0.2135997E-02 Vb(Abramov) -0.1339404E-02 Hb(Abramov) 0.7965931E-03 Ex_ueg -0.3220713E-03 Ec_ueg -0.6262965E-04 Delta_ex -0.4342709E-03 Delta_ec 0.1965409E-03 Delta_et -0.9882094E-03 Pxc 0.5142472E+01 Qxc -0.2209570E+01 3,+3 124 3 +1 2.187782 1.002071 -1.452830 Rho 0.2350154E-01 |GRAD(Rho)| 0.2940859E-16 GRAD(Rho)x 0.2262761E-16 GRAD(Rho)y 0.8656736E-17 GRAD(Rho)z -0.1667085E-16 Laplacian 0.8657114E-01 (-1/4)Del**2(Rho)) -0.2164279E-01 Diamond 0.9641657E-02 Metallicity 0.1534854E+01 Ellipticity -0.2973790E+01 Gb(Abramov) 0.1996494E-01 Vb(Abramov) -0.1828710E-01 Hb(Abramov) 0.1677843E-02 Ex_ueg -0.4971797E-02 Ec_ueg -0.1013569E-02 Delta_ex -0.5206934E-02 Delta_ec 0.1309537E-02 Delta_et -0.1142897E-01 Pxc 0.4905239E+01 Qxc -0.3976165E+01 3,+1 125 3 +1 0.269551 -1.504210 -1.741809 Rho 0.5278775E-02 |GRAD(Rho)| 0.4724980E-17 GRAD(Rho)x -0.1299254E-17 GRAD(Rho)y -0.3251965E-17 GRAD(Rho)z 0.3172082E-17 Laplacian 0.2051046E-01 (-1/4)Del**2(Rho)) -0.5127615E-02 Diamond 0.4561044E-03 Metallicity 0.5376830E+00 Ellipticity -0.2289864E+01 Gb(Abramov) 0.3877915E-02 Vb(Abramov) -0.2628216E-02 Hb(Abramov) 0.1249700E-02 Ex_ueg -0.6788324E-03 Ec_ueg -0.1589293E-03 Delta_ex -0.9800933E-03 Delta_ec 0.5558011E-03 Delta_et -0.3104203E-02 Pxc 0.4271286E+01 Qxc -0.1763389E+01 3,+1 126 3 -1 -0.508069 0.467992 0.472474 Rho 0.1755643E+00 |GRAD(Rho)| 0.2125443E-15 GRAD(Rho)x 0.2081668E-15 GRAD(Rho)y 0.4163336E-16 GRAD(Rho)z 0.1040834E-16 Laplacian 0.4586738E+00 (-1/4)Del**2(Rho)) -0.1146685E+00 Diamond 0.1145349E+01 Metallicity 0.8269947E+01 Ellipticity 0.1421518E-02 Gb(Abramov) 0.2344960E+00 Vb(Abramov) -0.3543235E+00 Hb(Abramov) -0.1198275E+00 Ex_ueg -0.7260500E-01 Ec_ueg -0.1009961E-01 Delta_ex -0.5140206E-01 Delta_ec 0.1150475E-01 Delta_et -0.1571264E+00 Pxc 0.7188888E+01 Qxc -0.4467897E+01 3,-1 127 3 +1 1.336358 -1.085978 2.183747 Rho 0.2578827E-01 |GRAD(Rho)| 0.2118472E-16 GRAD(Rho)x 0.1808556E-16 GRAD(Rho)y -0.3731442E-17 GRAD(Rho)z 0.1038177E-16 Laplacian 0.9977529E-01 (-1/4)Del**2(Rho)) -0.2494382E-01 Diamond 0.1302589E-01 Metallicity 0.1554631E+01 Ellipticity -0.3213392E+01 Gb(Abramov) 0.2309229E-01 Vb(Abramov) -0.2124075E-01 Hb(Abramov) 0.1851536E-02 Ex_ueg -0.5627058E-02 Ec_ueg -0.1128484E-02 Delta_ex -0.6195362E-02 Delta_ec 0.1582701E-02 Delta_et -0.1410016E-01 Pxc 0.4986388E+01 Qxc -0.3914424E+01 3,+1 128 3 +1 1.736005 -0.594754 -0.582687 Rho 0.6780331E-02 |GRAD(Rho)| 0.4364380E-17 GRAD(Rho)x -0.2878952E-17 GRAD(Rho)y -0.3023486E-17 GRAD(Rho)z -0.1271997E-17 Laplacian 0.2467014E-01 (-1/4)Del**2(Rho)) -0.6167536E-02 Diamond 0.4637430E-03 Metallicity 0.6784632E+00 Ellipticity -0.1395105E+01 Gb(Abramov) 0.4809098E-02 Vb(Abramov) -0.3450661E-02 Hb(Abramov) 0.1358438E-02 Ex_ueg -0.9478062E-03 Ec_ueg -0.2243143E-03 Delta_ex -0.1053241E-02 Delta_ec 0.3316800E-03 Delta_et -0.2144942E-02 Pxc 0.4225350E+01 Qxc -0.3175472E+01 3,+1 129 3 +1 0.539323 1.696916 0.526930 Rho 0.7688248E-02 |GRAD(Rho)| 0.7905051E-16 GRAD(Rho)x -0.4417398E-16 GRAD(Rho)y -0.6269460E-16 GRAD(Rho)z 0.1915803E-16 Laplacian 0.2862501E-01 (-1/4)Del**2(Rho)) -0.7156253E-02 Diamond 0.6480771E-03 Metallicity 0.7209633E+00 Ellipticity -0.1436442E+01 Gb(Abramov) 0.5630735E-02 Vb(Abramov) -0.4105216E-02 Hb(Abramov) 0.1525518E-02 Ex_ueg -0.1120697E-02 Ec_ueg -0.2643723E-03 Delta_ex -0.1266318E-02 Delta_ec 0.3938893E-03 Delta_et -0.2622940E-02 Pxc 0.4239086E+01 Qxc -0.3214909E+01 3,+1 130 3 -1 0.030722 -3.269435 -1.256211 Rho 0.5837966E-01 |GRAD(Rho)| 0.3053747E-16 GRAD(Rho)x -0.1117701E-16 GRAD(Rho)y -0.2728545E-16 GRAD(Rho)z 0.7944534E-17 Laplacian 0.1243632E+00 (-1/4)Del**2(Rho)) -0.3109081E-01 Diamond 0.1382100E+00 Metallicity 0.4868074E+01 Ellipticity 0.2858678E-02 Gb(Abramov) 0.4595259E-01 Vb(Abramov) -0.6081438E-01 Hb(Abramov) -0.1486179E-01 Ex_ueg -0.1672632E-01 Ec_ueg -0.2883052E-02 Delta_ex -0.1276307E-01 Delta_ec 0.7480568E-02 Delta_et -0.8371634E-01 Pxc 0.5801602E+01 Qxc -0.1706163E+01 3,-1 131 3 -1 -0.089545 -3.186958 3.256974 Rho 0.2352149E+00 |GRAD(Rho)| 0.3670824E-15 GRAD(Rho)x -0.5252960E-16 GRAD(Rho)y -0.2827599E-15 GRAD(Rho)z -0.2281161E-15 Laplacian 0.8675907E+00 (-1/4)Del**2(Rho)) -0.2168977E+00 Diamond 0.2988217E+01 Metallicity 0.7118792E+01 Ellipticity 0.1325811E-02 Gb(Abramov) 0.4019400E+00 Vb(Abramov) -0.5869823E+00 Hb(Abramov) -0.1850423E+00 Ex_ueg -0.1072354E+00 Ec_ueg -0.1410896E-01 Delta_ex -0.1042365E+00 Delta_ec 0.1921440E-01 Delta_et -0.2656737E+00 Pxc 0.7600517E+01 Qxc -0.5424916E+01 3,-1 132 3 +1 0.370600 -1.752886 -0.669084 Rho 0.6887535E-02 |GRAD(Rho)| 0.9070470E-17 GRAD(Rho)x 0.5376692E-17 GRAD(Rho)y 0.5101034E-17 GRAD(Rho)z 0.5229155E-17 Laplacian 0.2521998E-01 (-1/4)Del**2(Rho)) -0.6304994E-02 Diamond 0.6060422E-03 Metallicity 0.6812527E+00 Ellipticity -0.1722052E+01 Gb(Abramov) 0.4919212E-02 Vb(Abramov) -0.3533429E-02 Hb(Abramov) 0.1385782E-02 Ex_ueg -0.9678398E-03 Ec_ueg -0.2290241E-03 Delta_ex -0.1154699E-02 Delta_ec 0.4707599E-03 Delta_et -0.2938150E-02 Pxc 0.4225930E+01 Qxc -0.2452840E+01 3,+1 133 3 -1 0.545855 1.680962 -1.745618 Rho 0.5133881E-01 |GRAD(Rho)| 0.8328063E-15 GRAD(Rho)x -0.2285665E-15 GRAD(Rho)y 0.5410728E-15 GRAD(Rho)z -0.5903930E-15 Laplacian 0.2063406E+00 (-1/4)Del**2(Rho)) -0.5158515E-01 Diamond 0.1078954E+00 Metallicity 0.2368308E+01 Ellipticity 0.1837362E-01 Gb(Abramov) 0.5475169E-01 Vb(Abramov) -0.5791822E-01 Hb(Abramov) -0.3166534E-02 Ex_ueg -0.1409222E-01 Ec_ueg -0.2489011E-02 Delta_ex -0.1707584E-01 Delta_ec 0.6107531E-02 Delta_et -0.6483552E-01 Pxc 0.5661775E+01 Qxc -0.2795866E+01 3,-1 134 3 -1 -0.512536 1.741927 1.759768 Rho 0.4331684E-01 |GRAD(Rho)| 0.8420680E-16 GRAD(Rho)x -0.3466525E-16 GRAD(Rho)y -0.7063154E-16 GRAD(Rho)z 0.3000487E-16 Laplacian 0.1848680E+00 (-1/4)Del**2(Rho)) -0.4621700E-01 Diamond 0.8300179E-01 Metallicity 0.1991495E+01 Ellipticity 0.1267202E-01 Gb(Abramov) 0.4615150E-01 Vb(Abramov) -0.4608599E-01 Hb(Abramov) 0.6550923E-04 Ex_ueg -0.1123554E-01 Ec_ueg -0.2048928E-02 Delta_ex -0.1498743E-01 Delta_ec 0.6063327E-02 Delta_et -0.6165400E-01 Pxc 0.5483621E+01 Qxc -0.2471816E+01 3,-1 135 3 -1 -0.568453 1.745707 -2.782559 Rho 0.1155497E+00 |GRAD(Rho)| 0.1169622E-15 GRAD(Rho)x -0.6816921E-16 GRAD(Rho)y -0.5659535E-16 GRAD(Rho)z -0.7635494E-16 Laplacian 0.4840004E+00 (-1/4)Del**2(Rho)) -0.1210001E+00 Diamond 0.7190810E+00 Metallicity 0.3902854E+01 Ellipticity 0.9704242E-02 Gb(Abramov) 0.1593743E+00 Vb(Abramov) -0.1977486E+00 Hb(Abramov) -0.3837425E-01 Ex_ueg -0.4156651E-01 Ec_ueg -0.6276266E-02 Delta_ex -0.4883438E-01 Delta_ec 0.1312948E-01 Delta_et -0.1677191E+00 Pxc 0.6622810E+01 Qxc -0.3719444E+01 3,-1 136 3 +1 -1.056102 1.448293 2.227834 Rho 0.2561914E-01 |GRAD(Rho)| 0.1751705E-16 GRAD(Rho)x -0.5635108E-17 GRAD(Rho)y 0.1542533E-16 GRAD(Rho)z 0.6095231E-17 Laplacian 0.9718259E-01 (-1/4)Del**2(Rho)) -0.2429565E-01 Diamond 0.1122595E-01 Metallicity 0.1578698E+01 Ellipticity -0.2336246E+01 Gb(Abramov) 0.2258968E-01 Vb(Abramov) -0.2088371E-01 Hb(Abramov) 0.1705969E-02 Ex_ueg -0.5577906E-02 Ec_ueg -0.1119937E-02 Delta_ex -0.5882071E-02 Delta_ec 0.1288792E-02 Delta_et -0.1152182E-01 Pxc 0.4980552E+01 Qxc -0.4564018E+01 3,+1 137 3 -1 -0.085059 3.134784 -3.225216 Rho 0.2352422E+00 |GRAD(Rho)| 0.5449913E-12 GRAD(Rho)x 0.1449712E-12 GRAD(Rho)y -0.3682107E-12 GRAD(Rho)z 0.3747263E-12 Laplacian 0.8741383E+00 (-1/4)Del**2(Rho)) -0.2185346E+00 Diamond 0.3005453E+01 Metallicity 0.7066837E+01 Ellipticity 0.2044852E-02 Gb(Abramov) 0.4030811E+00 Vb(Abramov) -0.5876276E+00 Hb(Abramov) -0.1845465E+00 Ex_ueg -0.1072520E+00 Ec_ueg -0.1411084E-01 Delta_ex -0.1049950E+00 Delta_ec 0.1930276E-01 Delta_et -0.2666547E+00 Pxc 0.7600681E+01 Qxc -0.5439377E+01 3,-1 138 3 -1 0.520568 -1.740346 1.738239 Rho 0.4686768E-01 |GRAD(Rho)| 0.2385863E-15 GRAD(Rho)x -0.7045832E-16 GRAD(Rho)y -0.1220193E-15 GRAD(Rho)z 0.1925365E-15 Laplacian 0.1878081E+00 (-1/4)Del**2(Rho)) -0.4695203E-01 Diamond 0.8655950E-01 Metallicity 0.2235397E+01 Ellipticity 0.1675599E-01 Gb(Abramov) 0.4879409E-01 Vb(Abramov) -0.5063615E-01 Hb(Abramov) -0.1842058E-02 Ex_ueg -0.1248005E-01 Ec_ueg -0.2242477E-02 Delta_ex -0.1518016E-01 Delta_ec 0.5545774E-02 Delta_et -0.5748243E-01 Pxc 0.5565298E+01 Qxc -0.2737249E+01 3,-1 139 3 +1 1.974419 -2.051606 2.038537 Rho 0.1181250E-01 |GRAD(Rho)| 0.2060342E-16 GRAD(Rho)x 0.9437148E-17 GRAD(Rho)y -0.3576617E-17 GRAD(Rho)z -0.1796243E-16 Laplacian 0.5368397E-01 (-1/4)Del**2(Rho)) -0.1342099E-01 Diamond 0.1697118E-02 Metallicity 0.7864510E+00 Ellipticity -0.1131999E+01 Gb(Abramov) 0.1070649E-01 Vb(Abramov) -0.7991981E-02 Hb(Abramov) 0.2714505E-02 Ex_ueg -0.1986892E-02 Ec_ueg -0.4509203E-03 Delta_ex -0.2507451E-02 Delta_ec 0.4818184E-03 Delta_et -0.3765529E-02 Pxc 0.4406303E+01 Qxc -0.5204142E+01 3,+1 140 3 +1 1.782439 1.788004 1.793059 Rho 0.1126808E-01 |GRAD(Rho)| 0.6504548E-12 GRAD(Rho)x -0.9447697E-13 GRAD(Rho)y -0.5333966E-12 GRAD(Rho)z 0.3600744E-12 Laplacian 0.5199737E-01 (-1/4)Del**2(Rho)) -0.1299934E-01 Diamond 0.1806808E-02 Metallicity 0.7505537E+00 Ellipticity -0.1256215E+01 Gb(Abramov) 0.1029235E-01 Vb(Abramov) -0.7585349E-02 Hb(Abramov) 0.2706997E-02 Ex_ueg -0.1865743E-02 Ec_ueg -0.4258874E-03 Delta_ex -0.2481073E-02 Delta_ec 0.6162707E-03 Delta_et -0.4596742E-02 Pxc 0.4380835E+01 Qxc -0.4025947E+01 3,+1 141 3 -1 0.092698 3.227905 3.274620 Rho 0.2100014E+00 |GRAD(Rho)| 0.2876924E-13 GRAD(Rho)x -0.4271933E-14 GRAD(Rho)y -0.1965458E-13 GRAD(Rho)z -0.2056981E-13 Laplacian 0.7902418E+00 (-1/4)Del**2(Rho)) -0.1975604E+00 Diamond 0.2376123E+01 Metallicity 0.6469789E+01 Ellipticity 0.2696984E-02 Gb(Abramov) 0.3447360E+00 Vb(Abramov) -0.4919116E+00 Hb(Abramov) -0.1471756E+00 Ex_ueg -0.9218947E-01 Ec_ueg -0.1239010E-01 Delta_ex -0.9220429E-01 Delta_ec 0.1809535E-01 Delta_et -0.2487735E+00 Pxc 0.7440575E+01 Qxc -0.5095470E+01 3,-1 142 3 -1 0.420384 -0.490036 0.452214 Rho 0.1815900E+00 |GRAD(Rho)| 0.1155383E-15 GRAD(Rho)x 0.8673617E-16 GRAD(Rho)y -0.7632783E-16 GRAD(Rho)z 0.0000000E+00 Laplacian 0.4772881E+00 (-1/4)Del**2(Rho)) -0.1193220E+00 Diamond 0.1242373E+01 Metallicity 0.8407221E+01 Ellipticity 0.2606978E-02 Gb(Abramov) 0.2467425E+00 Vb(Abramov) -0.3741629E+00 Hb(Abramov) -0.1274204E+00 Ex_ueg -0.7594648E-01 Ec_ueg -0.1049555E-01 Delta_ex -0.5395103E-01 Delta_ec 0.1188470E-01 Delta_et -0.1629985E+00 Pxc 0.7236064E+01 Qxc -0.4539536E+01 3,-1 143 3 -1 0.432544 0.446183 -0.492208 Rho 0.1834138E+00 |GRAD(Rho)| 0.5760939E-14 GRAD(Rho)x 0.1786765E-14 GRAD(Rho)y 0.4010681E-14 GRAD(Rho)z -0.3729655E-14 Laplacian 0.4884075E+00 (-1/4)Del**2(Rho)) -0.1221019E+00 Diamond 0.1282181E+01 Metallicity 0.8353799E+01 Ellipticity 0.6587526E-02 Gb(Abramov) 0.2514037E+00 Vb(Abramov) -0.3807055E+00 Hb(Abramov) -0.1293018E+00 Ex_ueg -0.7696518E-01 Ec_ueg -0.1061580E-01 Delta_ex -0.5531224E-01 Delta_ec 0.1206892E-01 Delta_et -0.1655284E+00 Pxc 0.7250063E+01 Qxc -0.4583030E+01 3,-1 144 3 +1 1.419230 -2.229209 0.980263 Rho 0.2365781E-01 |GRAD(Rho)| 0.2701953E-16 GRAD(Rho)x 0.1845715E-16 GRAD(Rho)y -0.1954783E-16 GRAD(Rho)z -0.2696510E-17 Laplacian 0.8968146E-01 (-1/4)Del**2(Rho)) -0.2242036E-01 Diamond 0.8730018E-02 Metallicity 0.1498079E+01 Ellipticity -0.1987799E+01 Gb(Abramov) 0.2054482E-01 Vb(Abramov) -0.1866928E-01 Hb(Abramov) 0.1875544E-02 Ex_ueg -0.5015925E-02 Ec_ueg -0.1021377E-02 Delta_ex -0.5245907E-02 Delta_ec 0.1074877E-02 Delta_et -0.9480943E-02 Pxc 0.4910943E+01 Qxc -0.4880474E+01 3,+1 145 3 -1 0.825590 -3.037801 2.056791 Rho 0.1756493E+00 |GRAD(Rho)| 0.5379862E-15 GRAD(Rho)x -0.4160626E-15 GRAD(Rho)y 0.2054021E-15 GRAD(Rho)z 0.2722703E-15 Laplacian 0.6840923E+00 (-1/4)Del**2(Rho)) -0.1710231E+00 Diamond 0.1667519E+01 Metallicity 0.5549355E+01 Ellipticity 0.5049490E-01 Gb(Abramov) 0.2721933E+00 Vb(Abramov) -0.3733636E+00 Hb(Abramov) -0.1011703E+00 Ex_ueg -0.7265190E-01 Ec_ueg -0.1010519E-01 Delta_ex -0.7633657E-01 Delta_ec 0.1655563E-01 Delta_et -0.2244363E+00 Pxc 0.7189564E+01 Qxc -0.4610913E+01 3,-1 146 3 -1 0.853358 1.953992 -3.045215 Rho 0.1752127E+00 |GRAD(Rho)| 0.1523944E-14 GRAD(Rho)x -0.8699367E-15 GRAD(Rho)y 0.1036633E-14 GRAD(Rho)z 0.7007199E-15 Laplacian 0.6810918E+00 (-1/4)Del**2(Rho)) -0.1702729E+00 Diamond 0.1653626E+01 Metallicity 0.5550730E+01 Ellipticity 0.5254136E-01 Gb(Abramov) 0.2710385E+00 Vb(Abramov) -0.3718040E+00 Hb(Abramov) -0.1007655E+00 Ex_ueg -0.7241121E-01 Ec_ueg -0.1007658E-01 Delta_ex -0.7594110E-01 Delta_ec 0.1647029E-01 Delta_et -0.2231513E+00 Pxc 0.7186091E+01 Qxc -0.4610794E+01 3,-1 147 3 +1 3.063339 0.004439 0.000794 Rho 0.4250740E-02 |GRAD(Rho)| 0.2975046E-17 GRAD(Rho)x -0.4142329E-18 GRAD(Rho)y -0.2944659E-17 GRAD(Rho)z 0.9107377E-19 Laplacian 0.1624827E-01 (-1/4)Del**2(Rho)) -0.4062067E-02 Diamond 0.3286488E-03 Metallicity 0.4730572E+00 Ellipticity -0.7823860E+01 Gb(Abramov) 0.3028309E-02 Vb(Abramov) -0.1994552E-02 Hb(Abramov) 0.1033757E-02 Ex_ueg -0.5085548E-03 Ec_ueg -0.1148130E-03 Delta_ex -0.8109069E-03 Delta_ec 0.5610401E-03 Delta_et -0.2881431E-02 Pxc 0.4429420E+01 Qxc -0.1445364E+01 3,+1 148 3 -1 1.146741 -2.342601 -2.044541 Rho 0.4220615E-01 |GRAD(Rho)| 0.4275602E-15 GRAD(Rho)x -0.1958769E-15 GRAD(Rho)y 0.3031238E-15 GRAD(Rho)z 0.2292508E-15 Laplacian 0.1154901E+00 (-1/4)Del**2(Rho)) -0.2887251E-01 Diamond 0.6825401E-01 Metallicity 0.3052775E+01 Ellipticity 0.1496769E-01 Gb(Abramov) 0.3393856E-01 Vb(Abramov) -0.3900460E-01 Hb(Abramov) -0.5066043E-02 Ex_ueg -0.1085307E-01 Ec_ueg -0.1988819E-02 Delta_ex -0.1028697E-01 Delta_ec 0.5543858E-02 Delta_et -0.5621566E-01 Pxc 0.5457044E+01 Qxc -0.1855561E+01 3,-1 149 3 -1 1.180630 -1.799844 -2.638619 Rho 0.3096239E+00 |GRAD(Rho)| 0.5995976E-15 GRAD(Rho)x -0.1002511E-15 GRAD(Rho)y 0.4860051E-15 GRAD(Rho)z -0.3365503E-15 Laplacian -0.1517553E+01 (-1/4)Del**2(Rho)) 0.3793883E+00 Diamond 0.5164620E+01 Metallicity -0.6434678E+01 Ellipticity 0.1993166E-02 Gb(Abramov) 0.1539480E+00 Vb(Abramov) -0.6872844E+00 Hb(Abramov) -0.5333363E+00 Ex_ueg -0.1547027E+00 Ec_ueg -0.1938497E-01 Delta_ex 0.1489232E+00 Delta_ec 0.5340203E-01 Delta_et -0.1248957E+01 Pxc 0.7980545E+01 Qxc 0.2788717E+01 3,-1 150 3 -1 0.829059 -1.983615 3.043283 Rho 0.1587017E+00 |GRAD(Rho)| 0.2656246E-14 GRAD(Rho)x -0.2021387E-14 GRAD(Rho)y -0.1451327E-14 GRAD(Rho)z -0.9291342E-15 Laplacian 0.6210567E+00 (-1/4)Del**2(Rho)) -0.1552642E+00 Diamond 0.1345418E+01 Metallicity 0.5161602E+01 Ellipticity 0.5687582E-01 Gb(Abramov) 0.2370781E+00 Vb(Abramov) -0.3188920E+00 Hb(Abramov) -0.8181393E-01 Ex_ueg -0.6345909E-01 Ec_ueg -0.9002855E-02 Delta_ex -0.6761766E-01 Delta_ec 0.1551441E-01 Delta_et -0.2080406E+00 Pxc 0.7048774E+01 Qxc -0.4358377E+01 3,-1 151 3 -1 0.839075 2.996987 -2.030794 Rho 0.1670873E+00 |GRAD(Rho)| 0.1027293E-15 GRAD(Rho)x 0.6342583E-16 GRAD(Rho)y 0.3796063E-16 GRAD(Rho)z -0.7134050E-16 Laplacian 0.6490804E+00 (-1/4)Del**2(Rho)) -0.1622701E+00 Diamond 0.1493103E+01 Metallicity 0.5381300E+01 Ellipticity 0.4639296E-01 Gb(Abramov) 0.2537174E+00 Vb(Abramov) -0.3451647E+00 Hb(Abramov) -0.9144732E-01 Ex_ueg -0.6796882E-01 Ec_ueg -0.9546177E-02 Delta_ex -0.7155549E-01 Delta_ec 0.1596116E-01 Delta_et -0.2152898E+00 Pxc 0.7120005E+01 Qxc -0.4483101E+01 3,-1 152 3 -1 1.735378 -0.545557 1.718823 Rho 0.4058280E-01 |GRAD(Rho)| 0.3741132E-16 GRAD(Rho)x 0.3360455E-16 GRAD(Rho)y -0.1418145E-17 GRAD(Rho)z 0.1638077E-16 Laplacian 0.1602035E+00 (-1/4)Del**2(Rho)) -0.4005088E-01 Diamond 0.5985377E-01 Metallicity 0.2061474E+01 Ellipticity 0.6274095E-01 Gb(Abramov) 0.4046123E-01 Vb(Abramov) -0.4087157E-01 Hb(Abramov) -0.4103480E-03 Ex_ueg -0.1030009E-01 Ec_ueg -0.1901353E-02 Delta_ex -0.1244291E-01 Delta_ec 0.4648614E-02 Delta_et -0.4636312E-01 Pxc 0.5417243E+01 Qxc -0.2676691E+01 3,-1 153 3 +1 1.530443 0.905292 -2.195249 Rho 0.2300726E-01 |GRAD(Rho)| 0.4553106E-13 GRAD(Rho)x 0.3403915E-13 GRAD(Rho)y -0.1997212E-13 GRAD(Rho)z -0.2270525E-13 Laplacian 0.8758290E-01 (-1/4)Del**2(Rho)) -0.2189573E-01 Diamond 0.7819227E-02 Metallicity 0.1464318E+01 Ellipticity -0.1826120E+01 Gb(Abramov) 0.1994087E-01 Vb(Abramov) -0.1798601E-01 Hb(Abramov) 0.1954859E-02 Ex_ueg -0.4832868E-02 Ec_ueg -0.9889157E-03 Delta_ex -0.5037009E-02 Delta_ec 0.9667058E-03 Delta_et -0.8510186E-02 Pxc 0.4887037E+01 Qxc -0.5210488E+01 3,+1 154 3 -1 1.746510 -2.913246 -0.646706 Rho 0.1733874E+00 |GRAD(Rho)| 0.8994029E-14 GRAD(Rho)x -0.7092363E-14 GRAD(Rho)y 0.5525718E-14 GRAD(Rho)z -0.2395545E-15 Laplacian 0.6846343E+00 (-1/4)Del**2(Rho)) -0.1711586E+00 Diamond 0.1645804E+01 Metallicity 0.5426463E+01 Ellipticity 0.6981435E-02 Gb(Abramov) 0.2689034E+00 Vb(Abramov) -0.3666481E+00 Hb(Abramov) -0.9774477E-01 Ex_ueg -0.7140714E-01 Ec_ueg -0.9957092E-02 Delta_ex -0.7617140E-01 Delta_ec 0.1666516E-01 Delta_et -0.2257163E+00 Pxc 0.7171486E+01 Qxc -0.4570698E+01 3,-1 155 3 -1 1.925787 -3.077623 0.840318 Rho 0.9002614E-01 |GRAD(Rho)| 0.1610421E-15 GRAD(Rho)x 0.1415460E-15 GRAD(Rho)y 0.3796740E-16 GRAD(Rho)z 0.6676653E-16 Laplacian 0.3777952E+00 (-1/4)Del**2(Rho)) -0.9444881E-01 Diamond 0.4318045E+00 Metallicity 0.3298408E+01 Ellipticity 0.5043133E-02 Gb(Abramov) 0.1148877E+00 Vb(Abramov) -0.1353265E+00 Hb(Abramov) -0.2043885E-01 Ex_ueg -0.2979956E-01 Ec_ueg -0.4724942E-02 Delta_ex -0.3628616E-01 Delta_ec 0.1140743E-01 Delta_et -0.1393264E+00 Pxc 0.6306864E+01 Qxc -0.3180924E+01 3,-1 156 3 +1 1.919848 -1.849804 -1.775706 Rho 0.1306971E-01 |GRAD(Rho)| 0.2062088E-16 GRAD(Rho)x 0.1903141E-16 GRAD(Rho)y 0.2228003E-17 GRAD(Rho)z 0.7619844E-17 Laplacian 0.5375750E-01 (-1/4)Del**2(Rho)) -0.1343937E-01 Diamond 0.2224478E-02 Metallicity 0.9295741E+00 Ellipticity -0.1405680E+01 Gb(Abramov) 0.1104173E-01 Vb(Abramov) -0.8644090E-02 Hb(Abramov) 0.2397642E-02 Ex_ueg -0.2273734E-02 Ec_ueg -0.5091730E-03 Delta_ex -0.2651909E-02 Delta_ec 0.6068867E-03 Delta_et -0.4712775E-02 Pxc 0.4465543E+01 Qxc -0.4369694E+01 3,+1 157 3 -1 1.677025 -1.789462 0.453184 Rho 0.3756693E-01 |GRAD(Rho)| 0.1871893E-16 GRAD(Rho)x 0.1082381E-16 GRAD(Rho)y 0.1500011E-16 GRAD(Rho)z -0.2870595E-17 Laplacian 0.1578733E+00 (-1/4)Del**2(Rho)) -0.3946833E-01 Diamond 0.5873896E-01 Metallicity 0.1839277E+01 Ellipticity 0.1986249E-01 Gb(Abramov) 0.3841108E-01 Vb(Abramov) -0.3735384E-01 Hb(Abramov) 0.1057242E-02 Ex_ueg -0.9292358E-02 Ec_ueg -0.1740130E-02 Delta_ex -0.1238438E-01 Delta_ec 0.5218378E-02 Delta_et -0.5102564E-01 Pxc 0.5340037E+01 Qxc -0.2373223E+01 3,-1 158 3 +3 1.892450 -1.965928 1.938874 Rho 0.1176694E-01 |GRAD(Rho)| 0.2439397E-16 GRAD(Rho)x 0.9973283E-17 GRAD(Rho)y 0.2217256E-16 GRAD(Rho)z 0.1994215E-17 Laplacian 0.5307954E-01 (-1/4)Del**2(Rho)) -0.1326989E-01 Diamond 0.1323656E-02 Metallicity 0.7902996E+00 Ellipticity -0.8040841E+00 Gb(Abramov) 0.1059445E-01 Vb(Abramov) -0.7919024E-02 Hb(Abramov) 0.2675431E-02 Ex_ueg -0.1976680E-02 Ec_ueg -0.4488208E-03 Delta_ex -0.2374111E-02 Delta_ec 0.2934500E-03 Delta_et -0.2496933E-02 Pxc 0.4404163E+01 Qxc -0.8090342E+01 3,+3 159 3 -1 1.743656 1.729896 -0.534289 Rho 0.3676759E-01 |GRAD(Rho)| 0.8154220E-13 GRAD(Rho)x 0.5352826E-13 GRAD(Rho)y 0.5577468E-13 GRAD(Rho)z 0.2594304E-13 Laplacian 0.1544937E+00 (-1/4)Del**2(Rho)) -0.3862342E-01 Diamond 0.5508796E-01 Metallicity 0.1813334E+01 Ellipticity 0.3489552E-01 Gb(Abramov) 0.3742180E-01 Vb(Abramov) -0.3622019E-01 Hb(Abramov) 0.1201615E-02 Ex_ueg -0.9029671E-02 Ec_ueg -0.1697687E-02 Delta_ex -0.1200869E-01 Delta_ec 0.5021552E-02 Delta_et -0.4880364E-01 Pxc 0.5318807E+01 Qxc -0.2391429E+01 3,-1 160 3 -1 1.975951 3.037324 -0.881139 Rho 0.1018021E+00 |GRAD(Rho)| 0.1344803E-15 GRAD(Rho)x -0.1033245E-15 GRAD(Rho)y 0.5955658E-16 GRAD(Rho)z -0.6214511E-16 Laplacian 0.4201816E+00 (-1/4)Del**2(Rho)) -0.1050454E+00 Diamond 0.5547654E+00 Metallicity 0.3640021E+01 Ellipticity 0.4036100E-02 Gb(Abramov) 0.1337582E+00 Vb(Abramov) -0.1624709E+00 Hb(Abramov) -0.2871278E-01 Ex_ueg -0.3510702E-01 Ec_ueg -0.5434344E-02 Delta_ex -0.4146600E-01 Delta_ec 0.1229068E-01 Delta_et -0.1539957E+00 Pxc 0.6460212E+01 Qxc -0.3373775E+01 3,-1 161 3 -1 1.833123 2.850635 0.576360 Rho 0.1214035E+00 |GRAD(Rho)| 0.2889337E-15 GRAD(Rho)x -0.2590837E-15 GRAD(Rho)y 0.1040699E-15 GRAD(Rho)z 0.7434916E-16 Laplacian 0.5232269E+00 (-1/4)Del**2(Rho)) -0.1308067E+00 Diamond 0.8435600E+00 Metallicity 0.3920203E+01 Ellipticity 0.2230134E-01 Gb(Abramov) 0.1726693E+00 Vb(Abramov) -0.2145319E+00 Hb(Abramov) -0.4186258E-01 Ex_ueg -0.4439766E-01 Ec_ueg -0.6638934E-02 Delta_ex -0.5366199E-01 Delta_ec 0.1447019E-01 Delta_et -0.1872005E+00 Pxc 0.6687469E+01 Qxc -0.3708451E+01 3,-1 162 3 -1 1.834255 0.534447 2.808573 Rho 0.1360058E+00 |GRAD(Rho)| 0.4886850E-15 GRAD(Rho)x 0.2987248E-15 GRAD(Rho)y -0.3667585E-15 GRAD(Rho)z -0.1227385E-15 Laplacian 0.5627078E+00 (-1/4)Del**2(Rho)) -0.1406769E+00 Diamond 0.1008000E+01 Metallicity 0.4404799E+01 Ellipticity 0.1697745E-01 Gb(Abramov) 0.1970602E+00 Vb(Abramov) -0.2534435E+00 Hb(Abramov) -0.5638329E-01 Ex_ueg -0.5165691E-01 Ec_ueg -0.7553796E-02 Delta_ex -0.5893593E-01 Delta_ec 0.1450707E-01 Delta_et -0.1901184E+00 Pxc 0.6838536E+01 Qxc -0.4062564E+01 3,-1 163 3 -1 2.045343 0.808373 -3.042076 Rho 0.8771198E-01 |GRAD(Rho)| 0.1558805E-13 GRAD(Rho)x 0.3595120E-14 GRAD(Rho)y 0.1516780E-13 GRAD(Rho)z 0.1213968E-16 Laplacian 0.3656991E+00 (-1/4)Del**2(Rho)) -0.9142477E-01 Diamond 0.4045323E+00 Metallicity 0.3262778E+01 Ellipticity 0.1892376E-01 Gb(Abramov) 0.1106663E+00 Vb(Abramov) -0.1299078E+00 Hb(Abramov) -0.1924152E-01 Ex_ueg -0.2878262E-01 Ec_ueg -0.4586909E-02 Delta_ex -0.3490852E-01 Delta_ec 0.1108429E-01 Delta_et -0.1345901E+00 Pxc 0.6274949E+01 Qxc -0.3149369E+01 3,-1 164 3 -1 2.940792 -2.064402 0.832681 Rho 0.7874007E-01 |GRAD(Rho)| 0.1143835E-15 GRAD(Rho)x 0.6687156E-16 GRAD(Rho)y -0.5583641E-17 GRAD(Rho)z -0.9263152E-16 Laplacian 0.3284345E+00 (-1/4)Del**2(Rho)) -0.8210861E-01 Diamond 0.3149610E+00 Metallicity 0.3034991E+01 Ellipticity 0.2170229E-01 Gb(Abramov) 0.9627223E-01 Vb(Abramov) -0.1104359E+00 Hb(Abramov) -0.1416362E-01 Ex_ueg -0.2492563E-01 Ec_ueg -0.4056358E-02 Delta_ex -0.3051310E-01 Delta_ec 0.1001457E-01 Delta_et -0.1185449E+00 Pxc 0.6144830E+01 Qxc -0.3046871E+01 3,-1 165 3 -1 2.859153 -1.903377 -0.646107 Rho 0.1256971E+00 |GRAD(Rho)| 0.1332718E-15 GRAD(Rho)x -0.6691560E-16 GRAD(Rho)y -0.1114289E-15 GRAD(Rho)z 0.2944964E-16 Laplacian 0.5302774E+00 (-1/4)Del**2(Rho)) -0.1325693E+00 Diamond 0.8909415E+00 Metallicity 0.4098756E+01 Ellipticity 0.1497572E-01 Gb(Abramov) 0.1789411E+00 Vb(Abramov) -0.2253129E+00 Hb(Abramov) -0.4637179E-01 Ex_ueg -0.4650347E-01 Ec_ueg -0.6906451E-02 Delta_ex -0.5483004E-01 Delta_ec 0.1453712E-01 Delta_et -0.1892081E+00 Pxc 0.6733338E+01 Qxc -0.3771726E+01 3,-1 166 3 -1 2.849914 1.842947 0.613774 Rho 0.1108499E+00 |GRAD(Rho)| 0.3263945E-14 GRAD(Rho)x -0.1176969E-14 GRAD(Rho)y 0.2460312E-14 GRAD(Rho)z -0.1793026E-14 Laplacian 0.4787517E+00 (-1/4)Del**2(Rho)) -0.1196879E+00 Diamond 0.7004719E+00 Metallicity 0.3681814E+01 Ellipticity 0.1776541E-01 Gb(Abramov) 0.1532367E+00 Vb(Abramov) -0.1867855E+00 Hb(Abramov) -0.3354880E-01 Ex_ueg -0.3932773E-01 Ec_ueg -0.5986863E-02 Delta_ex -0.4818872E-01 Delta_ec 0.1374631E-01 Delta_et -0.1751843E+00 Pxc 0.6569005E+01 Qxc -0.3505575E+01 3,-1 167 3 -1 2.996654 -0.876543 2.036054 Rho 0.1756667E+00 |GRAD(Rho)| 0.3715281E-15 GRAD(Rho)x -0.1519238E-15 GRAD(Rho)y 0.1745294E-15 GRAD(Rho)z 0.2906746E-15 Laplacian 0.6878974E+00 (-1/4)Del**2(Rho)) -0.1719744E+00 Diamond 0.1670113E+01 Metallicity 0.5519568E+01 Ellipticity 0.4701940E-01 Gb(Abramov) 0.2728536E+00 Vb(Abramov) -0.3737328E+00 Hb(Abramov) -0.1008792E+00 Ex_ueg -0.7266147E-01 Ec_ueg -0.1010633E-01 Delta_ex -0.7670757E-01 Delta_ec 0.1654816E-01 Delta_et -0.2240494E+00 Pxc 0.7189702E+01 Qxc -0.4635413E+01 3,-1 168 3 -1 2.963267 -0.642575 -1.844324 Rho 0.1364747E+00 |GRAD(Rho)| 0.1100293E-15 GRAD(Rho)x -0.7859788E-16 GRAD(Rho)y 0.4458781E-16 GRAD(Rho)z 0.6277531E-16 Laplacian 0.5657950E+00 (-1/4)Del**2(Rho)) -0.1414488E+00 Diamond 0.1051109E+01 Metallicity 0.4405966E+01 Ellipticity 0.2835898E-01 Gb(Abramov) 0.1981689E+00 Vb(Abramov) -0.2548891E+00 Hb(Abramov) -0.5672015E-01 Ex_ueg -0.5189451E-01 Ec_ueg -0.7583407E-02 Delta_ex -0.5968602E-01 Delta_ec 0.1524786E-01 Delta_et -0.2012937E+00 Pxc 0.6843165E+01 Qxc -0.3914386E+01 3,-1 169 3 -1 2.849994 0.576132 1.851652 Rho 0.1590550E+00 |GRAD(Rho)| 0.6232076E-13 GRAD(Rho)x -0.1124712E-13 GRAD(Rho)y -0.4080173E-13 GRAD(Rho)z 0.4574493E-13 Laplacian 0.6530086E+00 (-1/4)Del**2(Rho)) -0.1632521E+00 Diamond 0.1412775E+01 Metallicity 0.4927270E+01 Ellipticity 0.1448958E-01 Gb(Abramov) 0.2428993E+00 Vb(Abramov) -0.3225465E+00 Hb(Abramov) -0.7964718E-01 Ex_ueg -0.6364750E-01 Ec_ueg -0.9025660E-02 Delta_ex -0.7108360E-01 Delta_ec 0.1621058E-01 Delta_et -0.2172046E+00 Pxc 0.7051840E+01 Qxc -0.4385013E+01 3,-1 170 3 -1 3.229471 0.029451 3.235115 Rho 0.2338930E+00 |GRAD(Rho)| 0.1027850E-14 GRAD(Rho)x -0.5826502E-15 GRAD(Rho)y -0.1927034E-15 GRAD(Rho)z -0.8245358E-15 Laplacian 0.8521027E+00 (-1/4)Del**2(Rho)) -0.2130257E+00 Diamond 0.2924684E+01 Metallicity 0.7180422E+01 Ellipticity 0.6606844E-02 Gb(Abramov) 0.3969529E+00 Vb(Abramov) -0.5808800E+00 Hb(Abramov) -0.1839272E+00 Ex_ueg -0.1064326E+00 Ec_ueg -0.1401798E-01 Delta_ex -0.1022786E+00 Delta_ec 0.1899757E-01 Delta_et -0.2630251E+00 Pxc 0.7592580E+01 Qxc -0.5383774E+01 3,-1 171 3 -1 3.101240 0.851502 -2.021725 Rho 0.1190593E+00 |GRAD(Rho)| 0.8578467E-14 GRAD(Rho)x 0.3511297E-14 GRAD(Rho)y -0.3541899E-14 GRAD(Rho)z -0.6979673E-14 Laplacian 0.4929452E+00 (-1/4)Del**2(Rho)) -0.1232363E+00 Diamond 0.7746456E+00 Metallicity 0.4027973E+01 Ellipticity 0.8639964E-02 Gb(Abramov) 0.1648896E+00 Vb(Abramov) -0.2065429E+00 Hb(Abramov) -0.4165332E-01 Ex_ueg -0.4325829E-01 Ec_ueg -0.6493409E-02 Delta_ex -0.5030087E-01 Delta_ec 0.1365344E-01 Delta_et -0.1759498E+00 Pxc 0.6661877E+01 Qxc -0.3684116E+01 3,-1 172 3 -1 3.151639 -3.360295 -0.113327 Rho 0.2042984E+00 |GRAD(Rho)| 0.4888974E-15 GRAD(Rho)x -0.4099368E-15 GRAD(Rho)y 0.2305556E-15 GRAD(Rho)z -0.1334788E-15 Laplacian 0.7651776E+00 (-1/4)Del**2(Rho)) -0.1912944E+00 Diamond 0.2235334E+01 Metallicity 0.6382035E+01 Ellipticity 0.8080498E-02 Gb(Abramov) 0.3310042E+00 Vb(Abramov) -0.4707140E+00 Hb(Abramov) -0.1397098E+00 Ex_ueg -0.8886655E-01 Ec_ueg -0.1200618E-01 Delta_ex -0.8871340E-01 Delta_ec 0.1776802E-01 Delta_et -0.2442042E+00 Pxc 0.7401733E+01 Qxc -0.4992870E+01 3,-1 173 3 -1 3.050870 2.043953 -0.864941 Rho 0.1363026E+00 |GRAD(Rho)| 0.1406701E-15 GRAD(Rho)x 0.6965999E-17 GRAD(Rho)y -0.3489776E-16 GRAD(Rho)z 0.1360945E-15 Laplacian 0.5566177E+00 (-1/4)Del**2(Rho)) -0.1391544E+00 Diamond 0.1023443E+01 Metallicity 0.4469199E+01 Ellipticity 0.1342673E-01 Gb(Abramov) 0.1964211E+00 Vb(Abramov) -0.2536877E+00 Hb(Abramov) -0.5726666E-01 Ex_ueg -0.5180725E-01 Ec_ueg -0.7572535E-02 Delta_ex -0.5859763E-01 Delta_ec 0.1482216E-01 Delta_et -0.1952808E+00 Pxc 0.6841467E+01 Qxc -0.3953379E+01 3,-1 174 3 -1 3.249281 3.285979 0.054346 Rho 0.2117689E+00 |GRAD(Rho)| 0.2630591E-14 GRAD(Rho)x 0.1886024E-14 GRAD(Rho)y -0.1655577E-14 GRAD(Rho)z -0.7886622E-15 Laplacian 0.7891780E+00 (-1/4)Del**2(Rho)) -0.1972945E+00 Diamond 0.2403722E+01 Metallicity 0.6569645E+01 Ellipticity 0.8333195E-02 Gb(Abramov) 0.3475554E+00 Vb(Abramov) -0.4978164E+00 Hb(Abramov) -0.1502610E+00 Ex_ueg -0.9322549E-01 Ec_ueg -0.1250945E-01 Delta_ex -0.9232153E-01 Delta_ec 0.1810449E-01 Delta_et -0.2493224E+00 Pxc 0.7452404E+01 Qxc -0.5099372E+01 3,-1 175 3 -1 3.383823 -0.051137 -3.270727 Rho 0.2089133E+00 |GRAD(Rho)| 0.2503127E-15 GRAD(Rho)x 0.2136962E-15 GRAD(Rho)y 0.2602085E-17 GRAD(Rho)z -0.1303211E-15 Laplacian 0.7746943E+00 (-1/4)Del**2(Rho)) -0.1936736E+00 Diamond 0.2324952E+01 Metallicity 0.6542740E+01 Ellipticity 0.6577609E-02 Gb(Abramov) 0.3403084E+00 Vb(Abramov) -0.4869431E+00 Hb(Abramov) -0.1466348E+00 Ex_ueg -0.9155313E-01 Ec_ueg -0.1231671E-01 Delta_ex -0.9033413E-01 Delta_ec 0.1788041E-01 Delta_et -0.2461589E+00 Pxc 0.7433245E+01 Qxc -0.5052129E+01 3,-1 176 3 -1 -2.811502 1.783098 -0.504680 Rho 0.1230601E+00 |GRAD(Rho)| 0.4881839E-14 GRAD(Rho)x 0.2762523E-14 GRAD(Rho)y 0.2388375E-14 GRAD(Rho)z 0.3239826E-14 Laplacian 0.5143908E+00 (-1/4)Del**2(Rho)) -0.1285977E+00 Diamond 0.8229908E+00 Metallicity 0.4078643E+01 Ellipticity 0.1400831E-01 Gb(Abramov) 0.1731491E+00 Vb(Abramov) -0.2177006E+00 Hb(Abramov) -0.4455144E-01 Ex_ueg -0.4520727E-01 Ec_ueg -0.6742002E-02 Delta_ex -0.5266688E-01 Delta_ec 0.1371940E-01 Delta_et -0.1771535E+00 Pxc 0.6705318E+01 Qxc -0.3838861E+01 3,-1 177 3 +1 -1.487954 -1.979289 -1.953229 Rho 0.1109900E-01 |GRAD(Rho)| 0.1009008E-16 GRAD(Rho)x 0.1033251E-17 GRAD(Rho)y 0.2953394E-17 GRAD(Rho)z 0.9592685E-17 Laplacian 0.4902401E-01 (-1/4)Del**2(Rho)) -0.1225600E-01 Diamond 0.1665500E-02 Metallicity 0.7762668E+00 Ellipticity -0.1296178E+01 Gb(Abramov) 0.9756324E-02 Vb(Abramov) -0.7256644E-02 Hb(Abramov) 0.2499680E-02 Ex_ueg -0.1828509E-02 Ec_ueg -0.4181373E-03 Delta_ex -0.2328850E-02 Delta_ec 0.5793036E-03 Delta_et -0.4306940E-02 Pxc 0.4372987E+01 Qxc -0.4020085E+01 3,+1 178 3 -1 -2.802916 -0.536574 1.840011 Rho 0.1266746E+00 |GRAD(Rho)| 0.2688400E-13 GRAD(Rho)x 0.6849989E-14 GRAD(Rho)y -0.2597426E-13 GRAD(Rho)z 0.1079472E-14 Laplacian 0.5297294E+00 (-1/4)Del**2(Rho)) -0.1324323E+00 Diamond 0.8768745E+00 Metallicity 0.4156315E+01 Ellipticity 0.8518989E-02 Gb(Abramov) 0.1800266E+00 Vb(Abramov) -0.2276209E+00 Hb(Abramov) -0.4759430E-01 Ex_ueg -0.4698629E-01 Ec_ueg -0.6967532E-02 Delta_ex -0.5460662E-01 Delta_ec 0.1401748E-01 Delta_et -0.1818628E+00 Pxc 0.6743606E+01 Qxc -0.3895608E+01 3,-1 179 3 -1 -1.823454 2.735156 -0.542538 Rho 0.1529623E+00 |GRAD(Rho)| 0.3387575E-15 GRAD(Rho)x -0.2355971E-15 GRAD(Rho)y -0.1686951E-15 GRAD(Rho)z 0.1754781E-15 Laplacian 0.6387233E+00 (-1/4)Del**2(Rho)) -0.1596808E+00 Diamond 0.1315767E+01 Metallicity 0.4719988E+01 Ellipticity 0.1706265E-01 Gb(Abramov) 0.2320692E+00 Vb(Abramov) -0.3044575E+00 Hb(Abramov) -0.7238833E-01 Ex_ueg -0.6041769E-01 Ec_ueg -0.8633411E-02 Delta_ex -0.6883291E-01 Delta_ec 0.1596481E-01 Delta_et -0.2127098E+00 Pxc 0.6998126E+01 Qxc -0.4311541E+01 3,-1 180 3 -1 -1.591352 -2.106677 -3.085853 Rho 0.3246478E+00 |GRAD(Rho)| 0.7816451E-15 GRAD(Rho)x -0.2610742E-15 GRAD(Rho)y 0.4407443E-15 GRAD(Rho)z 0.5903845E-15 Laplacian -0.1646767E+01 (-1/4)Del**2(Rho)) 0.4116917E+00 Diamond 0.5816611E+01 Metallicity -0.6417046E+01 Ellipticity 0.2436537E-02 Gb(Abramov) 0.1658463E+00 Vb(Abramov) -0.7433844E+00 Hb(Abramov) -0.5775380E+00 Ex_ueg -0.1647916E+00 Ec_ueg -0.2048739E-01 Delta_ex 0.1650595E+00 Delta_ec 0.5720627E-01 Delta_et -0.1366930E+01 Pxc 0.8043560E+01 Qxc 0.2885338E+01 3,-1 181 3 -1 -0.040976 0.002776 2.980827 Rho 0.5501214E-02 |GRAD(Rho)| 0.1082320E-13 GRAD(Rho)x 0.7035041E-14 GRAD(Rho)y -0.7734225E-14 GRAD(Rho)z 0.2798496E-14 Laplacian 0.2162267E-01 (-1/4)Del**2(Rho)) -0.5405667E-02 Diamond 0.6471642E-03 Metallicity 0.5463464E+00 Ellipticity 0.3341751E+01 Gb(Abramov) 0.4096006E-02 Vb(Abramov) -0.2786345E-02 Hb(Abramov) 0.1309661E-02 Ex_ueg -0.7172377E-03 Ec_ueg -0.1685454E-03 Delta_ex -0.1155535E-02 Delta_ec 0.7886028E-03 Delta_et -0.4364257E-02 Pxc 0.4255456E+01 Qxc -0.1465294E+01 3,-1 182 3 -1 0.591684 2.839461 1.834837 Rho 0.1430228E+00 |GRAD(Rho)| 0.1638344E-13 GRAD(Rho)x -0.6242294E-15 GRAD(Rho)y 0.8639180E-14 GRAD(Rho)z 0.1390655E-13 Laplacian 0.6010693E+00 (-1/4)Del**2(Rho)) -0.1502673E+00 Diamond 0.1175713E+01 Metallicity 0.4484327E+01 Ellipticity 0.1541171E-01 Gb(Abramov) 0.2124862E+00 Vb(Abramov) -0.2747051E+00 Hb(Abramov) -0.6221887E-01 Ex_ueg -0.5524064E-01 Ec_ueg -0.7998378E-02 Delta_ex -0.6406956E-01 Delta_ec 0.1591174E-01 Delta_et -0.2114118E+00 Pxc 0.6906480E+01 Qxc -0.4026559E+01 3,-1 183 3 +1 2.139827 -1.542573 0.953438 Rho 0.2385292E-01 |GRAD(Rho)| 0.5040727E-16 GRAD(Rho)x -0.4761918E-16 GRAD(Rho)y 0.1422739E-16 GRAD(Rho)z -0.8419507E-17 Laplacian 0.8946381E-01 (-1/4)Del**2(Rho)) -0.2236595E-01 Diamond 0.8645728E-02 Metallicity 0.1522422E+01 Ellipticity -0.1959537E+01 Gb(Abramov) 0.2058570E-01 Vb(Abramov) -0.1880545E-01 Hb(Abramov) 0.1780249E-02 Ex_ueg -0.5071157E-02 Ec_ueg -0.1031135E-02 Delta_ex -0.5226347E-02 Delta_ec 0.1038650E-02 Delta_et -0.9189953E-02 Pxc 0.4918032E+01 Qxc -0.5031863E+01 3,+1 184 3 -1 1.975586 -0.846118 3.017752 Rho 0.1138256E+00 |GRAD(Rho)| 0.1497025E-12 GRAD(Rho)x 0.1047333E-12 GRAD(Rho)y -0.7110000E-13 GRAD(Rho)z 0.7991593E-13 Laplacian 0.4442848E+00 (-1/4)Del**2(Rho)) -0.1110712E+00 Diamond 0.6485678E+00 Metallicity 0.4146528E+01 Ellipticity 0.1443304E-01 Gb(Abramov) 0.1508075E+00 Vb(Abramov) -0.1905437E+00 Hb(Abramov) -0.3973625E-01 Ex_ueg -0.4074160E-01 Ec_ueg -0.6169910E-02 Delta_ex -0.4467256E-01 Delta_ec 0.1210220E-01 Delta_et -0.1541879E+00 Pxc 0.6603273E+01 Qxc -0.3691275E+01 3,-1 185 3 -1 1.991450 -0.665069 -2.883665 Rho 0.1312904E+00 |GRAD(Rho)| 0.3406432E-15 GRAD(Rho)x 0.2569559E-15 GRAD(Rho)y 0.2167456E-15 GRAD(Rho)z 0.5507069E-16 Laplacian 0.5141796E+00 (-1/4)Del**2(Rho)) -0.1285449E+00 Diamond 0.9213725E+00 Metallicity 0.4545204E+01 Ellipticity 0.1130750E+00 Gb(Abramov) 0.1830737E+00 Vb(Abramov) -0.2376025E+00 Hb(Abramov) -0.5452882E-01 Ex_ueg -0.4928284E-01 Ec_ueg -0.7256817E-02 Delta_ex -0.5385305E-01 Delta_ec 0.1418798E-01 Delta_et -0.1864750E+00 Pxc 0.6791247E+01 Qxc -0.3795682E+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 80 138 111 109 150 145 131 142 122 143 126 133 135 117 146 151 137 134 119 182 114 118 141 157 165 154 164 155 172 159 166 161 173 160 174 96 176 179 78 80 65 58 77 59 61 93 75 84 72 85 63 82 70 91 178 83 73 92 69 152 169 162 167 184 170 55 168 185 171 163 175 89 67 113 149 181 130 148 180 94 104 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 14 17 21 21 22 28 28 36 37 37 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 21 19 36 54 24 53 54 52 52 53 2.394763 2.010345 1.961651 1.901764 1.863009 1.750862 1.709690 1.693946 1.704660 1.723767 2.357744 2.015532 2.014620 1.863795 1.882132 1.750778 2.418834 1.962531 1.931675 2.086871 2.084315 1.794879 2.477389 1.980607 1.866266 2.175164 2.116059 1.805563 2.487365 2.025200 1.994266 1.958844 2.068912 1.791829 2.366175 1.991821 1.905761 1.960697 1.884213 1.750579 2.318535 1.920213 1.933660 1.935529 1.964205 1.751158 2.325917 1.906947 1.887555 1.999530 1.966504 1.749657 2.396302 1.981479 1.898435 1.969137 1.883303 1.750498 2.455078 1.892118 1.955549 1.863606 2.033988 1.753341 2.528899 1.950453 1.981341 2.011233 2.127710 1.797160 3.331459 3.177409 3.257633 1.004728 3.274259 1.601676 1.745503 0.990946 1.982266 1.037303 2.396737 2.010735 1.962104 1.902318 1.863401 1.750871 1.709711 1.693995 1.704679 1.723775 2.359683 2.015949 2.015033 1.864191 1.882552 1.750788 2.420659 1.962816 1.931856 2.087180 2.084608 1.794881 2.479369 1.980773 1.866370 2.175511 2.116378 1.805590 2.489440 2.025390 1.994464 1.959157 2.069218 1.791835 2.367809 1.992207 1.906199 1.961276 1.884618 1.750589 2.320514 1.920702 1.934101 1.936110 1.965145 1.751173 2.327732 1.907375 1.887935 2.000108 1.967656 1.749668 2.398081 1.981895 1.898880 1.969735 1.883705 1.750508 2.456797 1.892424 1.955888 1.864014 2.034487 1.753352 2.530864 1.950681 1.982142 2.011530 2.128044 1.797170 3.401705 3.182135 3.260719 1.004793 3.278611 1.602298 1.749109 0.991023 1.993279 1.037432 27 30 29 25 23 22 22 22 22 24 27 24 31 23 28 22 27 25 29 28 27 23 29 25 23 27 26 25 29 25 25 27 26 26 31 27 28 27 30 24 30 27 27 28 27 23 30 27 28 28 27 23 31 25 29 27 28 24 29 29 25 24 27 24 32 27 27 29 26 27 37 35 37 20 35 24 23 19 30 19 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 W As W Ta Ta Ta W W W W W Ta O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O H H H 2.4457 2.4906 2.4459 2.2304 2.1185 2.2105 2.4537 2.4521 2.4916 2.4519 2.4281 2.1790 -1.1050 -1.0480 -1.1029 -1.1267 -0.9628 -1.0343 -0.9600 -0.9886 -0.8657 -0.9989 -0.9665 -0.9661 -0.9700 -0.9747 -1.0167 -1.0000 -0.9773 -0.9935 -1.0440 -0.9850 -0.9825 -0.9732 -0.9897 -0.8185 -0.8624 -0.9857 -0.9773 -0.9839 -0.8333 -0.9561 -0.8300 -0.9458 -0.9694 -0.9414 -0.8302 -0.8287 -0.8252 -0.8327 -0.8464 0.2890 0.3250 0.2873 2.0995 0.8352 2.1062 2.1016 2.1329 2.1128 2.0983 2.1092 2.0998 2.0979 2.1089 2.1232 1.9385 1.9412 1.9396 1.9318 1.9311 1.9227 1.9313 1.9281 1.8667 1.9264 1.9323 1.9307 1.9302 1.9288 1.9242 1.9338 1.9412 1.9380 1.9290 1.9386 1.9386 1.9411 1.9395 1.8764 1.8804 1.9398 1.9403 1.9388 1.9587 1.9391 1.9590 1.9409 1.9373 1.9417 1.9588 1.9586 1.9588 1.9590 1.9579 0.5772 0.5070 0.5524 6.0924 1.1278 6.0934 6.0711 6.0979 6.0826 6.0911 6.0989 6.0833 6.0907 6.1022 6.0935 5.1299 5.0685 5.1273 5.1584 5.0024 5.0864 4.9991 5.0330 4.9716 5.0462 5.0048 5.0064 5.0113 5.0164 5.0676 5.0398 5.0081 5.0247 5.0900 5.0162 5.0132 5.0032 5.0211 4.9119 4.9528 5.0165 5.0070 5.0152 4.8412 4.9911 4.8376 4.9787 5.0070 4.9730 4.8381 4.8369 4.8330 4.8404 4.8556 0.1338 0.1680 0.1603 3.3329 10.5463 3.3253 2.5625 2.6177 2.5599 3.3274 3.3101 3.2956 3.3300 3.3316 2.5706 0.0366 0.0383 0.0360 0.0366 0.0293 0.0251 0.0296 0.0275 0.0275 0.0263 0.0293 0.0290 0.0284 0.0295 0.0248 0.0264 0.0280 0.0308 0.0250 0.0302 0.0307 0.0290 0.0292 0.0301 0.0293 0.0294 0.0300 0.0299 0.0334 0.0259 0.0334 0.0263 0.0251 0.0267 0.0334 0.0332 0.0334 0.0334 0.0329 0.0000 0.0000 0.0000 14.0295 0.0000 14.0293 14.0344 14.0330 14.0341 14.0296 14.0296 14.0297 14.0296 14.0293 14.0337 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 W As W Ta Ta Ta W W W W W Ta O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O H H H 2.503664 2.316264 2.504063 2.358522 2.324295 2.361695 2.503720 2.519119 2.526324 2.501612 2.493894 2.353000 -1.091724 -1.037634 -1.093927 -1.102798 -0.978929 -1.053796 -0.976710 -1.008221 -0.715913 -1.021289 -0.968853 -0.979337 -0.982528 -0.979535 -1.045644 -0.867702 -0.990101 -0.970271 -1.058044 -0.977383 -0.975990 -0.975324 -0.989900 -0.637367 -0.642530 -0.985247 -0.981898 -0.984578 -0.877322 -1.048135 -0.874081 -1.031299 -1.067517 -1.025512 -0.874902 -0.873702 -0.867148 -0.877209 -0.893409 0.051866 0.048492 0.016880 1.932899 1.720345 1.942329 1.835110 1.812427 1.845521 1.929495 1.938215 1.947033 1.927840 1.930918 1.860255 -0.723006 -0.689490 -0.729594 -0.734106 -0.736025 -0.830484 -0.734732 -0.780221 -0.893752 -0.768209 -0.717651 -0.742172 -0.735734 -0.719242 -0.806023 -0.781798 -0.840935 -0.811885 -0.887084 -0.810533 -0.813378 -0.807981 -0.841172 -0.824176 -0.827135 -0.838031 -0.827632 -0.832209 -0.790135 -0.980196 -0.784625 -0.968688 -1.008608 -0.964590 -0.786500 -0.775614 -0.767099 -0.789589 -0.809806 0.346495 0.258484 0.282476 2.037107 1.668208 2.042927 1.949019 1.917776 1.964912 2.034240 2.059991 2.069670 2.036204 2.043517 1.966764 -0.787347 -0.776841 -0.795950 -0.797637 -0.814771 -0.916017 -0.810484 -0.861019 -0.896815 -0.856498 -0.800873 -0.819368 -0.822954 -0.825932 -0.891969 -0.868428 -0.868166 -0.860429 -0.944172 -0.846355 -0.839637 -0.836678 -0.865685 -0.851024 -0.849101 -0.861820 -0.854378 -0.856152 -0.757601 -0.966796 -0.754954 -0.945889 -0.985816 -0.938951 -0.754757 -0.758993 -0.762208 -0.756064 -0.775473 0.442893 0.299902 0.300875 -14.98429420 -3.85272605 -1.96226872 15.59561057 -22.99477099 5.39814428 19.85450150 6.55655507 -4.58111476 16.43821591 -373.8183 420.1463 -18.0684 -423.9960 -75.9254 -471.6618 Jun19-2024 22:18:48 Nodes: 1 Procs: 1 Jun19-2024 22:18:50 Nodes: 1 Procs: 1 0 Jun19-2024 22:18:53 Nodes: 1 Procs: 1 Jun19-2024 22:18:55 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun19-2024 22:18:58 Nodes: 1 Procs: 1 Jun19-2024 22:19:01 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun19-2024 22:19:05 Nodes: 1 Procs: 1 Jun19-2024 22:19:06 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun19-2024 22:19:08 Nodes: 1 Procs: 1 Jun19-2024 22:19:11 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Jun19-2024 22:19:16 Nodes: 1 Procs: 5 *** (NO TITLE) *** -8 -16.83255875 -17.16277496 -17.19223096 -17.18254208 -17.25620983 -17.28894973 -17.30007555 -17.30841055 -17.31907225 -17.32516379 -17.32705834 -17.33049277 -17.33166979 -17.33223008 -17.33273597 -17.33295907 -17.33308875 -17.33314092 -17.33320363 -17.33323729 -17.33325216 GEOMETRY CONVERGED