ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 10:53:11 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.56 0.02 2.33 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 Jun20-2024 10:53:11 Nodes: 1 Procs: 1 Jun20-2024 10:53:13 Nodes: 1 Procs: 1 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 10:53:17 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.01 0.04 2.89 1 2 3 1 2 3 1 2 3 4 2.000 0.000 0.000 3.000 0.000 0.000 10.000 0.000 0.000 0.000 -14.453 3.868 46.848 -5.206 2.716 28.135 -40.711 6.242 57.060 417.392 S S S P P P D D D D D S P P S D P S D D 1 1 1 2 2 2 3 3 3 4 10.00 2.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -40.7110 -14.4532 -5.2063 2.7160 3.8682 6.2422 28.1350 46.8475 57.0600 417.3918 1 As 0.0000 2.0000 3.0000 10.0000 0.0000 Jun20-2024 10:53:11 Nodes: 1 Procs: 1 Jun20-2024 10:53:13 Nodes: 1 Procs: 1 0 Jun20-2024 10:53:17 Nodes: 1 Procs: 1 Jun20-2024 10:53:20 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 10:53:24 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.81 0.05 4.26 1 2 3 4 5 6 1 2 3 4 1 2 3 1 2 3 2.000 2.000 0.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 3.000 0.000 0.000 14.000 0.000 0.000 -72.755 -5.438 1.149 14.442 84.369 82466.595 -39.462 -0.588 19.371 119.253 -3.592 3.193 26.757 -25.167 53.137 407.274 S S S S S S P P P P D D D F F F S P F S D P S D S P D F S P F S 1 1 1 2 1 2 3 2 4 3 3 2 5 4 3 6 2.00 6.00 14.00 2.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -72.7547 -39.4619 -25.1674 -5.4383 -3.5916 -0.5880 1.1490 3.1925 14.4417 19.3711 26.7574 53.1371 84.3692 119.2525 407.2740 82466.5951 1 Ta -0.0000 4.0000 6.0000 3.0000 14.0000 Jun20-2024 10:53:11 Nodes: 1 Procs: 1 Jun20-2024 10:53:13 Nodes: 1 Procs: 1 0 Jun20-2024 10:53:17 Nodes: 1 Procs: 1 Jun20-2024 10:53:20 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 10:53:24 Nodes: 1 Procs: 1 Jun20-2024 10:53:28 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 10:53:33 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.68 0.05 2.73 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 Jun20-2024 10:53:11 Nodes: 1 Procs: 1 Jun20-2024 10:53:13 Nodes: 1 Procs: 1 0 Jun20-2024 10:53:17 Nodes: 1 Procs: 1 Jun20-2024 10:53:20 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 10:53:24 Nodes: 1 Procs: 1 Jun20-2024 10:53:28 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 10:53:33 Nodes: 1 Procs: 1 Jun20-2024 10:53:37 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 10:53:40 Hydrogen (TZP) c10-51 c10-51 c10-51 c10-51 c10-51 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.80 0.05 2.41 1 2 3 4 5 6 1 2 3 4 1 2 3 1 2 3 2.000 2.000 0.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 4.000 0.000 0.000 14.000 0.000 0.000 -78.652 -5.688 1.231 15.256 90.545 82874.614 -43.195 -0.500 20.662 126.921 -4.498 4.055 33.318 -33.668 62.370 473.510 S S S S S S P P P P D D D F F F S P F S D P S D S P D F S P F S 1 1 1 2 1 2 3 2 4 3 3 2 5 4 3 6 2.00 6.00 14.00 2.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -78.6522 -43.1946 -33.6680 -5.6882 -4.4976 -0.5002 1.2309 4.0549 15.2562 20.6620 33.3183 62.3697 90.5446 126.9207 473.5096 82874.6143 1 W -0.0000 4.0000 6.0000 4.0000 14.0000 Jun20-2024 10:53:11 Nodes: 1 Procs: 1 Jun20-2024 10:53:13 Nodes: 1 Procs: 1 0 Jun20-2024 10:53:17 Nodes: 1 Procs: 1 Jun20-2024 10:53:20 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 10:53:24 Nodes: 1 Procs: 1 Jun20-2024 10:53:28 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 10:53:33 Nodes: 1 Procs: 1 Jun20-2024 10:53:37 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun20-2024 10:53:40 Nodes: 1 Procs: 1 Jun20-2024 10:53:42 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 10:53:49 Hydrogen (TZP) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP TZP 2703.7856000000056 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PW92 == Not Default == Restricted Restricted Point Charge Nuclei Frozen Orbital(s) 3 1 1.93000 78.39000 conjugate-gradient 1000 1.0E-08 0.00000 t21.Ta ADF 2019.304 Jun20-2024 10:53:28 1 1 Tantalum TZP 4d t21.As ADF 2019.304 Jun20-2024 10:53:20 1 1 Arsenic TZP 3p t21.W ADF 2019.304 Jun20-2024 10:53:42 1 1 Tungsten TZP 4d t21.O ADF 2019.304 Jun20-2024 10:53:37 1 1 Oxygen TZP 1s t21.H ADF 2019.304 Jun20-2024 10:53:13 1 1 Hydrogen TZP 1 1 -17.11509356 0.26354146 0.00100000 F 0.08633440 0.00066667 F 0.26354146 0.08633440 0.30169254 0.01000000 F 0.07380051 0.00666667 F Cartesian 2703.7856000000056 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3,-3 31 3 -3 3.501801 1.536783 -1.535057 Rho 0.3188861E+03 3,-3 32 3 -3 -3.455142 1.636581 1.584018 Rho 0.3188853E+03 3,-3 33 3 -3 1.538305 -1.450629 3.474057 Rho 0.3188896E+03 3,-3 34 3 -3 1.583701 1.417543 -3.464967 Rho 0.3188828E+03 3,-3 35 3 -3 -1.487838 1.591063 3.497176 Rho 0.3188983E+03 3,-3 36 3 -3 -1.970382 -1.407769 -3.892746 Rho 0.3191682E+03 3,-3 37 3 -3 -1.548522 -3.711205 -1.370489 Rho 0.3186281E+03 3,-3 38 3 -3 -1.489882 3.452592 1.553561 Rho 0.3189174E+03 3,-3 39 3 -3 1.521745 -3.509973 1.559552 Rho 0.3188285E+03 3,-3 40 3 -3 1.536311 3.478471 -1.569877 Rho 0.3188506E+03 3,-3 41 3 -3 -0.174679 -3.831063 3.924645 Rho 0.3190433E+03 3,-3 42 3 -3 3.961647 -0.162135 -3.750492 Rho 0.3191564E+03 3,-3 43 3 -3 -0.257156 3.689458 -3.866652 Rho 0.3190587E+03 3,-3 44 3 -3 0.241694 3.791350 3.805716 Rho 0.3191666E+03 3,-3 45 3 -3 3.849585 -3.852873 -0.202296 Rho 0.3190227E+03 3,-3 46 3 -3 3.817740 3.852448 0.253462 Rho 0.3190597E+03 3,-3 47 3 -3 -3.771594 3.816680 -0.199570 Rho 0.3191461E+03 3,-3 48 3 -3 -3.979120 -3.779508 0.172106 Rho 0.3190503E+03 3,-3 49 3 -3 -3.971624 0.433239 -3.596645 Rho 0.3191248E+03 3,-3 50 3 -3 -3.867046 -0.146359 3.894510 Rho 0.3190444E+03 3,-3 51 3 -3 3.772019 0.251036 3.793983 Rho 0.3191621E+03 3,-3 52 3 -3 1.235309 -1.967107 -2.404282 Rho 0.4118972E+00 3,-3 53 3 -3 -0.597184 -3.406137 -1.362619 Rho 0.4409018E+00 3,-3 54 3 -1 -3.336220 0.117410 -3.181829 Rho 0.2171830E+00 |GRAD(Rho)| 0.3960880E-15 GRAD(Rho)x -0.2237793E-15 GRAD(Rho)y -0.4933120E-17 GRAD(Rho)z -0.3267785E-15 Laplacian 0.8010835E+00 (-1/4)Del**2(Rho)) -0.2002709E+00 Diamond 0.2522982E+01 Metallicity 0.6750123E+01 Ellipticity 0.1495538E-01 Gb(Abramov) 0.3588228E+00 Vb(Abramov) -0.5173746E+00 Hb(Abramov) -0.1585519E+00 Ex_ueg -0.9641681E-01 Ec_ueg -0.1287612E-01 Delta_ex -0.9437332E-01 Delta_ec 0.1833192E-01 Delta_et -0.2531865E+00 Pxc 0.7488035E+01 Qxc -0.5148031E+01 3,-1 55 3 -1 -3.067765 -0.932152 -2.099308 Rho 0.1505826E+00 |GRAD(Rho)| 0.4515374E-13 GRAD(Rho)x 0.2079585E-13 GRAD(Rho)y -0.2930325E-13 GRAD(Rho)z 0.2734434E-13 Laplacian 0.5724938E+00 (-1/4)Del**2(Rho)) -0.1431234E+00 Diamond 0.1173924E+01 Metallicity 0.5130195E+01 Ellipticity 0.3109684E-01 Gb(Abramov) 0.2177908E+00 Vb(Abramov) -0.2924582E+00 Hb(Abramov) -0.7466738E-01 Ex_ueg -0.5916773E-01 Ec_ueg -0.8480822E-02 Delta_ex -0.6162182E-01 Delta_ec 0.1465924E-01 Delta_et -0.1955912E+00 Pxc 0.6976651E+01 Qxc -0.4203616E+01 3,-1 56 3 -1 -3.230865 3.216529 -0.062768 Rho 0.2203426E+00 |GRAD(Rho)| 0.9889599E-14 GRAD(Rho)x 0.1831055E-14 GRAD(Rho)y -0.9027989E-14 GRAD(Rho)z -0.3598169E-14 Laplacian 0.8167151E+00 (-1/4)Del**2(Rho)) -0.2041788E+00 Diamond 0.2606038E+01 Metallicity 0.6782241E+01 Ellipticity 0.2759229E-02 Gb(Abramov) 0.3669175E+00 Vb(Abramov) -0.5296561E+00 Hb(Abramov) -0.1627387E+00 Ex_ueg -0.9829156E-01 Ec_ueg -0.1309085E-01 Delta_ex -0.9650709E-01 Delta_ec 0.1849350E-01 Delta_et -0.2551699E+00 Pxc 0.7508420E+01 Qxc -0.5218435E+01 3,-1 57 3 +3 -1.933279 1.937025 1.973995 Rho 0.1188966E-01 |GRAD(Rho)| 0.1289302E-13 GRAD(Rho)x 0.4579205E-14 GRAD(Rho)y -0.8456510E-14 GRAD(Rho)z -0.8587680E-14 Laplacian 0.5344934E-01 (-1/4)Del**2(Rho)) -0.1336233E-01 Diamond 0.1228366E-02 Metallicity 0.7985213E+00 Ellipticity -0.7742777E+00 Gb(Abramov) 0.1068657E-01 Vb(Abramov) -0.8010815E-02 Hb(Abramov) 0.2675760E-02 Ex_ueg -0.2004215E-02 Ec_ueg -0.4544777E-03 Delta_ex -0.2361556E-02 Delta_ec 0.2307733E-03 Delta_et -0.2084052E-02 Pxc 0.4409930E+01 Qxc -0.1023323E+02 3,+3 58 3 -1 -3.083425 -2.027898 -0.881741 Rho 0.1084148E+00 |GRAD(Rho)| 0.1641504E-15 GRAD(Rho)x 0.5559247E-16 GRAD(Rho)y -0.2566171E-16 GRAD(Rho)z -0.1523033E-15 Laplacian 0.4457669E+00 (-1/4)Del**2(Rho)) -0.1114417E+00 Diamond 0.6328552E+00 Metallicity 0.3810536E+01 Ellipticity 0.2635208E-01 Gb(Abramov) 0.1450699E+00 Vb(Abramov) -0.1786981E+00 Hb(Abramov) -0.3362821E-01 Ex_ueg -0.3818003E-01 Ec_ueg -0.5837548E-02 Delta_ex -0.4460442E-01 Delta_ec 0.1280381E-01 Delta_et -0.1623880E+00 Pxc 0.6540423E+01 Qxc -0.3483684E+01 3,-1 59 3 +3 -1.169092 -1.147559 1.179216 Rho 0.4709209E-02 |GRAD(Rho)| 0.5166651E-14 GRAD(Rho)x 0.3746820E-14 GRAD(Rho)y 0.1801935E-14 GRAD(Rho)z -0.3067354E-14 Laplacian 0.1663639E-01 (-1/4)Del**2(Rho)) -0.4159097E-02 Diamond 0.1019790E-03 Metallicity 0.5480255E+00 Ellipticity -0.1178903E+00 Gb(Abramov) 0.3152613E-02 Vb(Abramov) -0.2146129E-02 Hb(Abramov) 0.1006484E-02 Ex_ueg -0.5829738E-03 Ec_ueg -0.1344204E-03 Delta_ex -0.5602343E-03 Delta_ec 0.6421836E-04 Delta_et -0.5295170E-03 Pxc 0.4336944E+01 Qxc -0.8723897E+01 3,+3 60 3 +1 -1.765111 -0.536691 0.581920 Rho 0.8153774E-02 |GRAD(Rho)| 0.5568202E-17 GRAD(Rho)x -0.3712499E-17 GRAD(Rho)y -0.3989970E-17 GRAD(Rho)z -0.1141210E-17 Laplacian 0.2977925E-01 (-1/4)Del**2(Rho)) -0.7444812E-02 Diamond 0.7236903E-03 Metallicity 0.7643587E+00 Ellipticity -0.1472279E+01 Gb(Abramov) 0.5911626E-02 Vb(Abramov) -0.4378439E-02 Hb(Abramov) 0.1533186E-02 Ex_ueg -0.1212076E-02 Ec_ueg -0.2850591E-03 Delta_ex -0.1333812E-02 Delta_ec 0.4039774E-03 Delta_et -0.2735965E-02 Pxc 0.4252016E+01 Qxc -0.3301700E+01 3,+1 61 3 +1 0.009267 -3.083719 0.037456 Rho 0.3688289E-02 |GRAD(Rho)| 0.1956435E-16 GRAD(Rho)x 0.8260493E-17 GRAD(Rho)y 0.2136511E-17 GRAD(Rho)z -0.1760578E-16 Laplacian 0.1364373E-01 (-1/4)Del**2(Rho)) -0.3410931E-02 Diamond 0.1692417E-03 Metallicity 0.4446877E+00 Ellipticity -0.1607260E+01 Gb(Abramov) 0.2526754E-02 Vb(Abramov) -0.1642577E-02 Hb(Abramov) 0.8841773E-03 Ex_ueg -0.4208736E-03 Ec_ueg -0.9090877E-04 Delta_ex -0.5817597E-03 Delta_ec 0.3246652E-03 Delta_et -0.1652160E-02 Pxc 0.4629626E+01 Qxc -0.1791876E+01 3,+1 62 3 -1 -1.765026 1.715175 0.528165 Rho 0.4783872E-01 |GRAD(Rho)| 0.7824027E-14 GRAD(Rho)x 0.6214883E-14 GRAD(Rho)y -0.3033506E-14 GRAD(Rho)z 0.3659025E-14 Laplacian 0.1887941E+00 (-1/4)Del**2(Rho)) -0.4719854E-01 Diamond 0.8938407E-01 Metallicity 0.2301039E+01 Ellipticity 0.1327823E-01 Gb(Abramov) 0.4956663E-01 Vb(Abramov) -0.5193473E-01 Hb(Abramov) -0.2368098E-02 Ex_ueg -0.1282600E-01 Ec_ueg -0.2295759E-02 Delta_ex -0.1533457E-01 Delta_ec 0.5566682E-02 Delta_et -0.5800890E-01 Pxc 0.5586822E+01 Qxc -0.2754706E+01 3,-1 63 3 +1 -3.071163 -0.252457 -0.234539 Rho 0.5163504E-02 |GRAD(Rho)| 0.1129994E-15 GRAD(Rho)x -0.1022325E-16 GRAD(Rho)y -0.8175498E-16 GRAD(Rho)z -0.7733354E-16 Laplacian 0.2014698E-01 (-1/4)Del**2(Rho)) -0.5036746E-02 Diamond 0.3645357E-03 Metallicity 0.5276072E+00 Ellipticity -0.1574668E+01 Gb(Abramov) 0.3800734E-02 Vb(Abramov) -0.2564723E-02 Hb(Abramov) 0.1236011E-02 Ex_ueg -0.6591402E-03 Ec_ueg -0.1539558E-03 Delta_ex -0.8957980E-03 Delta_ec 0.4341923E-03 Delta_et -0.2461570E-02 Pxc 0.4281359E+01 Qxc -0.2063136E+01 3,+1 64 3 -1 -2.880687 -0.578635 1.869976 Rho 0.1359411E+00 |GRAD(Rho)| 0.1577350E-14 GRAD(Rho)x 0.3126975E-15 GRAD(Rho)y 0.9468338E-15 GRAD(Rho)z 0.1222194E-14 Laplacian 0.5688352E+00 (-1/4)Del**2(Rho)) -0.1422088E+00 Diamond 0.1045949E+01 Metallicity 0.4353895E+01 Ellipticity 0.1511760E-01 Gb(Abramov) 0.1979995E+00 Vb(Abramov) -0.2537903E+00 Hb(Abramov) -0.5579075E-01 Ex_ueg -0.5162412E-01 Ec_ueg -0.7549709E-02 Delta_ex -0.5988377E-01 Delta_ec 0.1522553E-01 Delta_et -0.2006427E+00 Pxc 0.6837896E+01 Qxc -0.3933115E+01 3,-1 65 3 -1 -1.862995 0.449775 -2.834181 Rho 0.1487618E+00 |GRAD(Rho)| 0.1866448E-15 GRAD(Rho)x 0.3333922E-17 GRAD(Rho)y 0.1496199E-15 GRAD(Rho)z -0.1115305E-15 Laplacian 0.6072779E+00 (-1/4)Del**2(Rho)) -0.1518195E+00 Diamond 0.1222589E+01 Metallicity 0.4739272E+01 Ellipticity 0.1462400E-01 Gb(Abramov) 0.2211319E+00 Vb(Abramov) -0.2904444E+00 Hb(Abramov) -0.6931246E-01 Ex_ueg -0.5821574E-01 Ec_ueg -0.8364301E-02 Delta_ex -0.6512486E-01 Delta_ec 0.1551405E-01 Delta_et -0.2064528E+00 Pxc 0.6960025E+01 Qxc -0.4197798E+01 3,-1 66 3 -1 -3.278189 -0.039729 3.302638 Rho 0.1988978E+00 |GRAD(Rho)| 0.1306381E-12 GRAD(Rho)x 0.9120385E-13 GRAD(Rho)y 0.1623277E-13 GRAD(Rho)z -0.9211230E-13 Laplacian 0.7520775E+00 (-1/4)Del**2(Rho)) -0.1880194E+00 Diamond 0.2130209E+01 Metallicity 0.6209652E+01 Ellipticity 0.1974609E-02 Gb(Abramov) 0.3199354E+00 Vb(Abramov) -0.4518514E+00 Hb(Abramov) -0.1319160E+00 Ex_ueg -0.8574821E-01 Ec_ueg -0.1164429E-01 Delta_ex -0.8661830E-01 Delta_ec 0.1762662E-01 Delta_et -0.2418680E+00 Pxc 0.7363970E+01 Qxc -0.4914061E+01 3,-1 67 3 -1 -2.842160 0.507022 -1.841289 Rho 0.6634148E-01 |GRAD(Rho)| 0.3071061E-16 GRAD(Rho)x -0.1029018E-16 GRAD(Rho)y 0.2879234E-16 GRAD(Rho)z 0.2873136E-17 Laplacian 0.2716689E+00 (-1/4)Del**2(Rho)) -0.6791721E-01 Diamond 0.2033591E+00 Metallicity 0.2757710E+01 Ellipticity 0.1336294E-01 Gb(Abramov) 0.7649414E-01 Vb(Abramov) -0.8507107E-01 Hb(Abramov) -0.8576926E-02 Ex_ueg -0.1983499E-01 Ec_ueg -0.3336318E-02 Delta_ex -0.2406144E-01 Delta_ec 0.8134017E-02 Delta_et -0.9221416E-01 Pxc 0.5945172E+01 Qxc -0.2958126E+01 3,-1 68 3 +1 -0.678404 -1.727153 0.564498 Rho 0.7456148E-02 |GRAD(Rho)| 0.7411666E-13 GRAD(Rho)x 0.6263719E-13 GRAD(Rho)y -0.3693607E-13 GRAD(Rho)z -0.1433837E-13 Laplacian 0.2656717E-01 (-1/4)Del**2(Rho)) -0.6641792E-02 Diamond 0.5704968E-03 Metallicity 0.7381174E+00 Ellipticity -0.1461000E+01 Gb(Abramov) 0.5244932E-02 Vb(Abramov) -0.3848072E-02 Hb(Abramov) 0.1396860E-02 Ex_ueg -0.1075815E-02 Ec_ueg -0.2540954E-03 Delta_ex -0.1162773E-02 Delta_ec 0.3593300E-03 Delta_et -0.2379366E-02 Pxc 0.4233904E+01 Qxc -0.3235947E+01 3,+1 69 3 +3 -2.409149 -0.013082 0.038910 Rho 0.4529180E-02 |GRAD(Rho)| 0.7734368E-16 GRAD(Rho)x 0.5470605E-16 GRAD(Rho)y -0.4624749E-16 GRAD(Rho)z -0.2916267E-16 Laplacian 0.1813487E-01 (-1/4)Del**2(Rho)) -0.4533717E-02 Diamond 0.1506671E-03 Metallicity 0.4711199E+00 Ellipticity -0.4445268E+00 Gb(Abramov) 0.3378465E-02 Vb(Abramov) -0.2223214E-02 Hb(Abramov) 0.1155252E-02 Ex_ueg -0.5534494E-03 Ec_ueg -0.1267081E-03 Delta_ex -0.6520713E-03 Delta_ec 0.1556532E-03 Delta_et -0.9901396E-03 Pxc 0.4367908E+01 Qxc -0.4189258E+01 3,+3 70 3 -1 -3.039152 0.901994 2.065014 Rho 0.1064964E+00 |GRAD(Rho)| 0.1700873E-15 GRAD(Rho)x -0.4239908E-16 GRAD(Rho)y 0.1575888E-15 GRAD(Rho)z -0.4793529E-16 Laplacian 0.4401879E+00 (-1/4)Del**2(Rho)) -0.1100470E+00 Diamond 0.6079714E+00 Metallicity 0.3745700E+01 Ellipticity 0.1536397E-01 Gb(Abramov) 0.1420651E+00 Vb(Abramov) -0.1740833E+00 Hb(Abramov) -0.3201816E-01 Ex_ueg -0.3728190E-01 Ec_ueg -0.5720231E-02 Delta_ex -0.4380619E-01 Delta_ec 0.1259063E-01 Delta_et -0.1589898E+00 Pxc 0.6517552E+01 Qxc -0.3479268E+01 3,-1 71 3 +1 2.030376 1.998679 -2.019982 Rho 0.1151681E-01 |GRAD(Rho)| 0.1162993E-16 GRAD(Rho)x 0.6828108E-17 GRAD(Rho)y -0.9356711E-17 GRAD(Rho)z 0.1041247E-17 Laplacian 0.4871478E-01 (-1/4)Del**2(Rho)) -0.1217870E-01 Diamond 0.1269341E-02 Metallicity 0.8308178E+00 Ellipticity -0.1065201E+01 Gb(Abramov) 0.9805510E-02 Vb(Abramov) -0.7432324E-02 Hb(Abramov) 0.2373186E-02 Ex_ueg -0.1920854E-02 Ec_ueg -0.4373092E-03 Delta_ex -0.2193027E-02 Delta_ec 0.3185461E-03 Delta_et -0.2610906E-02 Pxc 0.4392439E+01 Qxc -0.6884488E+01 3,+1 72 3 +1 -1.754360 0.526655 -0.531969 Rho 0.8790420E-02 |GRAD(Rho)| 0.8959791E-16 GRAD(Rho)x 0.6298811E-16 GRAD(Rho)y -0.4003760E-16 GRAD(Rho)z 0.4957089E-16 Laplacian 0.3381773E-01 (-1/4)Del**2(Rho)) -0.8454433E-02 Diamond 0.9585572E-03 Metallicity 0.7629300E+00 Ellipticity -0.1505152E+01 Gb(Abramov) 0.6711312E-02 Vb(Abramov) -0.4968191E-02 Hb(Abramov) 0.1743121E-02 Ex_ueg -0.1339876E-02 Ec_ueg -0.3135081E-03 Delta_ex -0.1564957E-02 Delta_ec 0.4962847E-03 Delta_et -0.3394754E-02 Pxc 0.4273816E+01 Qxc -0.3153346E+01 3,+1 73 3 +1 -2.206555 1.049845 1.476889 Rho 0.2509440E-01 |GRAD(Rho)| 0.4206900E-13 GRAD(Rho)x -0.1716224E-13 GRAD(Rho)y -0.2326633E-13 GRAD(Rho)z 0.3056037E-13 Laplacian 0.9412360E-01 (-1/4)Del**2(Rho)) -0.2353090E-01 Diamond 0.1068975E-01 Metallicity 0.1574742E+01 Ellipticity -0.2424669E+01 Gb(Abramov) 0.2186311E-01 Vb(Abramov) -0.2019533E-01 Hb(Abramov) 0.1667785E-02 Ex_ueg -0.5426096E-02 Ec_ueg -0.1093468E-02 Delta_ex -0.5677834E-02 Delta_ec 0.1272188E-02 Delta_et -0.1131471E-01 Pxc 0.4962280E+01 Qxc -0.4463045E+01 3,+1 74 3 -1 -2.851179 1.804200 -0.529323 Rho 0.1912296E+00 |GRAD(Rho)| 0.1216194E-15 GRAD(Rho)x -0.8075951E-16 GRAD(Rho)y -0.6863000E-16 GRAD(Rho)z 0.5965822E-16 Laplacian 0.7708854E+00 (-1/4)Del**2(Rho)) -0.1927214E+00 Diamond 0.2058176E+01 Metallicity 0.5673902E+01 Ellipticity 0.2012573E-01 Gb(Abramov) 0.3107279E+00 Vb(Abramov) -0.4287345E+00 Hb(Abramov) -0.1180066E+00 Ex_ueg -0.8136892E-01 Ec_ueg -0.1113325E-01 Delta_ex -0.8772349E-01 Delta_ec 0.1794534E-01 Delta_et -0.2443758E+00 Pxc 0.7308638E+01 Qxc -0.4888370E+01 3,-1 75 3 +1 -1.436273 1.053501 2.217225 Rho 0.2421639E-01 |GRAD(Rho)| 0.7449979E-16 GRAD(Rho)x -0.2894771E-16 GRAD(Rho)y -0.1128541E-16 GRAD(Rho)z 0.6771181E-16 Laplacian 0.9058710E-01 (-1/4)Del**2(Rho)) -0.2264677E-01 Diamond 0.1004556E-01 Metallicity 0.1541922E+01 Ellipticity -0.2523479E+01 Gb(Abramov) 0.2091778E-01 Vb(Abramov) -0.1918878E-01 Hb(Abramov) 0.1728999E-02 Ex_ueg -0.5174450E-02 Ec_ueg -0.1049342E-02 Delta_ex -0.5439714E-02 Delta_ec 0.1275376E-02 Delta_et -0.1123692E-01 Pxc 0.4931138E+01 Qxc -0.4265184E+01 3,+1 76 3 -1 -0.023241 3.008533 0.047264 Rho 0.5642111E-02 |GRAD(Rho)| 0.1335617E-16 GRAD(Rho)x 0.7119498E-17 GRAD(Rho)y 0.3504179E-18 GRAD(Rho)z 0.1129501E-16 Laplacian 0.2191578E-01 (-1/4)Del**2(Rho)) -0.5478946E-02 Diamond 0.6730083E-03 Metallicity 0.5622449E+00 Ellipticity 0.3013018E+01 Gb(Abramov) 0.4166049E-02 Vb(Abramov) -0.2853152E-02 Hb(Abramov) 0.1312897E-02 Ex_ueg -0.7418348E-03 Ec_ueg -0.1746492E-03 Delta_ex -0.1172288E-02 Delta_ec 0.7913835E-03 Delta_et -0.4416160E-02 Pxc 0.4247569E+01 Qxc -0.1481315E+01 3,-1 77 3 -1 -1.917122 -2.862775 0.646436 Rho 0.1233257E+00 |GRAD(Rho)| 0.1403258E-15 GRAD(Rho)x 0.5522655E-16 GRAD(Rho)y -0.6898236E-17 GRAD(Rho)z 0.1288168E-15 Laplacian 0.5186945E+00 (-1/4)Del**2(Rho)) -0.1296736E+00 Diamond 0.8549345E+00 Metallicity 0.4059360E+01 Ellipticity 0.2948603E-01 Gb(Abramov) 0.1741811E+00 Vb(Abramov) -0.2186885E+00 Hb(Abramov) -0.4450745E-01 Ex_ueg -0.4533739E-01 Ec_ueg -0.6758542E-02 Delta_ex -0.5343114E-01 Delta_ec 0.1435607E-01 Delta_et -0.1863495E+00 Pxc 0.6708161E+01 Qxc -0.3721850E+01 3,-1 78 3 -1 -1.832611 -1.753950 -0.524077 Rho 0.4612235E-01 |GRAD(Rho)| 0.6582042E-16 GRAD(Rho)x 0.5323941E-16 GRAD(Rho)y 0.3374156E-16 GRAD(Rho)z -0.1895787E-16 Laplacian 0.1933147E+00 (-1/4)Del**2(Rho)) -0.4832868E-01 Diamond 0.9482838E-01 Metallicity 0.2114466E+01 Ellipticity 0.1764303E-01 Gb(Abramov) 0.4925068E-01 Vb(Abramov) -0.5017268E-01 Hb(Abramov) -0.9219961E-03 Ex_ueg -0.1221613E-01 Ec_ueg -0.2201680E-02 Delta_ex -0.1592980E-01 Delta_ec 0.6364790E-02 Delta_et -0.6583820E-01 Pxc 0.5548549E+01 Qxc -0.2502800E+01 3,-1 79 3 +1 -0.134965 -2.260451 -1.163927 Rho 0.6570577E-02 |GRAD(Rho)| 0.6916274E-18 GRAD(Rho)x -0.5860252E-18 GRAD(Rho)y 0.7539007E-19 GRAD(Rho)z 0.3594985E-18 Laplacian 0.2473613E-01 (-1/4)Del**2(Rho)) -0.6184033E-02 Diamond 0.6971919E-03 Metallicity 0.6421265E+00 Ellipticity -0.2370768E+01 Gb(Abramov) 0.4784511E-02 Vb(Abramov) -0.3384988E-02 Hb(Abramov) 0.1399522E-02 Ex_ueg -0.9089147E-03 Ec_ueg -0.2151149E-03 Delta_ex -0.1210159E-02 Delta_ec 0.6224092E-03 Delta_et -0.3729076E-02 Pxc 0.4225252E+01 Qxc -0.1944315E+01 3,+1 80 3 -1 -2.897351 -1.831699 0.607004 Rho 0.1199126E+00 |GRAD(Rho)| 0.2051253E-14 GRAD(Rho)x 0.6812381E-15 GRAD(Rho)y -0.1547089E-14 GRAD(Rho)z -0.1161926E-14 Laplacian 0.5080990E+00 (-1/4)Del**2(Rho)) -0.1270247E+00 Diamond 0.8079365E+00 Metallicity 0.3954635E+01 Ellipticity 0.1625785E-01 Gb(Abramov) 0.1684059E+00 Vb(Abramov) -0.2097871E+00 Hb(Abramov) -0.4138117E-01 Ex_ueg -0.4367219E-01 Ec_ueg -0.6546339E-02 Delta_ex -0.5196963E-01 Delta_ec 0.1411216E-01 Delta_et -0.1821952E+00 Pxc 0.6671239E+01 Qxc -0.3682614E+01 3,-1 81 3 +1 -0.347312 -0.666687 -3.109367 Rho 0.2990010E-02 |GRAD(Rho)| 0.3769597E-17 GRAD(Rho)x 0.3551633E-17 GRAD(Rho)y -0.3434603E-19 GRAD(Rho)z 0.1262768E-17 Laplacian 0.1134639E-01 (-1/4)Del**2(Rho)) -0.2836596E-02 Diamond 0.1069750E-03 Metallicity 0.3768861E+00 Ellipticity -0.1379247E+01 Gb(Abramov) 0.2069243E-02 Vb(Abramov) -0.1301890E-02 Hb(Abramov) 0.7673532E-03 Ex_ueg -0.3181378E-03 Ec_ueg -0.6146750E-04 Delta_ex -0.4654417E-03 Delta_ec 0.2726426E-03 Delta_et -0.1302909E-02 Pxc 0.5175708E+01 Qxc -0.1707150E+01 3,+1 82 3 +1 -2.289374 -1.471006 -1.046995 Rho 0.2810612E-01 |GRAD(Rho)| 0.2720321E-16 GRAD(Rho)x -0.2455022E-16 GRAD(Rho)y 0.6292833E-17 GRAD(Rho)z -0.9884405E-17 Laplacian 0.1111513E+00 (-1/4)Del**2(Rho)) -0.2778783E-01 Diamond 0.1517836E-01 Metallicity 0.1610770E+01 Ellipticity -0.2532883E+01 Gb(Abramov) 0.2598518E-01 Vb(Abramov) -0.2418254E-01 Hb(Abramov) 0.1802644E-02 Ex_ueg -0.6311312E-02 Ec_ueg -0.1246339E-02 Delta_ex -0.6956661E-02 Delta_ec 0.1570417E-02 Delta_et -0.1430657E-01 Pxc 0.5063880E+01 Qxc -0.4429817E+01 3,+1 83 3 +1 -2.044138 2.066278 2.093400 Rho 0.1199527E-01 |GRAD(Rho)| 0.1366650E-12 GRAD(Rho)x 0.1272100E-12 GRAD(Rho)y 0.3547890E-13 GRAD(Rho)z 0.3515909E-13 Laplacian 0.5458530E-01 (-1/4)Del**2(Rho)) -0.1364633E-01 Diamond 0.1721741E-02 Metallicity 0.7935138E+00 Ellipticity -0.1136295E+01 Gb(Abramov) 0.1090231E-01 Vb(Abramov) -0.8158291E-02 Hb(Abramov) 0.2744017E-02 Ex_ueg -0.2027988E-02 Ec_ueg -0.4593509E-03 Delta_ex -0.2548581E-02 Delta_ec 0.4688282E-03 Delta_et -0.3699324E-02 Pxc 0.4414899E+01 Qxc -0.5436066E+01 3,+1 84 3 +1 -0.158620 3.011124 0.182542 Rho 0.5619998E-02 |GRAD(Rho)| 0.2130618E-17 GRAD(Rho)x -0.1595054E-17 GRAD(Rho)y 0.1665348E-18 GRAD(Rho)z 0.1402713E-17 Laplacian 0.2262064E-01 (-1/4)Del**2(Rho)) -0.5655160E-02 Diamond 0.5938611E-03 Metallicity 0.5411718E+00 Ellipticity -0.3220184E+01 Gb(Abramov) 0.4280176E-02 Vb(Abramov) -0.2905191E-02 Hb(Abramov) 0.1374985E-02 Ex_ueg -0.7379607E-03 Ec_ueg -0.1736906E-03 Delta_ex -0.1131924E-02 Delta_ec 0.6790388E-03 Delta_et -0.3832597E-02 Pxc 0.4248708E+01 Qxc -0.1666950E+01 3,+1 85 3 -1 -2.004157 2.994391 0.864174 Rho 0.1077492E+00 |GRAD(Rho)| 0.2727309E-15 GRAD(Rho)x -0.3066259E-16 GRAD(Rho)y 0.6732557E-16 GRAD(Rho)z 0.2625057E-15 Laplacian 0.4224895E+00 (-1/4)Del**2(Rho)) -0.1056224E+00 Diamond 0.5713852E+00 Metallicity 0.3979431E+01 Ellipticity 0.2175454E-01 Gb(Abramov) 0.1404677E+00 Vb(Abramov) -0.1753131E+00 Hb(Abramov) -0.3484537E-01 Ex_ueg -0.3786786E-01 Ec_ueg -0.5796818E-02 Delta_ex -0.4184328E-01 Delta_ec 0.1148853E-01 Delta_et -0.1446548E+00 Pxc 0.6532524E+01 Qxc -0.3642177E+01 3,-1 86 3 +1 0.524645 1.703145 0.511207 Rho 0.7337018E-02 |GRAD(Rho)| 0.7712050E-13 GRAD(Rho)x -0.6104935E-13 GRAD(Rho)y -0.4702415E-13 GRAD(Rho)z -0.3045806E-14 Laplacian 0.2826646E-01 (-1/4)Del**2(Rho)) -0.7066614E-02 Diamond 0.6077165E-03 Metallicity 0.6753690E+00 Ellipticity -0.1394732E+01 Gb(Abramov) 0.5506505E-02 Vb(Abramov) -0.3946396E-02 Hb(Abramov) 0.1560109E-02 Ex_ueg -0.1052958E-02 Ec_ueg -0.2488302E-03 Delta_ex -0.1239881E-02 Delta_ec 0.3961208E-03 Delta_et -0.2599963E-02 Pxc 0.4231634E+01 Qxc -0.3130057E+01 3,+1 87 3 +1 -0.592458 -0.574778 1.718346 Rho 0.7343424E-02 |GRAD(Rho)| 0.2822496E-14 GRAD(Rho)x 0.2444579E-14 GRAD(Rho)y -0.1094305E-14 GRAD(Rho)z -0.8905140E-15 Laplacian 0.2704497E-01 (-1/4)Del**2(Rho)) -0.6761242E-02 Diamond 0.5659950E-03 Metallicity 0.7068995E+00 Ellipticity -0.1411064E+01 Gb(Abramov) 0.5304081E-02 Vb(Abramov) -0.3846920E-02 Hb(Abramov) 0.1457161E-02 Ex_ueg -0.1054184E-02 Ec_ueg -0.2491132E-03 Delta_ex -0.1177577E-02 Delta_ec 0.3629646E-03 Delta_et -0.2396536E-02 Pxc 0.4231748E+01 Qxc -0.3244329E+01 3,+1 88 3 +1 -1.858259 -1.784393 1.864339 Rho 0.1121600E-01 |GRAD(Rho)| 0.3235032E-14 GRAD(Rho)x -0.2786532E-14 GRAD(Rho)y 0.1241134E-14 GRAD(Rho)z -0.1077153E-14 Laplacian 0.5005227E-01 (-1/4)Del**2(Rho)) -0.1251307E-01 Diamond 0.1669936E-02 Metallicity 0.7737237E+00 Ellipticity -0.1251740E+01 Gb(Abramov) 0.9955654E-02 Vb(Abramov) -0.7398241E-02 Hb(Abramov) 0.2557413E-02 Ex_ueg -0.1854253E-02 Ec_ueg -0.4234987E-03 Delta_ex -0.2366898E-02 Delta_ec 0.5603245E-03 Delta_et -0.4203462E-02 Pxc 0.4378414E+01 Qxc -0.4224156E+01 3,+1 89 3 -1 -2.256220 -0.875214 -3.342738 Rho 0.2218153E+00 |GRAD(Rho)| 0.5885360E-15 GRAD(Rho)x -0.1811160E-15 GRAD(Rho)y 0.4259288E-15 GRAD(Rho)z 0.3635330E-15 Laplacian 0.8460807E+00 (-1/4)Del**2(Rho)) -0.2115202E+00 Diamond 0.2706629E+01 Metallicity 0.6619935E+01 Ellipticity 0.1692820E-02 Gb(Abramov) 0.3743884E+00 Vb(Abramov) -0.5372567E+00 Hb(Abramov) -0.1628682E+00 Ex_ueg -0.9916847E-01 Ec_ueg -0.1319112E-01 Delta_ex -0.1000618E+00 Delta_ec 0.1896547E-01 Delta_et -0.2611536E+00 Pxc 0.7517821E+01 Qxc -0.5276002E+01 3,-1 90 3 -1 -1.854687 -0.584899 2.900430 Rho 0.1363573E+00 |GRAD(Rho)| 0.3935656E-15 GRAD(Rho)x 0.2935477E-15 GRAD(Rho)y -0.2520499E-15 GRAD(Rho)z 0.7207234E-16 Laplacian 0.5735909E+00 (-1/4)Del**2(Rho)) -0.1433977E+00 Diamond 0.1057827E+01 Metallicity 0.4339851E+01 Ellipticity 0.1351042E-01 Gb(Abramov) 0.1993193E+00 Vb(Abramov) -0.2552409E+00 Hb(Abramov) -0.5592156E-01 Ex_ueg -0.5183498E-01 Ec_ueg -0.7575990E-02 Delta_ex -0.6042050E-01 Delta_ec 0.1532654E-01 Delta_et -0.2020442E+00 Pxc 0.6842007E+01 Qxc -0.3942213E+01 3,-1 91 3 +1 0.114317 -0.137819 3.039744 Rho 0.5181059E-02 |GRAD(Rho)| 0.4457762E-14 GRAD(Rho)x 0.2567964E-14 GRAD(Rho)y -0.3615128E-14 GRAD(Rho)z 0.4561263E-15 Laplacian 0.2036899E-01 (-1/4)Del**2(Rho)) -0.5092247E-02 Diamond 0.4780539E-03 Metallicity 0.5248170E+00 Ellipticity -0.3006698E+01 Gb(Abramov) 0.3840248E-02 Vb(Abramov) -0.2588248E-02 Hb(Abramov) 0.1251999E-02 Ex_ueg -0.6621298E-03 Ec_ueg -0.1547128E-03 Delta_ex -0.1001812E-02 Delta_ec 0.6094333E-03 Delta_et -0.3358140E-02 Pxc 0.4279735E+01 Qxc -0.1643842E+01 3,+1 92 3 -1 -1.821234 -0.605257 -1.815389 Rho 0.4970183E-01 |GRAD(Rho)| 0.4805086E-16 GRAD(Rho)x -0.1891679E-16 GRAD(Rho)y 0.8195256E-17 GRAD(Rho)z -0.4340366E-16 Laplacian 0.1967781E+00 (-1/4)Del**2(Rho)) -0.4919453E-01 Diamond 0.9997871E-01 Metallicity 0.2352829E+01 Ellipticity 0.4479763E-01 Gb(Abramov) 0.5208741E-01 Vb(Abramov) -0.5498028E-01 Hb(Abramov) -0.2892875E-02 Ex_ueg -0.1349631E-01 Ec_ueg -0.2398399E-02 Delta_ex -0.1621786E-01 Delta_ec 0.5943699E-02 Delta_et -0.6259969E-01 Pxc 0.5627215E+01 Qxc -0.2728580E+01 3,-1 93 3 +3 -1.202817 1.106202 -1.110226 Rho 0.5217204E-02 |GRAD(Rho)| 0.1723248E-14 GRAD(Rho)x -0.1688654E-14 GRAD(Rho)y 0.3258263E-15 GRAD(Rho)z 0.1089418E-15 Laplacian 0.2001885E-01 (-1/4)Del**2(Rho)) -0.5004714E-02 Diamond 0.1451290E-03 Metallicity 0.5402196E+00 Ellipticity -0.2981849E+00 Gb(Abramov) 0.3787083E-02 Vb(Abramov) -0.2569453E-02 Hb(Abramov) 0.1217630E-02 Ex_ueg -0.6682960E-03 Ec_ueg -0.1562719E-03 Delta_ex -0.6971795E-03 Delta_ec 0.8339371E-04 Delta_et -0.6787749E-03 Pxc 0.4276494E+01 Qxc -0.8360097E+01 3,+3 94 3 -1 -1.763649 0.514643 1.762296 Rho 0.3962280E-01 |GRAD(Rho)| 0.3258069E-16 GRAD(Rho)x 0.1997685E-16 GRAD(Rho)y -0.1597356E-16 GRAD(Rho)z 0.2018098E-16 Laplacian 0.1657097E+00 (-1/4)Del**2(Rho)) -0.4142743E-01 Diamond 0.6579634E-01 Metallicity 0.1915022E+01 Ellipticity 0.1125716E-01 Gb(Abramov) 0.4084069E-01 Vb(Abramov) -0.4025396E-01 Hb(Abramov) 0.5867363E-03 Ex_ueg -0.9976509E-02 Ec_ueg -0.1849850E-02 Delta_ex -0.1313895E-01 Delta_ec 0.5425011E-02 Delta_et -0.5382962E-01 Pxc 0.5393144E+01 Qxc -0.2421922E+01 3,-1 95 3 -1 -2.006259 0.877919 3.070744 Rho 0.1026092E+00 |GRAD(Rho)| 0.4469367E-15 GRAD(Rho)x 0.2487228E-15 GRAD(Rho)y 0.2982030E-15 GRAD(Rho)z 0.2212789E-15 Laplacian 0.4240081E+00 (-1/4)Del**2(Rho)) -0.1060020E+00 Diamond 0.5614357E+00 Metallicity 0.3654964E+01 Ellipticity 0.5594342E-02 Gb(Abramov) 0.1352403E+00 Vb(Abramov) -0.1644785E+00 Hb(Abramov) -0.2923825E-01 Ex_ueg -0.3547864E-01 Ec_ueg -0.5483379E-02 Delta_ex -0.4185808E-01 Delta_ec 0.1227104E-01 Delta_et -0.1538636E+00 Pxc 0.6470215E+01 Qxc -0.3411128E+01 3,-1 96 3 -1 -2.044110 -3.170909 -0.756936 Rho 0.1191020E+00 |GRAD(Rho)| 0.1042329E-15 GRAD(Rho)x -0.8847090E-16 GRAD(Rho)y 0.3190265E-16 GRAD(Rho)z 0.4494018E-16 Laplacian 0.4637441E+00 (-1/4)Del**2(Rho)) -0.1159360E+00 Diamond 0.7428093E+00 Metallicity 0.4284166E+01 Ellipticity 0.8976921E-01 Gb(Abramov) 0.1600722E+00 Vb(Abramov) -0.2042084E+00 Hb(Abramov) -0.4413618E-01 Ex_ueg -0.4327897E-01 Ec_ueg -0.6496055E-02 Delta_ex -0.4751127E-01 Delta_ec 0.1317589E-01 Delta_et -0.1703302E+00 Pxc 0.6662347E+01 Qxc -0.3605925E+01 3,-1 97 3 +1 1.694343 -0.574464 -0.540242 Rho 0.7707376E-02 |GRAD(Rho)| 0.1166954E-12 GRAD(Rho)x -0.9208347E-13 GRAD(Rho)y 0.6793738E-13 GRAD(Rho)z 0.2286858E-13 Laplacian 0.2997181E-01 (-1/4)Del**2(Rho)) -0.7492953E-02 Diamond 0.6917710E-03 Metallicity 0.6914239E+00 Ellipticity -0.1405990E+01 Gb(Abramov) 0.5858770E-02 Vb(Abramov) -0.4224587E-02 Hb(Abramov) 0.1634183E-02 Ex_ueg -0.1124416E-02 Ec_ueg -0.2652204E-03 Delta_ex -0.1332413E-02 Delta_ec 0.4225730E-03 Delta_et -0.2807050E-02 Pxc 0.4239555E+01 Qxc -0.3153096E+01 3,+1 98 3 +1 -1.807437 1.731649 -1.724634 Rho 0.1121294E-01 |GRAD(Rho)| 0.1908562E-16 GRAD(Rho)x -0.1298827E-16 GRAD(Rho)y 0.1298966E-18 GRAD(Rho)z 0.1398388E-16 Laplacian 0.5297721E-01 (-1/4)Del**2(Rho)) -0.1324430E-01 Diamond 0.1907411E-02 Metallicity 0.7306730E+00 Ellipticity -0.1282837E+01 Gb(Abramov) 0.1044241E-01 Vb(Abramov) -0.7640518E-02 Hb(Abramov) 0.2801891E-02 Ex_ueg -0.1853578E-02 Ec_ueg -0.4233584E-03 Delta_ex -0.2549492E-02 Delta_ec 0.6724489E-03 Delta_et -0.4971093E-02 Pxc 0.4378272E+01 Qxc -0.3791353E+01 3,+1 99 3 +1 -0.548417 1.650356 -0.557327 Rho 0.8651529E-02 |GRAD(Rho)| 0.5942947E-17 GRAD(Rho)x -0.2806864E-17 GRAD(Rho)y 0.1538443E-17 GRAD(Rho)z 0.5007328E-17 Laplacian 0.3286649E-01 (-1/4)Del**2(Rho)) -0.8216623E-02 Diamond 0.8601753E-03 Metallicity 0.7644480E+00 Ellipticity -0.1442091E+01 Gb(Abramov) 0.6524612E-02 Vb(Abramov) -0.4832601E-02 Hb(Abramov) 0.1692011E-02 Ex_ueg -0.1311723E-02 Ec_ueg -0.3072863E-03 Delta_ex -0.1491868E-02 Delta_ec 0.4412839E-03 Delta_et -0.3037984E-02 Pxc 0.4268734E+01 Qxc -0.3380744E+01 3,+1 100 3 +1 -1.312326 2.194200 1.169787 Rho 0.2709938E-01 |GRAD(Rho)| 0.2003802E-16 GRAD(Rho)x 0.1163415E-16 GRAD(Rho)y 0.1460560E-16 GRAD(Rho)z -0.7269491E-17 Laplacian 0.1082673E+00 (-1/4)Del**2(Rho)) -0.2706683E-01 Diamond 0.1653157E-01 Metallicity 0.1556138E+01 Ellipticity -0.5133222E+01 Gb(Abramov) 0.2506450E-01 Vb(Abramov) -0.2306218E-01 Hb(Abramov) 0.2002323E-02 Ex_ueg -0.6011703E-02 Ec_ueg -0.1194985E-02 Delta_ex -0.6949718E-02 Delta_ec 0.1960580E-02 Delta_et -0.1762755E-01 Pxc 0.5030778E+01 Qxc -0.3544725E+01 3,+1 101 3 -1 -1.838732 2.780114 -0.543897 Rho 0.1443434E+00 |GRAD(Rho)| 0.1352985E-15 GRAD(Rho)x 0.1271227E-15 GRAD(Rho)y -0.4623445E-16 GRAD(Rho)z 0.2805373E-17 Laplacian 0.5926897E+00 (-1/4)Del**2(Rho)) -0.1481724E+00 Diamond 0.1142101E+01 Metallicity 0.4617929E+01 Ellipticity 0.1057898E-01 Gb(Abramov) 0.2128232E+00 Vb(Abramov) -0.2774740E+00 Hb(Abramov) -0.6465081E-01 Ex_ueg -0.5592177E-01 Ec_ueg -0.8082398E-02 Delta_ex -0.6300199E-01 Delta_ec 0.1509173E-01 Delta_et -0.1996086E+00 Pxc 0.6918958E+01 Qxc -0.4174604E+01 3,-1 102 3 +3 0.028317 2.295630 0.014934 Rho 0.4447487E-02 |GRAD(Rho)| 0.1810589E-14 GRAD(Rho)x 0.1287495E-14 GRAD(Rho)y -0.1267497E-14 GRAD(Rho)z -0.1184880E-15 Laplacian 0.1792110E-01 (-1/4)Del**2(Rho)) -0.4480276E-02 Diamond 0.1351550E-03 Metallicity 0.4624941E+00 Ellipticity -0.2624060E+00 Gb(Abramov) 0.3332201E-02 Vb(Abramov) -0.2184126E-02 Hb(Abramov) 0.1148075E-02 Ex_ueg -0.5401793E-03 Ec_ueg -0.1232139E-03 Delta_ex -0.6304064E-03 Delta_ec 0.1342427E-03 Delta_et -0.8796603E-03 Pxc 0.4384076E+01 Qxc -0.4696018E+01 3,+3 103 3 -1 1.658258 -1.820600 0.466012 Rho 0.4117452E-01 |GRAD(Rho)| 0.5749430E-13 GRAD(Rho)x 0.3584415E-13 GRAD(Rho)y -0.4056460E-13 GRAD(Rho)z -0.1937278E-13 Laplacian 0.1732596E+00 (-1/4)Del**2(Rho)) -0.4331489E-01 Diamond 0.7293408E-01 Metallicity 0.1952676E+01 Ellipticity 0.1989574E-01 Gb(Abramov) 0.4297326E-01 Vb(Abramov) -0.4263162E-01 Hb(Abramov) 0.3416384E-03 Ex_ueg -0.1050082E-01 Ec_ueg -0.1933181E-02 Delta_ex -0.1389180E-01 Delta_ec 0.5716380E-02 Delta_et -0.5732867E-01 Pxc 0.5431886E+01 Qxc -0.2430174E+01 3,-1 104 3 -1 -0.306015 -1.267216 -3.463159 Rho 0.3616116E-02 |GRAD(Rho)| 0.6140008E-17 GRAD(Rho)x -0.6117903E-17 GRAD(Rho)y -0.5007988E-18 GRAD(Rho)z 0.1419934E-18 Laplacian 0.1272371E-01 (-1/4)Del**2(Rho)) -0.3180927E-02 Diamond 0.2867356E-03 Metallicity 0.4613920E+00 Ellipticity 0.2493040E+00 Gb(Abramov) 0.2365227E-02 Vb(Abramov) -0.1549527E-02 Hb(Abramov) 0.8156999E-03 Ex_ueg -0.4099286E-03 Ec_ueg -0.8785356E-04 Delta_ex -0.7306666E-03 Delta_ec 0.6425366E-03 Delta_et -0.3064829E-02 Pxc 0.4666044E+01 Qxc -0.1137160E+01 3,-1 105 3 +1 -0.407187 -0.995482 -2.835363 Rho 0.2974365E-02 |GRAD(Rho)| 0.4403961E-17 GRAD(Rho)x -0.3999293E-17 GRAD(Rho)y 0.1325348E-17 GRAD(Rho)z 0.1282178E-17 Laplacian 0.1136381E-01 (-1/4)Del**2(Rho)) -0.2840952E-02 Diamond 0.9356309E-04 Metallicity 0.3730323E+00 Ellipticity -0.1205145E+01 Gb(Abramov) 0.2070596E-02 Vb(Abramov) -0.1300240E-02 Hb(Abramov) 0.7703563E-03 Ex_ueg -0.3159203E-03 Ec_ueg -0.6081090E-04 Delta_ex -0.4418756E-03 Delta_ec 0.2305645E-03 Delta_et -0.1123237E-02 Pxc 0.5195125E+01 Qxc -0.1916495E+01 3,+1 106 3 +1 -0.578126 0.524349 -1.648921 Rho 0.9373500E-02 |GRAD(Rho)| 0.8220656E-17 GRAD(Rho)x 0.4536212E-17 GRAD(Rho)y 0.5822683E-17 GRAD(Rho)z -0.3619160E-17 Laplacian 0.3595496E-01 (-1/4)Del**2(Rho)) -0.8988741E-02 Diamond 0.1124478E-02 Metallicity 0.7986514E+00 Ellipticity -0.1556709E+01 Gb(Abramov) 0.7188972E-02 Vb(Abramov) -0.5389204E-02 Hb(Abramov) 0.1799769E-02 Ex_ueg -0.1459668E-02 Ec_ueg -0.3397201E-03 Delta_ex -0.1695928E-02 Delta_ec 0.5363279E-03 Delta_et -0.3723629E-02 Pxc 0.4296678E+01 Qxc -0.3162110E+01 3,+1 107 3 +3 -0.018019 -0.050700 2.326336 Rho 0.4160203E-02 |GRAD(Rho)| 0.2667358E-17 GRAD(Rho)x 0.1265917E-17 GRAD(Rho)y -0.9530267E-18 GRAD(Rho)z -0.2145692E-17 Laplacian 0.1662761E-01 (-1/4)Del**2(Rho)) -0.4156902E-02 Diamond 0.1182958E-03 Metallicity 0.4459719E+00 Ellipticity -0.2878541E+00 Gb(Abramov) 0.3080245E-02 Vb(Abramov) -0.2003588E-02 Hb(Abramov) 0.1076657E-02 Ex_ueg -0.4941640E-03 Ec_ueg -0.1109539E-03 Delta_ex -0.5792721E-03 Delta_ec 0.1325488E-03 Delta_et -0.8417605E-03 Pxc 0.4453779E+01 Qxc -0.4370254E+01 3,+3 108 3 -1 0.041790 -3.326752 -1.343890 Rho 0.3019031E-01 |GRAD(Rho)| 0.2195623E-14 GRAD(Rho)x 0.2155628E-14 GRAD(Rho)y 0.1860892E-15 GRAD(Rho)z 0.3733640E-15 Laplacian 0.9229114E-01 (-1/4)Del**2(Rho)) -0.2307278E-01 Diamond 0.3496407E-01 Metallicity 0.2185576E+01 Ellipticity 0.3090751E-02 Gb(Abramov) 0.2378641E-01 Vb(Abramov) -0.2450003E-01 Hb(Abramov) -0.7136243E-03 Ex_ueg -0.6942915E-02 Ec_ueg -0.1353428E-02 Delta_ex -0.7669338E-02 Delta_ec 0.4477904E-02 Delta_et -0.4111827E-01 Pxc 0.5129874E+01 Qxc -0.1712707E+01 3,-1 109 3 -1 -0.811816 -3.473769 -1.363736 Rho 0.3167022E+00 |GRAD(Rho)| 0.5955273E-15 GRAD(Rho)x -0.5559399E-15 GRAD(Rho)y -0.1817366E-15 GRAD(Rho)z 0.1120509E-15 Laplacian -0.1589654E+01 (-1/4)Del**2(Rho)) 0.3974135E+00 Diamond 0.5458956E+01 Metallicity -0.6378653E+01 Ellipticity 0.6890088E-03 Gb(Abramov) 0.1575515E+00 Vb(Abramov) -0.7125164E+00 Hb(Abramov) -0.5549650E+00 Ex_ueg -0.1594360E+00 Ec_ueg -0.1990279E-01 Delta_ex 0.1577623E+00 Delta_ec 0.5527854E-01 Delta_et -0.1307276E+01 Pxc 0.8010739E+01 Qxc 0.2853951E+01 3,-1 110 3 +1 1.031376 -1.414359 2.187807 Rho 0.2392076E-01 |GRAD(Rho)| 0.2755686E-16 GRAD(Rho)x -0.1991976E-16 GRAD(Rho)y 0.6577310E-17 GRAD(Rho)z -0.1786960E-16 Laplacian 0.9004404E-01 (-1/4)Del**2(Rho)) -0.2251101E-01 Diamond 0.1044993E-01 Metallicity 0.1519789E+01 Ellipticity -0.2991129E+01 Gb(Abramov) 0.2070934E-01 Vb(Abramov) -0.1890766E-01 Hb(Abramov) 0.1801673E-02 Ex_ueg -0.5090398E-02 Ec_ueg -0.1034531E-02 Delta_ex -0.5461832E-02 Delta_ec 0.1397834E-02 Delta_et -0.1224016E-01 Pxc 0.4920488E+01 Qxc -0.3907353E+01 3,+1 111 3 +3 -0.095341 -2.502542 -0.095430 Rho 0.3276646E-02 |GRAD(Rho)| 0.2422717E-17 GRAD(Rho)x -0.2203615E-17 GRAD(Rho)y 0.6178321E-18 GRAD(Rho)z 0.7949359E-18 Laplacian 0.1238357E-01 (-1/4)Del**2(Rho)) -0.3095892E-02 Diamond 0.6651630E-04 Metallicity 0.4022381E+00 Ellipticity -0.1990244E+00 Gb(Abramov) 0.2271476E-02 Vb(Abramov) -0.1447059E-02 Hb(Abramov) 0.8244165E-03 Ex_ueg -0.3594383E-03 Ec_ueg -0.7352080E-04 Delta_ex -0.4103834E-03 Delta_ec 0.1067792E-03 Delta_et -0.6279512E-03 Pxc 0.4888933E+01 Qxc -0.3843289E+01 3,+3 112 3 -1 -0.657068 -2.869333 1.903754 Rho 0.1352795E+00 |GRAD(Rho)| 0.8309139E-13 GRAD(Rho)x 0.1516365E-13 GRAD(Rho)y -0.6354698E-13 GRAD(Rho)z -0.5134223E-13 Laplacian 0.5693997E+00 (-1/4)Del**2(Rho)) -0.1423499E+00 Diamond 0.1042699E+01 Metallicity 0.4314353E+01 Ellipticity 0.8150258E-02 Gb(Abramov) 0.1972579E+00 Vb(Abramov) -0.2521659E+00 Hb(Abramov) -0.5490800E-01 Ex_ueg -0.5128939E-01 Ec_ueg -0.7507955E-02 Delta_ex -0.5989371E-01 Delta_ec 0.1529574E-01 Delta_et -0.2014805E+00 Pxc 0.6831340E+01 Qxc -0.3915711E+01 3,-1 113 3 -1 -0.601656 1.736465 -2.766681 Rho 0.1180062E+00 |GRAD(Rho)| 0.6639506E-15 GRAD(Rho)x 0.4879045E-15 GRAD(Rho)y 0.4475722E-15 GRAD(Rho)z 0.4958531E-16 Laplacian 0.5182412E+00 (-1/4)Del**2(Rho)) -0.1295603E+00 Diamond 0.8117607E+00 Metallicity 0.3775051E+01 Ellipticity 0.3774428E-02 Gb(Abramov) 0.1678896E+00 Vb(Abramov) -0.2062190E+00 Hb(Abramov) -0.3832935E-01 Ex_ueg -0.4274890E-01 Ec_ueg -0.6428163E-02 Delta_ex -0.5285375E-01 Delta_ec 0.1453075E-01 Delta_et -0.1871820E+00 Pxc 0.6650251E+01 Qxc -0.3637371E+01 3,-1 114 3 +1 0.440040 -0.802876 -1.776760 Rho 0.5651589E-02 |GRAD(Rho)| 0.1059702E-16 GRAD(Rho)x 0.9767024E-17 GRAD(Rho)y 0.9342385E-18 GRAD(Rho)z -0.4003662E-17 Laplacian 0.2195248E-01 (-1/4)Del**2(Rho)) -0.5488119E-02 Diamond 0.4938486E-03 Metallicity 0.5628775E+00 Ellipticity -0.1974601E+01 Gb(Abramov) 0.4173603E-02 Vb(Abramov) -0.2859086E-02 Hb(Abramov) 0.1314517E-02 Ex_ueg -0.7434968E-03 Ec_ueg -0.1750602E-03 Delta_ex -0.1031238E-02 Delta_ec 0.5367137E-03 Delta_et -0.3085412E-02 Pxc 0.4247092E+01 Qxc -0.1921393E+01 3,+1 115 3 -1 -0.548982 1.740202 1.746521 Rho 0.4421986E-01 |GRAD(Rho)| 0.1754504E-15 GRAD(Rho)x 0.3359036E-16 GRAD(Rho)y 0.7788680E-16 GRAD(Rho)z 0.1535844E-15 Laplacian 0.1751317E+00 (-1/4)Del**2(Rho)) -0.4378293E-01 Diamond 0.7427345E-01 Metallicity 0.2175758E+01 Ellipticity 0.1742497E-01 Gb(Abramov) 0.4506546E-01 Vb(Abramov) -0.4634800E-01 Hb(Abramov) -0.1282533E-02 Ex_ueg -0.1154892E-01 Ec_ueg -0.2097952E-02 Delta_ex -0.1393521E-01 Delta_ec 0.5145811E-02 Delta_et -0.5251837E-01 Pxc 0.5504856E+01 Qxc -0.2708068E+01 3,-1 116 3 +1 1.159738 1.269774 -2.209319 Rho 0.2673734E-01 |GRAD(Rho)| 0.3325357E-16 GRAD(Rho)x 0.5273380E-17 GRAD(Rho)y 0.3171174E-16 GRAD(Rho)z -0.8506322E-17 Laplacian 0.1044788E+00 (-1/4)Del**2(Rho)) -0.2611970E-01 Diamond 0.1588517E-01 Metallicity 0.1576820E+01 Ellipticity -0.7104090E+01 Gb(Abramov) 0.2427747E-01 Vb(Abramov) -0.2243525E-01 Hb(Abramov) 0.1842221E-02 Ex_ueg -0.5904857E-02 Ec_ueg -0.1176578E-02 Delta_ex -0.6704902E-02 Delta_ec 0.1931777E-02 Delta_et -0.1730411E-01 Pxc 0.5018669E+01 Qxc -0.3470846E+01 3,+1 117 3 -1 -0.850257 2.037327 3.054833 Rho 0.1547117E+00 |GRAD(Rho)| 0.6960414E-16 GRAD(Rho)x -0.5136408E-16 GRAD(Rho)y 0.4697306E-16 GRAD(Rho)z 0.0000000E+00 Laplacian 0.6093792E+00 (-1/4)Del**2(Rho)) -0.1523448E+00 Diamond 0.1273635E+01 Metallicity 0.5041940E+01 Ellipticity 0.3819383E-01 Gb(Abramov) 0.2295821E+00 Vb(Abramov) -0.3068194E+00 Hb(Abramov) -0.7723729E-01 Ex_ueg -0.6134080E-01 Ec_ueg -0.8745813E-02 Delta_ex -0.6586550E-01 Delta_ec 0.1520583E-01 Delta_et -0.2029458E+00 Pxc 0.7013734E+01 Qxc -0.4331596E+01 3,-1 118 3 -1 -0.609916 -1.843086 2.895003 Rho 0.1211648E+00 |GRAD(Rho)| 0.5509054E-16 GRAD(Rho)x -0.4048140E-16 GRAD(Rho)y -0.3331211E-16 GRAD(Rho)z 0.1692711E-16 Laplacian 0.5117250E+00 (-1/4)Del**2(Rho)) -0.1279312E+00 Diamond 0.8241393E+00 Metallicity 0.3995190E+01 Ellipticity 0.2002205E-01 Gb(Abramov) 0.1704724E+00 Vb(Abramov) -0.2130136E+00 Hb(Abramov) -0.4254120E-01 Ex_ueg -0.4428131E-01 Ec_ueg -0.6624099E-02 Delta_ex -0.5247209E-01 Delta_ec 0.1418389E-01 Delta_et -0.1834728E+00 Pxc 0.6684881E+01 Qxc -0.3699416E+01 3,-1 119 3 -1 -0.850169 3.023196 2.023112 Rho 0.1501825E+00 |GRAD(Rho)| 0.9900866E-12 GRAD(Rho)x -0.7048652E-12 GRAD(Rho)y 0.4384481E-12 GRAD(Rho)z -0.5396294E-12 Laplacian 0.5803222E+00 (-1/4)Del**2(Rho)) -0.1450806E+00 Diamond 0.1176524E+01 Metallicity 0.5038594E+01 Ellipticity 0.4444403E-01 Gb(Abramov) 0.2185540E+00 Vb(Abramov) -0.2920275E+00 Hb(Abramov) -0.7347349E-01 Ex_ueg -0.5895818E-01 Ec_ueg -0.8455196E-02 Delta_ex -0.6232766E-01 Delta_ec 0.1469805E-01 Delta_et -0.1956431E+00 Pxc 0.6973011E+01 Qxc -0.4240540E+01 3,-1 120 3 -1 -0.576943 2.769019 -1.785024 Rho 0.1177800E+00 |GRAD(Rho)| 0.2568636E-15 GRAD(Rho)x 0.2743031E-16 GRAD(Rho)y 0.2367288E-15 GRAD(Rho)z 0.9584347E-16 Laplacian 0.4990408E+00 (-1/4)Del**2(Rho)) -0.1247602E+00 Diamond 0.7783098E+00 Metallicity 0.3907779E+01 Ellipticity 0.1520048E-01 Gb(Abramov) 0.1644293E+00 Vb(Abramov) -0.2040985E+00 Hb(Abramov) -0.3966914E-01 Ex_ueg -0.4263968E-01 Ec_ueg -0.6414159E-02 Delta_ex -0.5085092E-01 Delta_ec 0.1395988E-01 Delta_et -0.1797052E+00 Pxc 0.6647743E+01 Qxc -0.3642648E+01 3,-1 121 3 +1 0.196452 3.005242 -0.174732 Rho 0.5563362E-02 |GRAD(Rho)| 0.1030328E-15 GRAD(Rho)x 0.6479663E-16 GRAD(Rho)y 0.8891872E-17 GRAD(Rho)z -0.7961214E-16 Laplacian 0.2161785E-01 (-1/4)Del**2(Rho)) -0.5404463E-02 Diamond 0.5131558E-03 Metallicity 0.5567961E+00 Ellipticity -0.2407032E+01 Gb(Abramov) 0.4104506E-02 Vb(Abramov) -0.2804549E-02 Hb(Abramov) 0.1299957E-02 Ex_ueg -0.7280617E-03 Ec_ueg -0.1712366E-03 Delta_ex -0.1041955E-02 Delta_ec 0.5817931E-03 Delta_et -0.3301928E-02 Pxc 0.4251789E+01 Qxc -0.1790938E+01 3,+1 122 3 +3 1.082517 1.112174 1.070193 Rho 0.4449984E-02 |GRAD(Rho)| 0.5979659E-14 GRAD(Rho)x 0.2618736E-14 GRAD(Rho)y 0.4718169E-14 GRAD(Rho)z 0.2576320E-14 Laplacian 0.1728548E-01 (-1/4)Del**2(Rho)) -0.4321370E-02 Diamond 0.1098090E-03 Metallicity 0.4799498E+00 Ellipticity -0.1891574E+00 Gb(Abramov) 0.3226587E-02 Vb(Abramov) -0.2131804E-02 Hb(Abramov) 0.1094783E-02 Ex_ueg -0.5405838E-03 Ec_ueg -0.1233207E-03 Delta_ex -0.5857363E-03 Delta_ec 0.8948760E-04 Delta_et -0.6551966E-03 Pxc 0.4383561E+01 Qxc -0.6545446E+01 3,+3 123 3 -1 0.240710 -1.106292 -1.921626 Rho 0.5881110E-02 |GRAD(Rho)| 0.1135439E-16 GRAD(Rho)x -0.3431889E-17 GRAD(Rho)y -0.4364739E-17 GRAD(Rho)z -0.9904211E-17 Laplacian 0.2313615E-01 (-1/4)Del**2(Rho)) -0.5784037E-02 Diamond 0.7901668E-03 Metallicity 0.5707172E+00 Ellipticity 0.2647916E+00 Gb(Abramov) 0.4406200E-02 Vb(Abramov) -0.3028362E-02 Hb(Abramov) 0.1377837E-02 Ex_ueg -0.7840266E-03 Ec_ueg -0.1850254E-03 Delta_ex -0.1276351E-02 Delta_ec 0.8874372E-03 Delta_et -0.4996982E-02 Pxc 0.4237399E+01 Qxc -0.1438244E+01 3,-1 124 3 +1 1.663366 0.497063 0.535519 Rho 0.7504387E-02 |GRAD(Rho)| 0.2787509E-15 GRAD(Rho)x -0.4997211E-16 GRAD(Rho)y 0.1388462E-15 GRAD(Rho)z -0.2364880E-15 Laplacian 0.2911097E-01 (-1/4)Del**2(Rho)) -0.7277741E-02 Diamond 0.6538884E-03 Metallicity 0.6808978E+00 Ellipticity -0.1408970E+01 Gb(Abramov) 0.5677727E-02 Vb(Abramov) -0.4077713E-02 Hb(Abramov) 0.1600014E-02 Ex_ueg -0.1085106E-02 Ec_ueg -0.2562293E-03 Delta_ex -0.1288744E-02 Delta_ec 0.4161727E-03 Delta_et -0.2740639E-02 Pxc 0.4234901E+01 Qxc -0.3096656E+01 3,+1 125 3 -1 -0.582817 -0.504716 -0.518537 Rho 0.1861026E+00 |GRAD(Rho)| 0.1857532E-14 GRAD(Rho)x 0.1196959E-14 GRAD(Rho)y 0.1009609E-14 GRAD(Rho)z 0.9992007E-15 Laplacian 0.4893065E+00 (-1/4)Del**2(Rho)) -0.1223266E+00 Diamond 0.1291708E+01 Metallicity 0.8543178E+01 Ellipticity 0.2575649E-01 Gb(Abramov) 0.2557274E+00 Vb(Abramov) -0.3891282E+00 Hb(Abramov) -0.1334008E+00 Ex_ueg -0.7847323E-01 Ec_ueg -0.1079342E-01 Delta_ex -0.5550142E-01 Delta_ec 0.1183850E-01 Delta_et -0.1619935E+00 Pxc 0.7270469E+01 Qxc -0.4688213E+01 3,-1 126 3 +3 1.943895 -1.988770 1.954112 Rho 0.1096946E-01 |GRAD(Rho)| 0.1473250E-16 GRAD(Rho)x 0.9719524E-17 GRAD(Rho)y 0.4885192E-18 GRAD(Rho)z -0.1106069E-16 Laplacian 0.4652734E-01 (-1/4)Del**2(Rho)) -0.1163184E-01 Diamond 0.1030236E-02 Metallicity 0.8020727E+00 Ellipticity -0.8978027E+00 Gb(Abramov) 0.9309487E-02 Vb(Abramov) -0.6987138E-02 Hb(Abramov) 0.2322349E-02 Ex_ueg -0.1800109E-02 Ec_ueg -0.4122072E-03 Delta_ex -0.2032295E-02 Delta_ec 0.2443703E-03 Delta_et -0.2081251E-02 Pxc 0.4367000E+01 Qxc -0.8316456E+01 3,+3 127 3 -1 -0.519822 0.445255 0.442096 Rho 0.1734917E+00 |GRAD(Rho)| 0.3334602E-12 GRAD(Rho)x 0.1738557E-12 GRAD(Rho)y -0.2066090E-12 GRAD(Rho)z -0.1956595E-12 Laplacian 0.4392096E+00 (-1/4)Del**2(Rho)) -0.1098024E+00 Diamond 0.1082148E+01 Metallicity 0.8467189E+01 Ellipticity 0.7681888E-02 Gb(Abramov) 0.2281546E+00 Vb(Abramov) -0.3465067E+00 Hb(Abramov) -0.1183522E+00 Ex_ueg -0.7146446E-01 Ec_ueg -0.9963919E-02 Delta_ex -0.4908290E-01 Delta_ec 0.1106386E-01 Delta_et -0.1509283E+00 Pxc 0.7172324E+01 Qxc -0.4436325E+01 3,-1 128 3 -1 0.085606 -2.045433 -1.125198 Rho 0.6709302E-02 |GRAD(Rho)| 0.7084489E-17 GRAD(Rho)x 0.5299090E-18 GRAD(Rho)y 0.7025245E-17 GRAD(Rho)z -0.7450572E-18 Laplacian 0.2483667E-01 (-1/4)Del**2(Rho)) -0.6209166E-02 Diamond 0.9397727E-03 Metallicity 0.6621893E+00 Ellipticity 0.1081860E+01 Gb(Abramov) 0.4824718E-02 Vb(Abramov) -0.3440270E-02 Hb(Abramov) 0.1384448E-02 Ex_ueg -0.9345909E-03 Ec_ueg -0.2211968E-03 Delta_ex -0.1358421E-02 Delta_ec 0.8710650E-03 Delta_et -0.5131598E-02 Pxc 0.4225156E+01 Qxc -0.1559494E+01 3,-1 129 3 -1 -0.064086 -3.263898 3.312787 Rho 0.1990219E+00 |GRAD(Rho)| 0.1815460E-14 GRAD(Rho)x -0.6600758E-15 GRAD(Rho)y 0.1086479E-14 GRAD(Rho)z 0.1296055E-14 Laplacian 0.7525617E+00 (-1/4)Del**2(Rho)) -0.1881404E+00 Diamond 0.2134111E+01 Metallicity 0.6212112E+01 Ellipticity 0.3160388E-02 Gb(Abramov) 0.3202185E+00 Vb(Abramov) -0.4522966E+00 Hb(Abramov) -0.1320781E+00 Ex_ueg -0.8581957E-01 Ec_ueg -0.1165259E-01 Delta_ex -0.8669423E-01 Delta_ec 0.1764633E-01 Delta_et -0.2421900E+00 Pxc 0.7364849E+01 Qxc -0.4912875E+01 3,-1 130 3 +1 0.519178 0.483828 1.660320 Rho 0.7827674E-02 |GRAD(Rho)| 0.5412784E-17 GRAD(Rho)x 0.1375156E-17 GRAD(Rho)y -0.4567159E-17 GRAD(Rho)z -0.2558953E-17 Laplacian 0.3068898E-01 (-1/4)Del**2(Rho)) -0.7672246E-02 Diamond 0.7336809E-03 Metallicity 0.6929234E+00 Ellipticity -0.1419337E+01 Gb(Abramov) 0.6000877E-02 Vb(Abramov) -0.4329508E-02 Hb(Abramov) 0.1671369E-02 Ex_ueg -0.1147877E-02 Ec_ueg -0.2705577E-03 Delta_ex -0.1374848E-02 Delta_ec 0.4420501E-03 Delta_et -0.2940432E-02 Pxc 0.4242633E+01 Qxc -0.3110164E+01 3,+1 131 3 -1 1.721798 1.740107 -0.531815 Rho 0.3876060E-01 |GRAD(Rho)| 0.6573823E-16 GRAD(Rho)x 0.1475235E-16 GRAD(Rho)y 0.5137212E-16 GRAD(Rho)z 0.3827255E-16 Laplacian 0.1626884E+00 (-1/4)Del**2(Rho)) -0.4067210E-01 Diamond 0.6255537E-01 Metallicity 0.1880359E+01 Ellipticity 0.2562735E-01 Gb(Abramov) 0.3986109E-01 Vb(Abramov) -0.3905008E-01 Hb(Abramov) 0.8110097E-03 Ex_ueg -0.9688110E-02 Ec_ueg -0.1803739E-02 Delta_ex -0.1282235E-01 Delta_ec 0.5311634E-02 Delta_et -0.5238438E-01 Pxc 0.5371127E+01 Qxc -0.2414013E+01 3,-1 132 3 -1 0.834632 -3.074335 2.044054 Rho 0.1198423E+00 |GRAD(Rho)| 0.3231504E-12 GRAD(Rho)x 0.2349623E-12 GRAD(Rho)y -0.1421463E-12 GRAD(Rho)z -0.1703330E-12 Laplacian 0.4887749E+00 (-1/4)Del**2(Rho)) -0.1221937E+00 Diamond 0.7720151E+00 Metallicity 0.4106969E+01 Ellipticity 0.1526133E-01 Gb(Abramov) 0.1651035E+00 Vb(Abramov) -0.2080132E+00 Hb(Abramov) -0.4290973E-01 Ex_ueg -0.4363806E-01 Ec_ueg -0.6541977E-02 Delta_ex -0.4992376E-01 Delta_ec 0.1346582E-01 Delta_et -0.1736556E+00 Pxc 0.6670470E+01 Qxc -0.3707444E+01 3,-1 133 3 -1 0.473467 -1.785206 1.733986 Rho 0.4036349E-01 |GRAD(Rho)| 0.2787674E-12 GRAD(Rho)x 0.7708965E-14 GRAD(Rho)y 0.1162462E-12 GRAD(Rho)z -0.2532561E-12 Laplacian 0.1698742E+00 (-1/4)Del**2(Rho)) -0.4246854E-01 Diamond 0.6932920E-01 Metallicity 0.1926639E+01 Ellipticity 0.2253741E-01 Gb(Abramov) 0.4194928E-01 Vb(Abramov) -0.4143003E-01 Hb(Abramov) 0.5192559E-03 Ex_ueg -0.1022594E-01 Ec_ueg -0.1889572E-02 Delta_ex -0.1353907E-01 Delta_ec 0.5577278E-02 Delta_et -0.5562521E-01 Pxc 0.5411775E+01 Qxc -0.2427541E+01 3,-1 134 3 +1 0.325770 -1.580245 -1.649822 Rho 0.5353628E-02 |GRAD(Rho)| 0.3335433E-17 GRAD(Rho)x 0.6434958E-18 GRAD(Rho)y -0.3129832E-17 GRAD(Rho)z -0.9566495E-18 Laplacian 0.2096889E-01 (-1/4)Del**2(Rho)) -0.5242223E-02 Diamond 0.4356349E-03 Metallicity 0.5384160E+00 Ellipticity -0.1842419E+01 Gb(Abramov) 0.3965231E-02 Vb(Abramov) -0.2688240E-02 Hb(Abramov) 0.1276991E-02 Ex_ueg -0.6916971E-03 Ec_ueg -0.1621624E-03 Delta_ex -0.9713338E-03 Delta_ec 0.5083088E-03 Delta_et -0.2878689E-02 Pxc 0.4265458E+01 Qxc -0.1910913E+01 3,+1 135 3 -1 0.549349 1.821108 2.786481 Rho 0.1467704E+00 |GRAD(Rho)| 0.1203270E-12 GRAD(Rho)x 0.8041765E-13 GRAD(Rho)y -0.8839698E-13 GRAD(Rho)z 0.1405590E-13 Laplacian 0.6067075E+00 (-1/4)Del**2(Rho)) -0.1516769E+00 Diamond 0.1189718E+01 Metallicity 0.4638364E+01 Ellipticity 0.1637270E-01 Gb(Abramov) 0.2183733E+00 Vb(Abramov) -0.2850698E+00 Hb(Abramov) -0.6669646E-01 Ex_ueg -0.5717899E-01 Ec_ueg -0.8237097E-02 Delta_ex -0.6472496E-01 Delta_ec 0.1532940E-01 Delta_et -0.2031100E+00 Pxc 0.6941644E+01 Qxc -0.4222277E+01 3,-1 136 3 -1 -0.087436 3.136530 -3.257123 Rho 0.2003689E+00 |GRAD(Rho)| 0.5822771E-15 GRAD(Rho)x 0.8936536E-16 GRAD(Rho)y -0.5482268E-15 GRAD(Rho)z 0.1746650E-15 Laplacian 0.7670314E+00 (-1/4)Del**2(Rho)) -0.1917579E+00 Diamond 0.2184971E+01 Metallicity 0.6163829E+01 Ellipticity 0.3480013E-02 Gb(Abramov) 0.3248323E+00 Vb(Abramov) -0.4579068E+00 Hb(Abramov) -0.1330745E+00 Ex_ueg -0.8659487E-01 Ec_ueg -0.1174271E-01 Delta_ex -0.8846005E-01 Delta_ec 0.1785723E-01 Delta_et -0.2448889E+00 Pxc 0.7374353E+01 Qxc -0.4953739E+01 3,-1 137 3 -1 0.546745 2.831028 1.842434 Rho 0.1426766E+00 |GRAD(Rho)| 0.5393669E-15 GRAD(Rho)x 0.2361799E-15 GRAD(Rho)y 0.1006275E-15 GRAD(Rho)z -0.4743520E-15 Laplacian 0.5907753E+00 (-1/4)Del**2(Rho)) -0.1476938E+00 Diamond 0.1124209E+01 Metallicity 0.4544074E+01 Ellipticity 0.1163932E-01 Gb(Abramov) 0.2103178E+00 Vb(Abramov) -0.2729418E+00 Hb(Abramov) -0.6262400E-01 Ex_ueg -0.5506243E-01 Ec_ueg -0.7976371E-02 Delta_ex -0.6263701E-01 Delta_ec 0.1511585E-01 Delta_et -0.1996552E+00 Pxc 0.6903193E+01 Qxc -0.4143795E+01 3,-1 138 3 -1 0.073499 3.227160 3.240957 Rho 0.2240723E+00 |GRAD(Rho)| 0.1251356E-11 GRAD(Rho)x -0.2705704E-12 GRAD(Rho)y -0.8634120E-12 GRAD(Rho)z -0.8644093E-12 Laplacian 0.8256027E+00 (-1/4)Del**2(Rho)) -0.2064007E+00 Diamond 0.2693295E+01 Metallicity 0.6899576E+01 Ellipticity 0.1644509E-02 Gb(Abramov) 0.3749467E+00 Vb(Abramov) -0.5434926E+00 Hb(Abramov) -0.1685460E+00 Ex_ueg -0.1005162E+00 Ec_ueg -0.1334503E-01 Delta_ex -0.9801227E-01 Delta_ec 0.1865893E-01 Delta_et -0.2579035E+00 Pxc 0.7532106E+01 Qxc -0.5252834E+01 3,-1 139 3 +1 0.399384 -1.795142 -0.777986 Rho 0.6201764E-02 |GRAD(Rho)| 0.3211578E-13 GRAD(Rho)x -0.2651364E-13 GRAD(Rho)y 0.1799314E-13 GRAD(Rho)z -0.2167321E-14 Laplacian 0.2250983E-01 (-1/4)Del**2(Rho)) -0.5627458E-02 Diamond 0.5032416E-03 Metallicity 0.6408646E+00 Ellipticity -0.1837032E+01 Gb(Abramov) 0.4352712E-02 Vb(Abramov) -0.3077966E-02 Hb(Abramov) 0.1274746E-02 Ex_ueg -0.8415347E-03 Ec_ueg -0.1989906E-03 Delta_ex -0.1029400E-02 Delta_ec 0.4623508E-03 Delta_et -0.2775026E-02 Pxc 0.4229017E+01 Qxc -0.2226448E+01 3,+1 140 3 -1 0.402827 -0.525482 0.422921 Rho 0.1783426E+00 |GRAD(Rho)| 0.1325624E-14 GRAD(Rho)x -0.7771561E-15 GRAD(Rho)y 0.8396062E-15 GRAD(Rho)z -0.6696033E-15 Laplacian 0.4594044E+00 (-1/4)Del**2(Rho)) -0.1148511E+00 Diamond 0.1168433E+01 Metallicity 0.8475716E+01 Ellipticity 0.3058587E-02 Gb(Abramov) 0.2388083E+00 Vb(Abramov) -0.3627655E+00 Hb(Abramov) -0.1239572E+00 Ex_ueg -0.7414100E-01 Ec_ueg -0.1028191E-01 Delta_ex -0.5168168E-01 Delta_ec 0.1146831E-01 Delta_et -0.1568932E+00 Pxc 0.7210819E+01 Qxc -0.4506476E+01 3,-1 141 3 -1 0.426540 0.425820 -0.507719 Rho 0.1769089E+00 |GRAD(Rho)| 0.1414692E-14 GRAD(Rho)x -0.7459311E-15 GRAD(Rho)y -0.7945034E-15 GRAD(Rho)z 0.9020562E-15 Laplacian 0.4573846E+00 (-1/4)Del**2(Rho)) -0.1143462E+00 Diamond 0.1151756E+01 Metallicity 0.8399390E+01 Ellipticity 0.2491361E-02 Gb(Abramov) 0.2363038E+00 Vb(Abramov) -0.3582614E+00 Hb(Abramov) -0.1219576E+00 Ex_ueg -0.7334738E-01 Ec_ueg -0.1018779E-01 Delta_ex -0.5134822E-01 Delta_ec 0.1143722E-01 Delta_et -0.1563085E+00 Pxc 0.7199541E+01 Qxc -0.4489574E+01 3,-1 142 3 -1 0.523782 1.680765 -1.731845 Rho 0.4941141E-01 |GRAD(Rho)| 0.8235610E-16 GRAD(Rho)x -0.6323524E-17 GRAD(Rho)y -0.7133881E-16 GRAD(Rho)z 0.4066097E-16 Laplacian 0.2098038E+00 (-1/4)Del**2(Rho)) -0.5245096E-01 Diamond 0.1119884E+00 Metallicity 0.2185304E+01 Ellipticity 0.1634208E-01 Gb(Abramov) 0.5407085E-01 Vb(Abramov) -0.5569075E-01 Hb(Abramov) -0.1619894E-02 Ex_ueg -0.1339126E-01 Ec_ueg -0.2382365E-02 Delta_ex -0.1753910E-01 Delta_ec 0.6825023E-02 Delta_et -0.7190344E-01 Pxc 0.5620994E+01 Qxc -0.2569823E+01 3,-1 143 3 -1 0.885593 1.919595 -3.022435 Rho 0.1094179E+00 |GRAD(Rho)| 0.8668824E-16 GRAD(Rho)x 0.6711211E-16 GRAD(Rho)y -0.3045253E-16 GRAD(Rho)z -0.4564491E-16 Laplacian 0.4447858E+00 (-1/4)Del**2(Rho)) -0.1111964E+00 Diamond 0.6343217E+00 Metallicity 0.3878015E+01 Ellipticity 0.2214083E-01 Gb(Abramov) 0.1460012E+00 Vb(Abramov) -0.1808060E+00 Hb(Abramov) -0.3480476E-01 Ex_ueg -0.3865178E-01 Ec_ueg -0.5899003E-02 Delta_ex -0.4453829E-01 Delta_ec 0.1263621E-01 Delta_et -0.1603978E+00 Pxc 0.6552257E+01 Qxc -0.3524657E+01 3,-1 144 3 +1 1.758373 1.803101 1.765566 Rho 0.1200150E-01 |GRAD(Rho)| 0.2056118E-14 GRAD(Rho)x -0.9455333E-15 GRAD(Rho)y -0.7575653E-15 GRAD(Rho)z 0.1661229E-14 Laplacian 0.5802698E-01 (-1/4)Del**2(Rho)) -0.1450674E-01 Diamond 0.2240611E-02 Metallicity 0.7470953E+00 Ellipticity -0.1247867E+01 Gb(Abramov) 0.1147748E-01 Vb(Abramov) -0.8448222E-02 Hb(Abramov) 0.3029261E-02 Ex_ueg -0.2029392E-02 Ec_ueg -0.4596385E-03 Delta_ex -0.2827835E-02 Delta_ec 0.7093729E-03 Delta_et -0.5352947E-02 Pxc 0.4415192E+01 Qxc -0.3986387E+01 3,+1 145 3 -1 1.255852 -2.338614 -2.054121 Rho 0.5985146E-01 |GRAD(Rho)| 0.5006479E-13 GRAD(Rho)x -0.1195778E-14 GRAD(Rho)y -0.3575091E-13 GRAD(Rho)z 0.3502750E-13 Laplacian 0.1309443E+00 (-1/4)Del**2(Rho)) -0.3273607E-01 Diamond 0.1418510E+00 Metallicity 0.4819307E+01 Ellipticity 0.6179764E-02 Gb(Abramov) 0.4811824E-01 Vb(Abramov) -0.6350041E-01 Hb(Abramov) -0.1538217E-01 Ex_ueg -0.1729092E-01 Ec_ueg -0.2966255E-02 Delta_ex -0.1321683E-01 Delta_ec 0.7352556E-02 Delta_et -0.8277240E-01 Pxc 0.5829208E+01 Qxc -0.1797582E+01 3,-1 146 3 +3 0.992063 -1.176812 -1.219046 Rho 0.4295560E-02 |GRAD(Rho)| 0.3046409E-17 GRAD(Rho)x -0.5942829E-18 GRAD(Rho)y 0.2888164E-17 GRAD(Rho)z 0.7654713E-18 Laplacian 0.1635652E-01 (-1/4)Del**2(Rho)) -0.4089130E-02 Diamond 0.1312097E-03 Metallicity 0.4782136E+00 Ellipticity -0.5818204E+00 Gb(Abramov) 0.3052000E-02 Vb(Abramov) -0.2014869E-02 Hb(Abramov) 0.1037130E-02 Ex_ueg -0.5157170E-03 Ec_ueg -0.1167250E-03 Delta_ex -0.5855654E-03 Delta_ec 0.1500216E-03 Delta_et -0.9280029E-03 Pxc 0.4418223E+01 Qxc -0.3903208E+01 3,+3 147 3 +3 2.302814 -0.034353 0.032122 Rho 0.4217049E-02 |GRAD(Rho)| 0.7845764E-15 GRAD(Rho)x -0.5624936E-15 GRAD(Rho)y -0.3919786E-15 GRAD(Rho)z 0.3814628E-15 Laplacian 0.1711161E-01 (-1/4)Del**2(Rho)) -0.4277903E-02 Diamond 0.1240588E-03 Metallicity 0.4432716E+00 Ellipticity -0.2987737E+00 Gb(Abramov) 0.3167981E-02 Vb(Abramov) -0.2058059E-02 Hb(Abramov) 0.1109922E-02 Ex_ueg -0.5031875E-03 Ec_ueg -0.1133764E-03 Delta_ex -0.5982943E-03 Delta_ec 0.1365232E-03 Delta_et -0.8695372E-03 Pxc 0.4438204E+01 Qxc -0.4382365E+01 3,+3 148 3 -1 1.794976 0.515224 -1.742277 Rho 0.3970350E-01 |GRAD(Rho)| 0.1203348E-15 GRAD(Rho)x 0.9379683E-16 GRAD(Rho)y -0.3527924E-16 GRAD(Rho)z -0.6661829E-16 Laplacian 0.1556828E+00 (-1/4)Del**2(Rho)) -0.3892071E-01 Diamond 0.5633961E-01 Metallicity 0.2045284E+01 Ellipticity 0.3238814E-01 Gb(Abramov) 0.3921446E-01 Vb(Abramov) -0.3950821E-01 Hb(Abramov) -0.2937487E-03 Ex_ueg -0.1000361E-01 Ec_ueg -0.1854173E-02 Delta_ex -0.1201906E-01 Delta_ec 0.4505787E-02 Delta_et -0.4467455E-01 Pxc 0.5395186E+01 Qxc -0.2667472E+01 3,-1 149 3 +1 2.198372 1.385605 -1.081659 Rho 0.2373393E-01 |GRAD(Rho)| 0.1504971E-10 GRAD(Rho)x 0.2447251E-11 GRAD(Rho)y 0.1132389E-10 GRAD(Rho)z 0.9605950E-11 Laplacian 0.8915383E-01 (-1/4)Del**2(Rho)) -0.2228846E-01 Diamond 0.1040687E-01 Metallicity 0.1515035E+01 Ellipticity -0.3233104E+01 Gb(Abramov) 0.2048694E-01 Vb(Abramov) -0.1868542E-01 Hb(Abramov) 0.1801521E-02 Ex_ueg -0.5037456E-02 Ec_ueg -0.1025183E-02 Delta_ex -0.5416368E-02 Delta_ec 0.1419655E-02 Delta_et -0.1239758E-01 Pxc 0.4913714E+01 Qxc -0.3815270E+01 3,+1 150 3 -1 1.819107 -2.922368 -0.690491 Rho 0.1732974E+00 |GRAD(Rho)| 0.2972487E-15 GRAD(Rho)x 0.4727121E-16 GRAD(Rho)y 0.9947555E-16 GRAD(Rho)z -0.2760921E-15 Laplacian 0.6749170E+00 (-1/4)Del**2(Rho)) -0.1687292E+00 Diamond 0.1627688E+01 Metallicity 0.5499832E+01 Ellipticity 0.1503303E-01 Gb(Abramov) 0.2671499E+00 Vb(Abramov) -0.3655706E+00 Hb(Abramov) -0.9842066E-01 Ex_ueg -0.7135772E-01 Ec_ueg -0.9951205E-02 Delta_ex -0.7513187E-01 Delta_ec 0.1652260E-01 Delta_et -0.2240336E+00 Pxc 0.7170762E+01 Qxc -0.4547219E+01 3,-1 151 3 +1 2.000707 -2.041319 2.013011 Rho 0.1097931E-01 |GRAD(Rho)| 0.2122674E-16 GRAD(Rho)x -0.1745081E-16 GRAD(Rho)y 0.1188167E-17 GRAD(Rho)z 0.1202630E-16 Laplacian 0.4678711E-01 (-1/4)Del**2(Rho)) -0.1169678E-01 Diamond 0.1206894E-02 Metallicity 0.7988139E+00 Ellipticity -0.1080453E+01 Gb(Abramov) 0.9355109E-02 Vb(Abramov) -0.7013441E-02 Hb(Abramov) 0.2341668E-02 Ex_ueg -0.1802265E-02 Ec_ueg -0.4126579E-03 Delta_ex -0.2099351E-02 Delta_ec 0.3442558E-03 Delta_et -0.2736825E-02 Pxc 0.4367455E+01 Qxc -0.6098230E+01 3,+1 152 3 -1 3.010902 0.063295 -0.032286 Rho 0.5354427E-02 |GRAD(Rho)| 0.4002244E-17 GRAD(Rho)x 0.6077369E-18 GRAD(Rho)y 0.1387754E-17 GRAD(Rho)z -0.3704423E-17 Laplacian 0.2100876E-01 (-1/4)Del**2(Rho)) -0.5252189E-02 Diamond 0.6075816E-03 Metallicity 0.5375281E+00 Ellipticity 0.4065664E+01 Gb(Abramov) 0.3971992E-02 Vb(Abramov) -0.2691796E-02 Hb(Abramov) 0.1280196E-02 Ex_ueg -0.6918348E-03 Ec_ueg -0.1621970E-03 Delta_ex -0.1118165E-02 Delta_ec 0.7680765E-03 Delta_et -0.4215200E-02 Pxc 0.4265399E+01 Qxc -0.1455799E+01 3,-1 153 3 +1 1.372256 2.178288 -1.105058 Rho 0.2472321E-01 |GRAD(Rho)| 0.4359537E-14 GRAD(Rho)x 0.3117788E-14 GRAD(Rho)y 0.1996594E-14 GRAD(Rho)z 0.2301863E-14 Laplacian 0.8988851E-01 (-1/4)Del**2(Rho)) -0.2247213E-01 Diamond 0.1098110E-01 Metallicity 0.1608485E+01 Ellipticity -0.3702905E+01 Gb(Abramov) 0.2100576E-01 Vb(Abramov) -0.1953940E-01 Hb(Abramov) 0.1466363E-02 Ex_ueg -0.5319344E-02 Ec_ueg -0.1074788E-02 Delta_ex -0.5508231E-02 Delta_ec 0.1407943E-02 Delta_et -0.1242249E-01 Pxc 0.4949203E+01 Qxc -0.3912254E+01 3,+1 154 3 -1 1.961564 -3.109660 0.840697 Rho 0.1284110E+00 |GRAD(Rho)| 0.4391893E-15 GRAD(Rho)x 0.2272894E-15 GRAD(Rho)y -0.1215797E-15 GRAD(Rho)z -0.3555912E-15 Laplacian 0.5142651E+00 (-1/4)Del**2(Rho)) -0.1285663E+00 Diamond 0.8860483E+00 Metallicity 0.4379554E+01 Ellipticity 0.1802495E-01 Gb(Abramov) 0.1795547E+00 Vb(Abramov) -0.2305431E+00 Hb(Abramov) -0.5098839E-01 Ex_ueg -0.4784700E-01 Ec_ueg -0.7076190E-02 Delta_ex -0.5344033E-01 Delta_ec 0.1401791E-01 Delta_et -0.1831070E+00 Pxc 0.6761690E+01 Qxc -0.3812290E+01 3,-1 155 3 +1 1.971522 -1.811046 -1.746378 Rho 0.1543765E-01 |GRAD(Rho)| 0.1693546E-16 GRAD(Rho)x -0.1302792E-16 GRAD(Rho)y -0.1077090E-16 GRAD(Rho)z -0.1034930E-17 Laplacian 0.6849840E-01 (-1/4)Del**2(Rho)) -0.1712460E-01 Diamond 0.3835128E-02 Metallicity 0.9628704E+00 Ellipticity -0.1475034E+01 Gb(Abramov) 0.1416453E-01 Vb(Abramov) -0.1120446E-01 Hb(Abramov) 0.2960072E-02 Ex_ueg -0.2838963E-02 Ec_ueg -0.6205007E-03 Delta_ex -0.3591376E-02 Delta_ec 0.8726061E-03 Delta_et -0.6963979E-02 Pxc 0.4575278E+01 Qxc -0.4115690E+01 3,+1 156 3 -1 1.797714 2.850797 0.591528 Rho 0.1244567E+00 |GRAD(Rho)| 0.1760267E-13 GRAD(Rho)x 0.1356388E-13 GRAD(Rho)y -0.1961010E-14 GRAD(Rho)z -0.1104669E-13 Laplacian 0.5340309E+00 (-1/4)Del**2(Rho)) -0.1335077E+00 Diamond 0.8915957E+00 Metallicity 0.4003232E+01 Ellipticity 0.1234930E-01 Gb(Abramov) 0.1780822E+00 Vb(Abramov) -0.2226567E+00 Hb(Abramov) -0.4457450E-01 Ex_ueg -0.4589263E-01 Ec_ueg -0.6829040E-02 Delta_ex -0.5515163E-01 Delta_ec 0.1478743E-01 Delta_et -0.1923235E+00 Pxc 0.6720217E+01 Qxc -0.3729630E+01 3,-1 157 3 -1 2.005593 3.059064 -0.879328 Rho 0.1274051E+00 |GRAD(Rho)| 0.2580627E-14 GRAD(Rho)x 0.1419966E-14 GRAD(Rho)y -0.9206367E-15 GRAD(Rho)z 0.1948271E-14 Laplacian 0.5158591E+00 (-1/4)Del**2(Rho)) -0.1289648E+00 Diamond 0.8762772E+00 Metallicity 0.4309166E+01 Ellipticity 0.1096588E-01 Gb(Abramov) 0.1785983E+00 Vb(Abramov) -0.2282318E+00 Hb(Abramov) -0.4963351E-01 Ex_ueg -0.4734789E-01 Ec_ueg -0.7013217E-02 Delta_ex -0.5345394E-01 Delta_ec 0.1399537E-01 Delta_et -0.1824055E+00 Pxc 0.6751238E+01 Qxc -0.3819400E+01 3,-1 158 3 -1 2.014996 -0.840333 3.025986 Rho 0.1548282E+00 |GRAD(Rho)| 0.2021526E-15 GRAD(Rho)x 0.7917386E-16 GRAD(Rho)y -0.7909255E-16 GRAD(Rho)z 0.1683495E-15 Laplacian 0.6067463E+00 (-1/4)Del**2(Rho)) -0.1516866E+00 Diamond 0.1271932E+01 Metallicity 0.5070173E+01 Ellipticity 0.3157433E-01 Gb(Abramov) 0.2293039E+00 Vb(Abramov) -0.3069213E+00 Hb(Abramov) -0.7761735E-01 Ex_ueg -0.6140237E-01 Ec_ueg -0.8753302E-02 Delta_ex -0.6561846E-01 Delta_ec 0.1518249E-01 Delta_et -0.2027646E+00 Pxc 0.7014767E+01 Qxc -0.4321982E+01 3,-1 159 3 -1 1.986954 -0.602818 -2.818617 Rho 0.1452944E+00 |GRAD(Rho)| 0.2703970E-13 GRAD(Rho)x 0.2460792E-13 GRAD(Rho)y 0.6991600E-14 GRAD(Rho)z -0.8758612E-14 Laplacian 0.5458144E+00 (-1/4)Del**2(Rho)) -0.1364536E+00 Diamond 0.1079732E+01 Metallicity 0.5069707E+01 Ellipticity 0.1063156E+00 Gb(Abramov) 0.2062657E+00 Vb(Abramov) -0.2760778E+00 Hb(Abramov) -0.6981210E-01 Ex_ueg -0.5641356E-01 Ec_ueg -0.8142970E-02 Delta_ex -0.5831665E-01 Delta_ec 0.1423992E-01 Delta_et -0.1893269E+00 Pxc 0.6927884E+01 Qxc -0.4095293E+01 3,-1 160 3 +1 3.009732 0.167399 -0.131000 Rho 0.5345873E-02 |GRAD(Rho)| 0.2551333E-16 GRAD(Rho)x 0.1022796E-17 GRAD(Rho)y 0.2547819E-16 GRAD(Rho)z -0.8635468E-18 Laplacian 0.2134169E-01 (-1/4)Del**2(Rho)) -0.5335422E-02 Diamond 0.5469606E-03 Metallicity 0.5277345E+00 Ellipticity -0.4268312E+01 Gb(Abramov) 0.4026229E-02 Vb(Abramov) -0.2717036E-02 Hb(Abramov) 0.1309193E-02 Ex_ueg -0.6903616E-03 Ec_ueg -0.1618274E-03 Delta_ex -0.1077009E-02 Delta_ec 0.6757291E-03 Delta_et -0.3742702E-02 Pxc 0.4266037E+01 Qxc -0.1593847E+01 3,+1 161 3 -1 1.718251 -0.579207 1.709816 Rho 0.3880358E-01 |GRAD(Rho)| 0.3808787E-12 GRAD(Rho)x 0.3621074E-12 GRAD(Rho)y -0.9866976E-13 GRAD(Rho)z 0.6489278E-13 Laplacian 0.1506038E+00 (-1/4)Del**2(Rho)) -0.3765094E-01 Diamond 0.5280766E-01 Metallicity 0.2034997E+01 Ellipticity 0.2093440E-01 Gb(Abramov) 0.3787055E-01 Vb(Abramov) -0.3809016E-01 Hb(Abramov) -0.2196107E-03 Ex_ueg -0.9702437E-02 Ec_ueg -0.1806034E-02 Delta_ex -0.1155954E-01 Delta_ec 0.4357247E-02 Delta_et -0.4293669E-01 Pxc 0.5372233E+01 Qxc -0.2652946E+01 3,-1 162 3 -1 1.813558 0.551981 2.769504 Rho 0.1178535E+00 |GRAD(Rho)| 0.2767409E-15 GRAD(Rho)x 0.1540109E-15 GRAD(Rho)y -0.2292003E-15 GRAD(Rho)z -0.1825864E-16 Laplacian 0.4886755E+00 (-1/4)Del**2(Rho)) -0.1221689E+00 Diamond 0.7396047E+00 Metallicity 0.3994815E+01 Ellipticity 0.1046157E-01 Gb(Abramov) 0.1627863E+00 Vb(Abramov) -0.2034036E+00 Hb(Abramov) -0.4061739E-01 Ex_ueg -0.4267514E-01 Ec_ueg -0.6418707E-02 Delta_ex -0.4948450E-01 Delta_ec 0.1310104E-01 Delta_et -0.1677970E+00 Pxc 0.6648558E+01 Qxc -0.3777144E+01 3,-1 163 3 -1 2.089417 0.802271 -3.021852 Rho 0.1438445E+00 |GRAD(Rho)| 0.3095191E-13 GRAD(Rho)x 0.9087105E-15 GRAD(Rho)y -0.1523284E-13 GRAD(Rho)z -0.2692871E-13 Laplacian 0.5600350E+00 (-1/4)Del**2(Rho)) -0.1400087E+00 Diamond 0.1076472E+01 Metallicity 0.4859076E+01 Ellipticity 0.2600710E-01 Gb(Abramov) 0.2067247E+00 Vb(Abramov) -0.2734406E+00 Hb(Abramov) -0.6671593E-01 Ex_ueg -0.5566424E-01 Ec_ueg -0.8050648E-02 Delta_ex -0.5949911E-01 Delta_ec 0.1430577E-01 Delta_et -0.1891914E+00 Pxc 0.6914255E+01 Qxc -0.4159100E+01 3,-1 164 3 -1 2.978485 -2.042586 0.838216 Rho 0.7466006E-01 |GRAD(Rho)| 0.5394927E-15 GRAD(Rho)x 0.1379596E-15 GRAD(Rho)y 0.3064396E-15 GRAD(Rho)z 0.4220359E-15 Laplacian 0.3125978E+00 (-1/4)Del**2(Rho)) -0.7814946E-01 Diamond 0.2805744E+00 Metallicity 0.2918151E+01 Ellipticity 0.6005273E-02 Gb(Abramov) 0.9010829E-01 Vb(Abramov) -0.1020671E+00 Hb(Abramov) -0.1195883E-01 Ex_ueg -0.2321861E-01 Ec_ueg -0.3817643E-02 Delta_ex -0.2868882E-01 Delta_ec 0.9612910E-02 Delta_et -0.1123788E+00 Pxc 0.6081923E+01 Qxc -0.2984406E+01 3,-1 165 3 +3 1.980773 1.948752 -1.966564 Rho 0.1150909E-01 |GRAD(Rho)| 0.8045075E-13 GRAD(Rho)x -0.7320245E-13 GRAD(Rho)y 0.2325371E-13 GRAD(Rho)z -0.2393718E-13 Laplacian 0.4838890E-01 (-1/4)Del**2(Rho)) -0.1209722E-01 Diamond 0.1093044E-02 Metallicity 0.8354798E+00 Ellipticity -0.9193961E+00 Gb(Abramov) 0.9749314E-02 Vb(Abramov) -0.7401404E-02 Hb(Abramov) 0.2347910E-02 Ex_ueg -0.1919139E-02 Ec_ueg -0.4369547E-03 Delta_ex -0.2127031E-02 Delta_ec 0.2255178E-03 Delta_et -0.1989867E-02 Pxc 0.4392079E+01 Qxc -0.9431763E+01 3,+3 166 3 -1 2.797182 -1.854383 -0.606203 Rho 0.9884165E-01 |GRAD(Rho)| 0.1046165E-15 GRAD(Rho)x -0.9567745E-16 GRAD(Rho)y -0.3867891E-16 GRAD(Rho)z -0.1715750E-16 Laplacian 0.4252592E+00 (-1/4)Del**2(Rho)) -0.1063148E+00 Diamond 0.5420102E+00 Metallicity 0.3423939E+01 Ellipticity 0.1680405E-01 Gb(Abramov) 0.1315458E+00 Vb(Abramov) -0.1567767E+00 Hb(Abramov) -0.2523097E-01 Ex_ueg -0.3375243E-01 Ec_ueg -0.5254937E-02 Delta_ex -0.4168638E-01 Delta_ec 0.1252426E-01 Delta_et -0.1559772E+00 Pxc 0.6422994E+01 Qxc -0.3328452E+01 3,-1 167 3 +1 2.175157 -1.488301 1.002113 Rho 0.2253314E-01 |GRAD(Rho)| 0.2484368E-16 GRAD(Rho)x -0.1727299E-16 GRAD(Rho)y -0.1667602E-16 GRAD(Rho)z -0.6384541E-17 Laplacian 0.8299027E-01 (-1/4)Del**2(Rho)) -0.2074757E-01 Diamond 0.7929320E-02 Metallicity 0.1492642E+01 Ellipticity -0.2196123E+01 Gb(Abramov) 0.1899316E-01 Vb(Abramov) -0.1723875E-01 Hb(Abramov) 0.1754408E-02 Ex_ueg -0.4700536E-02 Ec_ueg -0.9653321E-03 Delta_ex -0.4836272E-02 Delta_ec 0.1078875E-02 Delta_et -0.9381836E-02 Pxc 0.4869346E+01 Qxc -0.4482700E+01 3,+1 168 3 -1 3.038250 -0.856323 2.015429 Rho 0.1774696E+00 |GRAD(Rho)| 0.4532817E-11 GRAD(Rho)x -0.2065924E-11 GRAD(Rho)y 0.3236373E-11 GRAD(Rho)z 0.2409206E-11 Laplacian 0.6818462E+00 (-1/4)Del**2(Rho)) -0.1704615E+00 Diamond 0.1686071E+01 Metallicity 0.5664134E+01 Ellipticity 0.3786154E-01 Gb(Abramov) 0.2745605E+00 Vb(Abramov) -0.3786595E+00 Hb(Abramov) -0.1040990E+00 Ex_ueg -0.7365752E-01 Ec_ueg -0.1022459E-01 Delta_ex -0.7630982E-01 Delta_ec 0.1650386E-01 Delta_et -0.2241202E+00 Pxc 0.7203962E+01 Qxc -0.4623755E+01 3,-1 169 3 -1 2.895920 -0.550530 -1.812685 Rho 0.1616734E+00 |GRAD(Rho)| 0.2035629E-15 GRAD(Rho)x 0.1031076E-15 GRAD(Rho)y -0.1724424E-15 GRAD(Rho)z 0.3271580E-16 Laplacian 0.6561939E+00 (-1/4)Del**2(Rho)) -0.1640485E+00 Diamond 0.1444027E+01 Metallicity 0.5038622E+01 Ellipticity 0.2026105E-01 Gb(Abramov) 0.2471287E+00 Vb(Abramov) -0.3302089E+00 Hb(Abramov) -0.8308022E-01 Ex_ueg -0.6504836E-01 Ec_ueg -0.9194918E-02 Delta_ex -0.7168674E-01 Delta_ec 0.1616175E-01 Delta_et -0.2168378E+00 Pxc 0.7074382E+01 Qxc -0.4435581E+01 3,-1 170 3 +1 3.019154 -0.170869 0.186942 Rho 0.5279864E-02 |GRAD(Rho)| 0.4117979E-17 GRAD(Rho)x -0.1507594E-18 GRAD(Rho)y 0.1792737E-17 GRAD(Rho)z 0.3704202E-17 Laplacian 0.2117124E-01 (-1/4)Del**2(Rho)) -0.5292809E-02 Diamond 0.4926094E-03 Metallicity 0.5210805E+00 Ellipticity -0.2418185E+01 Gb(Abramov) 0.3988203E-02 Vb(Abramov) -0.2683596E-02 Hb(Abramov) 0.1304606E-02 Ex_ueg -0.6790192E-03 Ec_ueg -0.1589763E-03 Delta_ex -0.1030433E-02 Delta_ec 0.6071324E-03 Delta_et -0.3375496E-02 Pxc 0.4271197E+01 Qxc -0.1697212E+01 3,+1 171 3 -1 2.788970 1.838525 0.589275 Rho 0.1182576E+00 |GRAD(Rho)| 0.1591211E-15 GRAD(Rho)x -0.9806947E-16 GRAD(Rho)y -0.1044222E-15 GRAD(Rho)z -0.6926697E-16 Laplacian 0.5112187E+00 (-1/4)Del**2(Rho)) -0.1278047E+00 Diamond 0.8035283E+00 Metallicity 0.3840504E+01 Ellipticity 0.1171863E-01 Gb(Abramov) 0.1670088E+00 Vb(Abramov) -0.2062130E+00 Hb(Abramov) -0.3920417E-01 Ex_ueg -0.4287036E-01 Ec_ueg -0.6443731E-02 Delta_ex -0.5217348E-01 Delta_ec 0.1434437E-01 Delta_et -0.1848804E+00 Pxc 0.6653034E+01 Qxc -0.3637211E+01 3,-1 172 3 -1 3.043359 2.033924 -0.858484 Rho 0.1140374E+00 |GRAD(Rho)| 0.2963118E-14 GRAD(Rho)x 0.2413041E-14 GRAD(Rho)y 0.1629922E-14 GRAD(Rho)z 0.5483217E-15 Laplacian 0.4702715E+00 (-1/4)Del**2(Rho)) -0.1175679E+00 Diamond 0.7066477E+00 Metallicity 0.3929557E+01 Ellipticity 0.1255874E-01 Gb(Abramov) 0.1553769E+00 Vb(Abramov) -0.1931859E+00 Hb(Abramov) -0.3780899E-01 Ex_ueg -0.4084275E-01 Ec_ueg -0.6182969E-02 Delta_ex -0.4757343E-01 Delta_ec 0.1328153E-01 Delta_et -0.1699906E+00 Pxc 0.6605687E+01 Qxc -0.3581925E+01 3,-1 173 3 -1 3.374251 -0.038568 -3.197499 Rho 0.2234510E+00 |GRAD(Rho)| 0.5723720E-15 GRAD(Rho)x 0.1366095E-16 GRAD(Rho)y 0.7715454E-16 GRAD(Rho)z 0.5669835E-15 Laplacian 0.8167887E+00 (-1/4)Del**2(Rho)) -0.2041972E+00 Diamond 0.2658444E+01 Metallicity 0.6941829E+01 Ellipticity 0.2517189E-02 Gb(Abramov) 0.3723818E+00 Vb(Abramov) -0.5405664E+00 Hb(Abramov) -0.1681846E+00 Ex_ueg -0.1001447E+00 Ec_ueg -0.1330263E-01 Delta_ex -0.9691252E-01 Delta_ec 0.1850357E-01 Delta_et -0.2558353E+00 Pxc 0.7528188E+01 Qxc -0.5237503E+01 3,-1 174 3 -1 3.209334 -3.309889 -0.094846 Rho 0.1942930E+00 |GRAD(Rho)| 0.2202744E-10 GRAD(Rho)x -0.1668259E-10 GRAD(Rho)y 0.1411975E-10 GRAD(Rho)z 0.2744461E-11 Laplacian 0.7367776E+00 (-1/4)Del**2(Rho)) -0.1841944E+00 Diamond 0.2032374E+01 Metallicity 0.6095911E+01 Ellipticity 0.9363999E-02 Gb(Abramov) 0.3099350E+00 Vb(Abramov) -0.4356757E+00 Hb(Abramov) -0.1257406E+00 Ex_ueg -0.8311152E-01 Ec_ueg -0.1133701E-01 Delta_ex -0.8437542E-01 Delta_ec 0.1742156E-01 Delta_et -0.2387237E+00 Pxc 0.7330989E+01 Qxc -0.4843160E+01 3,-1 175 3 -1 -3.354838 -3.229967 0.053210 Rho 0.2002146E+00 |GRAD(Rho)| 0.6069420E-15 GRAD(Rho)x 0.2142383E-15 GRAD(Rho)y -0.5661704E-15 GRAD(Rho)z -0.4395085E-16 Laplacian 0.7627815E+00 (-1/4)Del**2(Rho)) -0.1906954E+00 Diamond 0.2178441E+01 Metallicity 0.6190217E+01 Ellipticity 0.7583939E-03 Gb(Abramov) 0.3238712E+00 Vb(Abramov) -0.4570470E+00 Hb(Abramov) -0.1331758E+00 Ex_ueg -0.8650596E-01 Ec_ueg -0.1173238E-01 Delta_ex -0.8800403E-01 Delta_ec 0.1785387E-01 Delta_et -0.2451478E+00 Pxc 0.7373268E+01 Qxc -0.4929129E+01 3,-1 176 3 -1 -3.039452 2.039916 0.890001 Rho 0.1491129E+00 |GRAD(Rho)| 0.1897196E-15 GRAD(Rho)x -0.6570265E-16 GRAD(Rho)y -0.1653408E-17 GRAD(Rho)z 0.1779718E-15 Laplacian 0.5779874E+00 (-1/4)Del**2(Rho)) -0.1444969E+00 Diamond 0.1161604E+01 Metallicity 0.4999044E+01 Ellipticity 0.2941429E-01 Gb(Abramov) 0.2167222E+00 Vb(Abramov) -0.2889476E+00 Hb(Abramov) -0.7222540E-01 Ex_ueg -0.5839901E-01 Ec_ueg -0.8386753E-02 Delta_ex -0.6196621E-01 Delta_ec 0.1466186E-01 Delta_et -0.1949605E+00 Pxc 0.6963244E+01 Qxc -0.4226354E+01 3,-1 177 3 +1 1.045399 -2.241547 1.375311 Rho 0.2537129E-01 |GRAD(Rho)| 0.9167629E-16 GRAD(Rho)x 0.2126306E-16 GRAD(Rho)y -0.8874167E-16 GRAD(Rho)z 0.8794275E-17 Laplacian 0.9466351E-01 (-1/4)Del**2(Rho)) -0.2366588E-01 Diamond 0.1273669E-01 Metallicity 0.1594661E+01 Ellipticity -0.5161403E+01 Gb(Abramov) 0.2206709E-01 Vb(Abramov) -0.2046831E-01 Hb(Abramov) 0.1598786E-02 Ex_ueg -0.5506072E-02 Ec_ueg -0.1107426E-02 Delta_ex -0.5921649E-02 Delta_ec 0.1625743E-02 Delta_et -0.1439823E-01 Pxc 0.4971953E+01 Qxc -0.3642427E+01 3,+1 178 3 -1 0.863910 3.006658 -2.023213 Rho 0.1251179E+00 |GRAD(Rho)| 0.1558884E-15 GRAD(Rho)x -0.1172294E-15 GRAD(Rho)y -0.3749984E-16 GRAD(Rho)z 0.9566729E-16 Laplacian 0.5075172E+00 (-1/4)Del**2(Rho)) -0.1268793E+00 Diamond 0.8452960E+00 Metallicity 0.4249732E+01 Ellipticity 0.1241655E-01 Gb(Abramov) 0.1744534E+00 Vb(Abramov) -0.2220274E+00 Hb(Abramov) -0.4757407E-01 Ex_ueg -0.4621799E-01 Ec_ueg -0.6870291E-02 Delta_ex -0.5238495E-01 Delta_ec 0.1386733E-01 Delta_et -0.1802417E+00 Pxc 0.6727225E+01 Qxc -0.3777581E+01 3,-1 179 3 -1 0.840963 -1.991686 3.051780 Rho 0.1028851E+00 |GRAD(Rho)| 0.6128154E-16 GRAD(Rho)x 0.4875522E-16 GRAD(Rho)y -0.4357137E-17 GRAD(Rho)z -0.3686965E-16 Laplacian 0.4256982E+00 (-1/4)Del**2(Rho)) -0.1064245E+00 Diamond 0.5662592E+00 Metallicity 0.3656781E+01 Ellipticity 0.7169956E-02 Gb(Abramov) 0.1358116E+00 Vb(Abramov) -0.1651986E+00 Hb(Abramov) -0.2938703E-01 Ex_ueg -0.3560588E-01 Ec_ueg -0.5500151E-02 Delta_ex -0.4206350E-01 Delta_ec 0.1233501E-01 Delta_et -0.1547770E+00 Pxc 0.6473619E+01 Qxc -0.3410091E+01 3,-1 180 3 -1 1.266945 -1.797932 -2.558644 Rho 0.2882280E+00 |GRAD(Rho)| 0.6338478E-15 GRAD(Rho)x 0.2157749E-15 GRAD(Rho)y 0.5913857E-15 GRAD(Rho)z -0.7394089E-16 Laplacian -0.1343000E+01 (-1/4)Del**2(Rho)) 0.3357500E+00 Diamond 0.4417449E+01 Metallicity -0.6453036E+01 Ellipticity 0.5539807E-02 Gb(Abramov) 0.1372678E+00 Vb(Abramov) -0.6102856E+00 Hb(Abramov) -0.4730178E+00 Ex_ueg -0.1406155E+00 Ec_ueg -0.1783667E-01 Delta_ex 0.1271795E+00 Delta_ec 0.4895266E-01 Delta_et -0.1105969E+01 Pxc 0.7883506E+01 Qxc 0.2598010E+01 3,-1 181 3 -1 2.801331 0.549754 1.824504 Rho 0.1471815E+00 |GRAD(Rho)| 0.6438089E-15 GRAD(Rho)x 0.1041444E-15 GRAD(Rho)y 0.4777672E-15 GRAD(Rho)z -0.4187866E-15 Laplacian 0.6073833E+00 (-1/4)Del**2(Rho)) -0.1518458E+00 Diamond 0.1198827E+01 Metallicity 0.4654851E+01 Ellipticity 0.1487011E-01 Gb(Abramov) 0.2190338E+00 Vb(Abramov) -0.2862218E+00 Hb(Abramov) -0.6718801E-01 Ex_ueg -0.5739263E-01 Ec_ueg -0.8263335E-02 Delta_ex -0.6488017E-01 Delta_ec 0.1540470E-01 Delta_et -0.2043440E+00 Pxc 0.6945455E+01 Qxc -0.4211711E+01 3,-1 182 3 -1 3.231002 3.276064 0.088312 Rho 0.2016378E+00 |GRAD(Rho)| 0.8281110E-12 GRAD(Rho)x -0.5834597E-12 GRAD(Rho)y -0.5658920E-12 GRAD(Rho)z -0.1584581E-12 Laplacian 0.7610867E+00 (-1/4)Del**2(Rho)) -0.1902717E+00 Diamond 0.2190466E+01 Metallicity 0.6277675E+01 Ellipticity 0.2533696E-02 Gb(Abramov) 0.3259251E+00 Vb(Abramov) -0.4615785E+00 Hb(Abramov) -0.1356534E+00 Ex_ueg -0.8732681E-01 Ec_ueg -0.1182769E-01 Delta_ex -0.8795599E-01 Delta_ec 0.1775905E-01 Delta_et -0.2439122E+00 Pxc 0.7383251E+01 Qxc -0.4952743E+01 3,-1 183 3 -1 3.224449 0.067157 3.217962 Rho 0.2239152E+00 |GRAD(Rho)| 0.3825561E-15 GRAD(Rho)x 0.3814223E-15 GRAD(Rho)y -0.2024748E-16 GRAD(Rho)z -0.2135878E-16 Laplacian 0.8185495E+00 (-1/4)Del**2(Rho)) -0.2046374E+00 Diamond 0.2672687E+01 Metallicity 0.6950899E+01 Ellipticity 0.8782304E-03 Gb(Abramov) 0.3734939E+00 Vb(Abramov) -0.5423503E+00 Hb(Abramov) -0.1688565E+00 Ex_ueg -0.1004222E+00 Ec_ueg -0.1333431E-01 Delta_ex -0.9718445E-01 Delta_ec 0.1855175E-01 Delta_et -0.2566079E+00 Pxc 0.7531116E+01 Qxc -0.5238559E+01 3,-1 184 3 -1 3.106283 0.867017 -2.000607 Rho 0.1461755E+00 |GRAD(Rho)| 0.4072860E-09 GRAD(Rho)x 0.1655633E-09 GRAD(Rho)y 0.3015901E-09 GRAD(Rho)z 0.2179774E-09 Laplacian 0.5817289E+00 (-1/4)Del**2(Rho)) -0.1454322E+00 Diamond 0.1136938E+01 Metallicity 0.4804892E+01 Ellipticity 0.2818450E-01 Gb(Abramov) 0.2134192E+00 Vb(Abramov) -0.2814061E+00 Hb(Abramov) -0.6798695E-01 Ex_ueg -0.5687018E-01 Ec_ueg -0.8199144E-02 Delta_ex -0.6201641E-01 Delta_ec 0.1474535E-01 Delta_et -0.1953323E+00 Pxc 0.6936112E+01 Qxc -0.4205828E+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 79 133 118 112 179 132 129 140 125 141 127 142 113 120 143 178 136 115 135 137 117 119 138 103 166 150 164 154 174 131 171 156 172 157 182 62 74 101 176 85 56 78 80 77 58 96 175 92 67 65 55 89 54 94 64 90 70 95 66 161 181 162 168 158 183 148 169 159 184 163 173 123 128 152 104 180 76 145 108 109 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 14 18 21 21 25 28 28 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 28 20 36 52 27 52 53 53 2.447099 1.997199 1.953348 2.067183 2.009542 1.814949 1.717793 1.698113 1.720474 1.730093 2.366842 2.000928 2.005953 2.045113 1.993130 1.812149 2.418111 1.924007 1.936686 1.913430 1.926436 1.769347 2.438293 2.073583 1.869126 2.195991 1.982686 1.824317 2.464207 2.002910 1.983206 2.026865 1.986076 1.809945 2.388815 1.823750 1.932623 1.929462 2.058464 1.775831 2.389908 2.001075 1.990060 2.047154 2.021406 1.812381 2.362606 2.243053 1.919034 1.925639 1.772582 1.781902 2.457465 1.952864 1.950977 2.054925 2.068973 1.815182 2.475844 1.924219 2.010819 1.860419 1.913010 1.769852 2.464529 1.889058 1.945675 1.934780 1.943488 1.770682 3.250557 3.213576 3.288443 3.437117 1.028510 3.269676 1.600188 1.872100 0.999086 2.449155 1.997374 1.953558 2.067435 2.009828 1.814957 1.717811 1.698158 1.720495 1.730100 2.368740 2.001220 2.006270 2.045370 1.993384 1.812159 2.419845 1.924495 1.937025 1.913862 1.926944 1.769350 2.440345 2.073772 1.869168 2.196293 1.982930 1.824342 2.466298 2.003187 1.983478 2.027107 1.986343 1.809948 2.390422 1.824106 1.932939 1.929911 2.058901 1.775847 2.392831 2.001251 1.990238 2.047448 2.021977 1.812392 2.364961 2.243299 1.919384 1.926156 1.772594 1.781919 2.459363 1.953062 1.951178 2.055175 2.069211 1.815192 2.477537 1.924610 2.011236 1.860709 1.913481 1.769860 2.465958 1.889478 1.946468 1.935227 1.943983 1.770689 3.280547 3.216673 3.293583 3.440581 1.028595 3.271967 1.602439 1.873702 0.999158 31 27 26 25 26 25 23 23 22 22 30 27 29 26 24 24 31 27 27 28 27 23 30 25 25 28 26 22 32 25 26 25 27 22 30 24 27 24 27 24 30 27 27 27 26 22 30 28 27 28 25 24 31 26 27 26 30 26 32 25 29 22 26 24 31 25 27 25 26 22 35 35 35 37 18 35 25 28 20 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 Ta As Ta W Ta Ta W Ta W Ta W W O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O H H 2.1410 2.4401 2.1683 2.3976 2.0596 2.1672 2.3702 2.1421 2.3375 2.1434 2.3816 2.3626 -1.0989 -1.0204 -1.1108 -1.1067 -1.0235 -0.9876 -0.9287 -0.9958 -0.8294 -0.9787 -1.0091 -1.0242 -0.9981 -1.0281 -0.9967 -1.0151 -0.9863 -1.0454 -1.0252 -1.0295 -1.0210 -1.0252 -1.0180 -0.8848 -0.9174 -1.0085 -1.0645 -1.0505 -0.9942 -0.8984 -0.9828 -0.8945 -1.0076 -0.9820 -0.9093 -0.9894 -0.9229 -0.9946 -0.8979 0.2806 0.3100 2.1271 0.8598 2.1187 2.1118 2.1484 2.1166 2.1191 2.1407 2.1472 2.1228 2.1200 2.1278 1.9379 1.9469 1.9353 1.9337 1.9211 1.9280 1.9393 1.9253 1.8744 1.9271 1.9249 1.9208 1.9250 1.9192 1.9249 1.9340 1.9377 1.9300 1.9308 1.9311 1.9315 1.9314 1.9319 1.9452 1.8636 1.9334 1.9247 1.9264 1.9333 1.9476 1.9342 1.9486 1.9306 1.9348 1.9469 1.9338 1.9440 1.9335 1.9489 0.5453 0.5501 6.0956 1.1588 6.0872 6.1011 6.1053 6.0835 6.1041 6.1013 6.1047 6.0919 6.1065 6.1171 5.1265 5.0386 5.1408 5.1377 5.0786 5.0323 4.9596 5.0443 4.9246 5.0244 5.0582 5.0794 5.0470 5.0844 5.0453 5.0550 5.0208 5.0887 5.0672 5.0716 5.0626 5.0681 5.0589 4.9098 5.0283 5.0475 5.1158 5.0991 5.0371 4.9207 5.0244 4.9155 5.0542 5.0228 4.9330 5.0317 4.9502 5.0374 4.9187 0.1741 0.1400 2.6016 10.5414 2.5909 3.3596 2.6533 2.5977 3.3769 2.5814 3.3818 2.6072 3.3622 3.3630 0.0345 0.0349 0.0347 0.0353 0.0237 0.0273 0.0298 0.0263 0.0304 0.0273 0.0260 0.0241 0.0261 0.0245 0.0265 0.0262 0.0278 0.0266 0.0272 0.0267 0.0269 0.0257 0.0272 0.0298 0.0255 0.0276 0.0240 0.0250 0.0238 0.0301 0.0241 0.0304 0.0229 0.0244 0.0294 0.0238 0.0287 0.0238 0.0303 0.0000 0.0000 14.0347 0.0000 14.0349 14.0299 14.0333 14.0349 14.0297 14.0345 14.0289 14.0347 14.0296 14.0295 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 Ta As Ta W Ta Ta W Ta W Ta W W O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O H H 2.353761 2.307234 2.364660 2.494289 2.322639 2.358201 2.479438 2.375388 2.484578 2.348554 2.487626 2.484953 -1.093849 -1.032486 -1.094259 -1.095436 -1.075801 -1.016780 -0.982675 -1.030699 -0.703070 -1.013358 -1.030560 -1.074524 -1.037447 -1.078078 -1.033902 -0.904124 -1.021791 -1.048572 -1.045601 -1.049635 -1.042908 -1.041228 -1.040159 -0.945857 -0.744729 -1.025293 -1.095404 -1.078662 -1.101643 -0.967269 -1.085951 -0.956699 -1.125284 -1.082950 -0.976036 -1.090581 -0.986887 -1.100991 -0.959712 0.020129 0.029441 1.826268 1.747181 1.834396 1.922695 1.811946 1.830202 1.912467 1.871006 1.944453 1.823626 1.925481 1.934787 -0.696339 -0.665719 -0.697355 -0.696167 -0.831655 -0.784379 -0.766162 -0.777259 -0.844200 -0.754445 -0.758112 -0.832824 -0.790979 -0.832835 -0.785849 -0.850168 -0.878046 -0.877559 -0.879824 -0.896808 -0.886037 -0.869860 -0.889859 -0.867786 -0.992924 -0.872610 -0.930597 -0.927299 -1.066173 -0.891153 -1.043106 -0.891439 -1.084725 -1.039844 -0.910308 -1.041146 -0.929818 -1.061330 -0.893140 0.281679 0.319653 1.959400 1.671503 1.958338 2.041780 1.929977 1.956724 2.028117 1.984614 2.044879 1.952569 2.042316 2.049463 -0.777586 -0.749919 -0.777127 -0.785467 -0.929353 -0.868991 -0.825875 -0.865005 -0.865076 -0.844147 -0.855658 -0.916182 -0.873107 -0.946614 -0.871077 -0.955146 -0.896251 -0.909368 -0.921420 -0.933213 -0.914538 -0.920132 -0.915317 -0.846057 -0.958072 -0.902692 -0.987393 -0.969112 -1.032898 -0.868149 -1.018391 -0.854717 -1.058738 -1.012369 -0.873033 -1.024290 -0.913712 -1.032905 -0.859161 0.358779 0.349801 4.62846246 4.04074586 -6.17206735 8.70888668 -22.57273037 -11.99416401 9.00503399 -2.14689952 48.43280517 24.71962990 -356.7939 419.1115 44.0780 -440.6736 -143.2727 -477.5508 Jun20-2024 10:53:11 Nodes: 1 Procs: 1 Jun20-2024 10:53:13 Nodes: 1 Procs: 1 0 Jun20-2024 10:53:17 Nodes: 1 Procs: 1 Jun20-2024 10:53:20 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 10:53:24 Nodes: 1 Procs: 1 Jun20-2024 10:53:28 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 10:53:33 Nodes: 1 Procs: 1 Jun20-2024 10:53:37 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun20-2024 10:53:40 Nodes: 1 Procs: 1 Jun20-2024 10:53:42 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Jun20-2024 10:53:49 Nodes: 1 Procs: 5 *** (NO TITLE) *** -11 -17.11509356 -17.39582383 -17.47726529 -17.49771966 -17.49490428 -17.51074579 -17.51382928 -17.51814517 -17.51837731 -17.52494953 -17.52746807 -17.53353420 -17.53902835 -17.53887825 -17.54294548 -17.54447074 -17.54748258 -17.54852868 -17.54918620 -17.54938023 -17.54951949 -17.54962848 -17.54972400 -17.54974386 -17.54967138 -17.54975272 -17.54966979 GEOMETRY CONVERGED