ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 03:24:20 Silicon (TZP, 1s frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.60 0.03 0.68 1 2 3 4 5 1 2 3 4 5 1 2.000 2.000 0.000 0.000 0.000 6.000 2.000 0.000 0.000 0.000 0.000 -139.491 -10.820 3.478 40.665 286.501 -95.429 -4.086 1.767 16.978 215.955 10.038 S S S S S P P P P P D S P S P P S D P S P S 1 1 2 2 3 3 1 4 4 5 5 2.00 6.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -139.4907 -95.4288 -10.8205 -4.0856 1.7668 3.4780 10.0377 16.9776 40.6653 215.9554 286.5008 1 Si -0.0000 4.0000 8.0000 0.0000 0.0000 Apr20-2024 03:24:20 Nodes: 1 Procs: 1 Apr20-2024 03:24:20 Nodes: 1 Procs: 1 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 03:24:21 Silicon (TZP, 1s frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.31 0.05 1.43 1 2 3 4 5 6 1 2 3 4 1 2 3 1 2 3 2.000 2.000 0.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 3.000 0.000 0.000 14.000 0.000 0.000 -72.755 -5.438 1.149 14.442 84.369 82466.595 -39.462 -0.588 19.371 119.253 -3.592 3.193 26.757 -25.167 53.137 407.274 S S S S S S P P P P D D D F F F S P F S D P S D S P D F S P F S 1 1 1 2 1 2 3 2 4 3 3 2 5 4 3 6 2.00 6.00 14.00 2.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -72.7547 -39.4619 -25.1674 -5.4383 -3.5916 -0.5880 1.1490 3.1925 14.4417 19.3711 26.7574 53.1371 84.3692 119.2525 407.2741 82466.5953 1 Ta -0.0000 4.0000 6.0000 3.0000 14.0000 Apr20-2024 03:24:20 Nodes: 1 Procs: 1 Apr20-2024 03:24:20 Nodes: 1 Procs: 1 0 Apr20-2024 03:24:21 Nodes: 1 Procs: 1 Apr20-2024 03:24:22 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 03:24:24 Silicon (TZP, 1s frozen) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.46 0.02 0.51 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 Apr20-2024 03:24:20 Nodes: 1 Procs: 1 Apr20-2024 03:24:20 Nodes: 1 Procs: 1 0 Apr20-2024 03:24:21 Nodes: 1 Procs: 1 Apr20-2024 03:24:22 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Apr20-2024 03:24:24 Nodes: 1 Procs: 1 Apr20-2024 03:24:24 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 03:24:25 Silicon (TZP, 1s frozen) kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.35 0.02 1.42 1 2 3 4 5 6 1 2 3 4 1 2 3 1 2 3 2.000 2.000 0.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 4.000 0.000 0.000 14.000 0.000 0.000 -78.652 -5.688 1.231 15.256 90.545 82874.614 -43.195 -0.500 20.662 126.921 -4.498 4.055 33.318 -33.668 62.370 473.510 S S S S S S P P P P D D D F F F S P F S D P S D S P D F S P F S 1 1 1 2 1 2 3 2 4 3 3 2 5 4 3 6 2.00 6.00 14.00 2.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -78.6522 -43.1946 -33.6680 -5.6882 -4.4976 -0.5002 1.2309 4.0549 15.2562 20.6620 33.3183 62.3697 90.5446 126.9207 473.5096 82874.6143 1 W -0.0000 4.0000 6.0000 4.0000 14.0000 Apr20-2024 03:24:20 Nodes: 1 Procs: 1 Apr20-2024 03:24:20 Nodes: 1 Procs: 1 0 Apr20-2024 03:24:21 Nodes: 1 Procs: 1 Apr20-2024 03:24:22 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Apr20-2024 03:24:24 Nodes: 1 Procs: 1 Apr20-2024 03:24:24 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Apr20-2024 03:24:25 Nodes: 1 Procs: 1 Apr20-2024 03:24:26 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr20-2024 03:24:28 Silicon (TZP, 1s frozen) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP 2671.4100000000053 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272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 -5.270 -5.261 -5.217 -5.186 -5.172 -5.135 -5.081 -5.012 -4.913 -4.871 -1.743 -1.575 -1.407 -1.381 -1.353 -1.240 -1.099 -1.043 -1.013 -0.976 A A A A A A A A A A A A A A A A A A A A 0.00000000070806 0.00046179124922 0.00032233332742 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 74 74 74 74 74 74 74 74 74 74 14 73 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 0.123084 0.011334 3.513287 -0.125780 3.568069 0.002102 2.471534 -1.818014 1.828043 2.574938 1.710264 -1.906193 -2.545984 1.829608 -1.723457 -2.465540 -2.057367 1.660483 -2.464041 -2.070949 -1.678427 -2.560777 1.845737 1.679020 2.574865 1.712646 1.866067 2.486708 -1.828648 -1.867711 -0.069470 -0.073585 -0.012178 0.130853 -0.006228 -3.558774 0.914231 -0.080398 1.336963 -1.117857 -1.345870 -0.005877 0.930126 -0.091042 -1.339714 -0.957034 1.344736 -0.014350 -3.019262 0.088199 1.599908 3.007050 -1.554385 0.005415 -3.063274 0.099242 -1.578149 3.037490 1.698942 0.010665 1.419967 -3.176551 -1.516565 1.126668 2.913009 1.326756 -1.182873 -1.337338 -2.894167 -1.119496 1.353418 2.920910 -1.183974 1.406718 -2.964049 -1.119196 -1.299722 2.885173 1.138405 2.921916 -1.291415 1.361484 -3.141070 1.522577 3.446482 0.104290 2.162813 -3.480675 -2.196562 0.019410 3.480331 0.118486 -2.125083 -3.431207 2.281219 0.017296 1.502452 1.392112 3.484982 1.629990 -1.337052 -3.533831 -1.478580 3.524403 1.373811 -1.846626 -3.721263 -1.656195 -1.806141 -3.691323 1.682306 -1.497896 3.544333 -1.329720 1.553707 -1.297399 3.519242 1.549282 1.446848 -3.492083 -0.220327 0.004289 5.240112 3.942879 -2.637508 -2.476754 -0.206078 -0.022869 -5.329655 0.255293 5.289710 0.015276 3.884369 -2.649426 2.504203 3.751184 2.888409 -2.478184 -3.772695 2.550460 -2.773511 -3.823423 -2.234831 2.791914 -3.874932 -2.256549 -2.743333 -3.730772 2.526804 2.813500 3.729737 2.875546 2.507137 1 3 -3 0.123084 0.011334 3.513287 Rho 0.4361414E+07 3,-3 2 3 -3 -0.125780 3.568069 0.002102 Rho 0.4361415E+07 3,-3 3 3 -3 2.471534 -1.818014 1.828043 Rho 0.4361415E+07 3,-3 4 3 -3 2.574938 1.710264 -1.906193 Rho 0.4361415E+07 3,-3 5 3 -3 -2.545984 1.829608 -1.723457 Rho 0.4361415E+07 3,-3 6 3 -3 -2.465540 -2.057367 1.660483 Rho 0.4361415E+07 3,-3 7 3 -3 -2.464041 -2.070949 -1.678427 Rho 0.4361415E+07 3,-3 8 3 -3 -2.560777 1.845737 1.679020 Rho 0.4361414E+07 3,-3 9 3 -3 2.574865 1.712646 1.866067 Rho 0.4361415E+07 3,-3 10 3 -3 2.486708 -1.828648 -1.867711 Rho 0.4361415E+07 3,-3 11 3 -3 -0.069470 -0.073585 -0.012178 Rho 0.1943330E+04 3,-3 12 3 -3 0.130853 -0.006228 -3.558774 Rho 0.3882646E+07 3,-3 13 3 -3 0.914231 -0.080398 1.336963 Rho 0.3186824E+03 3,-3 14 3 -3 -1.117857 -1.345870 -0.005877 Rho 0.3186406E+03 3,-3 15 3 -3 0.930126 -0.091042 -1.339714 Rho 0.3186732E+03 3,-3 16 3 -3 -0.957034 1.344736 -0.014350 Rho 0.3186760E+03 3,-3 17 3 -3 -3.019262 0.088199 1.599908 Rho 0.3190248E+03 3,-3 18 3 -3 3.007050 -1.554385 0.005415 Rho 0.3188192E+03 3,-3 19 3 -3 -3.063274 0.099242 -1.578149 Rho 0.3190418E+03 3,-3 20 3 -3 3.037490 1.698942 0.010665 Rho 0.3188500E+03 3,-3 21 3 -3 1.419967 -3.176551 -1.516565 Rho 0.3192869E+03 3,-3 22 3 -3 1.126668 2.913009 1.326756 Rho 0.3188711E+03 3,-3 23 3 -3 -1.182873 -1.337338 -2.894167 Rho 0.3188122E+03 3,-3 24 3 -3 -1.119496 1.353418 2.920910 Rho 0.3188642E+03 3,-3 25 3 -3 -1.183974 1.406718 -2.964049 Rho 0.3188567E+03 3,-3 26 3 -3 -1.119196 -1.299722 2.885173 Rho 0.3188380E+03 3,-3 27 3 -3 1.138405 2.921916 -1.291415 Rho 0.3188692E+03 3,-3 28 3 -3 1.361484 -3.141070 1.522577 Rho 0.3193004E+03 3,-3 29 3 -3 3.446482 0.104290 2.162813 Rho 0.3190098E+03 3,-3 30 3 -3 -3.480675 -2.196562 0.019410 Rho 0.3188949E+03 3,-3 31 3 -3 3.480331 0.118486 -2.125083 Rho 0.3190182E+03 3,-3 32 3 -3 -3.431207 2.281219 0.017296 Rho 0.3189177E+03 3,-3 33 3 -3 1.502452 1.392112 3.484982 Rho 0.3189160E+03 3,-3 34 3 -3 1.629990 -1.337052 -3.533831 Rho 0.3188783E+03 3,-3 35 3 -3 -1.478580 3.524403 1.373811 Rho 0.3189328E+03 3,-3 36 3 -3 -1.846626 -3.721263 -1.656195 Rho 0.3192123E+03 3,-3 37 3 -3 -1.806141 -3.691323 1.682306 Rho 0.3192195E+03 3,-3 38 3 -3 -1.497896 3.544333 -1.329720 Rho 0.3189399E+03 3,-3 39 3 -3 1.553707 -1.297399 3.519242 Rho 0.3189149E+03 3,-3 40 3 -3 1.549282 1.446848 -3.492083 Rho 0.3189002E+03 3,-3 41 3 -3 -0.220327 0.004289 5.240112 Rho 0.3192249E+03 3,-3 42 3 -3 3.942879 -2.637508 -2.476754 Rho 0.3191635E+03 3,-3 43 3 -3 -0.206078 -0.022869 -5.329655 Rho 0.3190941E+03 3,-3 44 3 -3 0.255293 5.289710 0.015276 Rho 0.3192026E+03 3,-3 45 3 -3 3.884369 -2.649426 2.504203 Rho 0.3191673E+03 3,-3 46 3 -3 3.751184 2.888409 -2.478184 Rho 0.3192080E+03 3,-3 47 3 -3 -3.772695 2.550460 -2.773511 Rho 0.3191842E+03 3,-3 48 3 -3 -3.823423 -2.234831 2.791914 Rho 0.3191672E+03 3,-3 49 3 -3 -3.874932 -2.256549 -2.743333 Rho 0.3191579E+03 3,-3 50 3 -3 -3.730772 2.526804 2.813500 Rho 0.3191945E+03 3,-3 51 3 -3 3.729737 2.875546 2.507137 Rho 0.3192114E+03 3,-3 52 3 -1 -1.721673 1.564716 -0.849718 Rho 0.5027241E-01 |GRAD(Rho)| 0.7617151E-15 GRAD(Rho)x 0.4964219E-15 GRAD(Rho)y 0.7681043E-16 GRAD(Rho)z 0.5726040E-15 Laplacian 0.1882542E+00 (-1/4)Del**2(Rho)) -0.4706356E-01 Diamond 0.9356447E-01 Metallicity 0.2506598E+01 Ellipticity 0.1720138E-01 Gb(Abramov) 0.5103727E-01 Vb(Abramov) -0.5501099E-01 Hb(Abramov) -0.3973715E-02 Ex_ueg -0.1370329E-01 Ec_ueg -0.2429937E-02 Delta_ex -0.1540674E-01 Delta_ec 0.5412338E-02 Delta_et -0.5709613E-01 Pxc 0.5639357E+01 Qxc -0.2846596E+01 3,-1 53 3 +1 -2.185809 1.770069 -0.060542 Rho 0.2728523E-01 |GRAD(Rho)| 0.9342794E-17 GRAD(Rho)x -0.1546956E-17 GRAD(Rho)y 0.9213731E-17 GRAD(Rho)z 0.4350949E-19 Laplacian 0.1020339E+00 (-1/4)Del**2(Rho)) -0.2550847E-01 Diamond 0.1413161E-01 Metallicity 0.1670122E+01 Ellipticity -0.3658501E+01 Gb(Abramov) 0.2410602E-01 Vb(Abramov) -0.2270357E-01 Hb(Abramov) 0.1402449E-02 Ex_ueg -0.6066738E-02 Ec_ueg -0.1204446E-02 Delta_ex -0.6407316E-02 Delta_ec 0.1572410E-02 Delta_et -0.1420450E-01 Pxc 0.5036952E+01 Qxc -0.4074838E+01 3,+1 54 3 +1 -2.945838 -0.410621 0.005360 Rho 0.5507323E-02 |GRAD(Rho)| 0.2911409E-15 GRAD(Rho)x 0.1409638E-15 GRAD(Rho)y -0.2547193E-15 GRAD(Rho)z 0.3210834E-17 Laplacian 0.2276167E-01 (-1/4)Del**2(Rho)) -0.5690417E-02 Diamond 0.3698994E-03 Metallicity 0.5199680E+00 Ellipticity -0.1189658E+01 Gb(Abramov) 0.4286750E-02 Vb(Abramov) -0.2883084E-02 Hb(Abramov) 0.1403666E-02 Ex_ueg -0.7182998E-03 Ec_ueg -0.1688099E-03 Delta_ex -0.9616652E-03 Delta_ec 0.3748820E-03 Delta_et -0.2232393E-02 Pxc 0.4255082E+01 Qxc -0.2565248E+01 3,+1 55 3 -1 -1.977205 2.722664 1.507378 Rho 0.1182827E+00 |GRAD(Rho)| 0.1375487E-15 GRAD(Rho)x -0.8656677E-16 GRAD(Rho)y -0.1065229E-15 GRAD(Rho)z 0.8871823E-17 Laplacian 0.4704429E+00 (-1/4)Del**2(Rho)) -0.1176107E+00 Diamond 0.7144830E+00 Metallicity 0.4174858E+01 Ellipticity 0.2335740E-01 Gb(Abramov) 0.1602418E+00 Vb(Abramov) -0.2028730E+00 Hb(Abramov) -0.4263111E-01 Ex_ueg -0.4288250E-01 Ec_ueg -0.6445287E-02 Delta_ex -0.4767063E-01 Delta_ec 0.1258578E-01 Delta_et -0.1612753E+00 Pxc 0.6653312E+01 Qxc -0.3787659E+01 3,-1 56 3 -1 -1.790841 1.576531 2.327847 Rho 0.1318254E+00 |GRAD(Rho)| 0.7182361E-12 GRAD(Rho)x -0.5309348E-12 GRAD(Rho)y 0.1861556E-12 GRAD(Rho)z -0.4464498E-12 Laplacian 0.5471720E+00 (-1/4)Del**2(Rho)) -0.1367930E+00 Diamond 0.9584540E+00 Metallicity 0.4300189E+01 Ellipticity 0.8273516E-02 Gb(Abramov) 0.1892346E+00 Vb(Abramov) -0.2416763E+00 Hb(Abramov) -0.5244164E-01 Ex_ueg -0.4955077E-01 Ec_ueg -0.7290436E-02 Delta_ex -0.5704658E-01 Delta_ec 0.1451691E-01 Delta_et -0.1899056E+00 Pxc 0.6796681E+01 Qxc -0.3929664E+01 3,-1 57 3 +1 -0.530497 0.802337 1.529585 Rho 0.8791623E-02 |GRAD(Rho)| 0.9191462E-14 GRAD(Rho)x 0.7274564E-14 GRAD(Rho)y -0.5204415E-14 GRAD(Rho)z 0.2116070E-14 Laplacian 0.3498847E-01 (-1/4)Del**2(Rho)) -0.8747118E-02 Diamond 0.9218041E-03 Metallicity 0.7375701E+00 Ellipticity -0.1385134E+01 Gb(Abramov) 0.6906680E-02 Vb(Abramov) -0.5066243E-02 Hb(Abramov) 0.1840437E-02 Ex_ueg -0.1340120E-02 Ec_ueg -0.3135620E-03 Delta_ex -0.1588509E-02 Delta_ec 0.4586874E-03 Delta_et -0.3180067E-02 Pxc 0.4273861E+01 Qxc -0.3463163E+01 3,+1 58 3 +3 -1.144238 0.013225 -1.576028 Rho 0.5047159E-02 |GRAD(Rho)| 0.2790235E-16 GRAD(Rho)x 0.1599545E-16 GRAD(Rho)y 0.2286097E-16 GRAD(Rho)z 0.2500333E-18 Laplacian 0.1930924E-01 (-1/4)Del**2(Rho)) -0.4827309E-02 Diamond 0.1316560E-03 Metallicity 0.5299803E+00 Ellipticity -0.3122296E+00 Gb(Abramov) 0.3644603E-02 Vb(Abramov) -0.2461896E-02 Hb(Abramov) 0.1182707E-02 Ex_ueg -0.6394124E-03 Ec_ueg -0.1489428E-03 Delta_ex -0.6643393E-03 Delta_ec 0.7698371E-04 Delta_et -0.6337458E-03 Pxc 0.4293006E+01 Qxc -0.8629609E+01 3,+3 59 3 +1 0.529027 1.488537 -0.854555 Rho 0.8107468E-02 |GRAD(Rho)| 0.7582512E-17 GRAD(Rho)x 0.5119966E-17 GRAD(Rho)y 0.5060418E-17 GRAD(Rho)z -0.2381723E-17 Laplacian 0.3234691E-01 (-1/4)Del**2(Rho)) -0.8086728E-02 Diamond 0.7978404E-03 Metallicity 0.6970368E+00 Ellipticity -0.1398246E+01 Gb(Abramov) 0.6330610E-02 Vb(Abramov) -0.4574492E-02 Hb(Abramov) 0.1756118E-02 Ex_ueg -0.1202907E-02 Ec_ueg -0.2829970E-03 Delta_ex -0.1455418E-02 Delta_ec 0.4543245E-03 Delta_et -0.3059166E-02 Pxc 0.4250599E+01 Qxc -0.3203476E+01 3,+1 60 3 +1 -1.771870 0.017281 -2.449469 Rho 0.1086792E-01 |GRAD(Rho)| 0.2012214E-16 GRAD(Rho)x -0.5715841E-18 GRAD(Rho)y -0.1945155E-16 GRAD(Rho)z -0.5119688E-17 Laplacian 0.5040649E-01 (-1/4)Del**2(Rho)) -0.1260162E-01 Diamond 0.1757206E-02 Metallicity 0.7289608E+00 Ellipticity -0.1301150E+01 Gb(Abramov) 0.9932096E-02 Vb(Abramov) -0.7262570E-02 Hb(Abramov) 0.2669526E-02 Ex_ueg -0.1777926E-02 Ec_ueg -0.4075638E-03 Delta_ex -0.2412004E-02 Delta_ec 0.6506682E-03 Delta_et -0.4764476E-02 Pxc 0.4362326E+01 Qxc -0.3706965E+01 3,+1 61 3 +1 -1.732106 0.031195 0.705387 Rho 0.9548406E-02 |GRAD(Rho)| 0.9612913E-17 GRAD(Rho)x 0.8956626E-17 GRAD(Rho)y -0.3350735E-17 GRAD(Rho)z -0.9795497E-18 Laplacian 0.3865225E-01 (-1/4)Del**2(Rho)) -0.9663062E-02 Diamond 0.1168249E-02 Metallicity 0.7661665E+00 Ellipticity -0.1424973E+01 Gb(Abramov) 0.7675961E-02 Vb(Abramov) -0.5688859E-02 Hb(Abramov) 0.1987102E-02 Ex_ueg -0.1496096E-02 Ec_ueg -0.3476117E-03 Delta_ex -0.1803692E-02 Delta_ec 0.5265685E-03 Delta_et -0.3710440E-02 Pxc 0.4303930E+01 Qxc -0.3425370E+01 3,+1 62 3 +1 -1.743537 0.011524 2.430576 Rho 0.1151719E-01 |GRAD(Rho)| 0.1567987E-16 GRAD(Rho)x 0.1304375E-16 GRAD(Rho)y 0.8584595E-17 GRAD(Rho)z 0.1422641E-17 Laplacian 0.5607457E-01 (-1/4)Del**2(Rho)) -0.1401864E-01 Diamond 0.2144257E-02 Metallicity 0.7218130E+00 Ellipticity -0.1286418E+01 Gb(Abramov) 0.1103224E-01 Vb(Abramov) -0.8045827E-02 Hb(Abramov) 0.2986408E-02 Ex_ueg -0.1920940E-02 Ec_ueg -0.4373269E-03 Delta_ex -0.2732875E-02 Delta_ec 0.7389361E-03 Delta_et -0.5476604E-02 Pxc 0.4392457E+01 Qxc -0.3698391E+01 3,+1 63 3 +1 -0.228210 -2.643745 -1.879681 Rho 0.3021784E-02 |GRAD(Rho)| 0.3450507E-17 GRAD(Rho)x 0.3440886E-17 GRAD(Rho)y -0.1153144E-18 GRAD(Rho)z -0.2302222E-18 Laplacian 0.1177525E-01 (-1/4)Del**2(Rho)) -0.2943814E-02 Diamond 0.1221962E-03 Metallicity 0.3696140E+00 Ellipticity -0.1551948E+01 Gb(Abramov) 0.2143888E-02 Vb(Abramov) -0.1343963E-02 Hb(Abramov) 0.7999254E-03 Ex_ueg -0.3226534E-03 Ec_ueg -0.6280137E-04 Delta_ex -0.5014666E-03 Delta_ec 0.3140681E-03 Delta_et -0.1488638E-02 Pxc 0.5137680E+01 Qxc -0.1596681E+01 3,+1 64 3 +1 0.211110 1.953297 2.233779 Rho 0.6423335E-02 |GRAD(Rho)| 0.7799851E-17 GRAD(Rho)x 0.5066553E-17 GRAD(Rho)y 0.4939801E-17 GRAD(Rho)z -0.3281170E-17 Laplacian 0.2709057E-01 (-1/4)Del**2(Rho)) -0.6772642E-02 Diamond 0.7879859E-03 Metallicity 0.5645849E+00 Ellipticity -0.2237448E+01 Gb(Abramov) 0.5152384E-02 Vb(Abramov) -0.3532125E-02 Hb(Abramov) 0.1620259E-02 Ex_ueg -0.8818589E-03 Ec_ueg -0.2086697E-03 Delta_ex -0.1350436E-02 Delta_ec 0.7379580E-03 Delta_et -0.4364874E-02 Pxc 0.4226099E+01 Qxc -0.1829963E+01 3,+1 65 3 +1 -0.526727 0.787593 -1.592948 Rho 0.8245810E-02 |GRAD(Rho)| 0.9811149E-17 GRAD(Rho)x 0.5546277E-17 GRAD(Rho)y -0.6375473E-17 GRAD(Rho)z -0.4985059E-17 Laplacian 0.3149194E-01 (-1/4)Del**2(Rho)) -0.7872984E-02 Diamond 0.7503660E-03 Metallicity 0.7364377E+00 Ellipticity -0.1389954E+01 Gb(Abramov) 0.6214983E-02 Vb(Abramov) -0.4556982E-02 Hb(Abramov) 0.1658001E-02 Ex_ueg -0.1230352E-02 Ec_ueg -0.2891606E-03 Delta_ex -0.1401801E-02 Delta_ec 0.4044580E-03 Delta_et -0.2766502E-02 Pxc 0.4254909E+01 Qxc -0.3465875E+01 3,+1 66 3 +3 -2.375518 0.018323 -0.000590 Rho 0.5291807E-02 |GRAD(Rho)| 0.7017903E-17 GRAD(Rho)x -0.4118787E-17 GRAD(Rho)y 0.1804285E-17 GRAD(Rho)z 0.5388053E-17 Laplacian 0.2213422E-01 (-1/4)Del**2(Rho)) -0.5533554E-02 Diamond 0.2329668E-03 Metallicity 0.5002907E+00 Ellipticity -0.5982204E+00 Gb(Abramov) 0.4150433E-02 Vb(Abramov) -0.2767313E-02 Hb(Abramov) 0.1383120E-02 Ex_ueg -0.6810679E-03 Ec_ueg -0.1594920E-03 Delta_ex -0.8336174E-03 Delta_ec 0.1987975E-03 Delta_et -0.1298252E-02 Pxc 0.4270233E+01 Qxc -0.4193299E+01 3,+3 67 3 +3 0.018759 1.568809 1.584738 Rho 0.4969364E-02 |GRAD(Rho)| 0.1891704E-12 GRAD(Rho)x 0.3969699E-13 GRAD(Rho)y -0.1587857E-12 GRAD(Rho)z 0.9485083E-13 Laplacian 0.2069581E-01 (-1/4)Del**2(Rho)) -0.5173953E-02 Diamond 0.1756442E-03 Metallicity 0.4818353E+00 Ellipticity -0.2817306E+00 Gb(Abramov) 0.3864801E-02 Vb(Abramov) -0.2555649E-02 Hb(Abramov) 0.1309152E-02 Ex_ueg -0.6263053E-03 Ec_ueg -0.1455946E-03 Delta_ex -0.7440747E-03 Delta_ec 0.1452069E-03 Delta_et -0.9920527E-03 Pxc 0.4301706E+01 Qxc -0.5124238E+01 3,+3 68 3 +3 -1.138691 0.007462 1.538112 Rho 0.5166929E-02 |GRAD(Rho)| 0.4209934E-17 GRAD(Rho)x 0.7061940E-18 GRAD(Rho)y 0.4147979E-17 GRAD(Rho)z -0.1382129E-18 Laplacian 0.2061459E-01 (-1/4)Del**2(Rho)) -0.5153647E-02 Diamond 0.1487666E-03 Metallicity 0.5162095E+00 Ellipticity -0.2402309E+00 Gb(Abramov) 0.3879158E-02 Vb(Abramov) -0.2604669E-02 Hb(Abramov) 0.1274489E-02 Ex_ueg -0.6597231E-03 Ec_ueg -0.1541035E-03 Delta_ex -0.7171341E-03 Delta_ec 0.8792365E-04 Delta_et -0.7082771E-03 Pxc 0.4281039E+01 Qxc -0.8156328E+01 3,+3 69 3 +1 -1.749863 0.023449 -0.715020 Rho 0.9432036E-02 |GRAD(Rho)| 0.9808007E-17 GRAD(Rho)x 0.4248856E-17 GRAD(Rho)y -0.8801066E-17 GRAD(Rho)z 0.8279181E-18 Laplacian 0.3797130E-01 (-1/4)Del**2(Rho)) -0.9492824E-02 Diamond 0.1128050E-02 Metallicity 0.7641293E+00 Ellipticity -0.1425356E+01 Gb(Abramov) 0.7537507E-02 Vb(Abramov) -0.5582190E-02 Hb(Abramov) 0.1955317E-02 Ex_ueg -0.1471835E-02 Ec_ueg -0.3423598E-03 Delta_ex -0.1766122E-02 Delta_ec 0.5168927E-03 Delta_et -0.3631296E-02 Pxc 0.4299088E+01 Qxc -0.3416806E+01 3,+1 70 3 +1 -0.574922 -0.846413 -1.519091 Rho 0.9439667E-02 |GRAD(Rho)| 0.2073032E-16 GRAD(Rho)x 0.6323179E-18 GRAD(Rho)y 0.1275371E-17 GRAD(Rho)z 0.2068138E-16 Laplacian 0.3760939E-01 (-1/4)Del**2(Rho)) -0.9402347E-02 Diamond 0.1110487E-02 Metallicity 0.7725229E+00 Ellipticity -0.1429717E+01 Gb(Abramov) 0.7478819E-02 Vb(Abramov) -0.5555292E-02 Hb(Abramov) 0.1923528E-02 Ex_ueg -0.1473422E-02 Ec_ueg -0.3427039E-03 Delta_ex -0.1746450E-02 Delta_ec 0.5062493E-03 Delta_et -0.3561907E-02 Pxc 0.4299403E+01 Qxc -0.3449782E+01 3,+1 71 3 +1 1.690866 -2.834829 0.001355 Rho 0.7114174E-02 |GRAD(Rho)| 0.2001690E-16 GRAD(Rho)x 0.6812254E-17 GRAD(Rho)y 0.5899633E-17 GRAD(Rho)z 0.1787355E-16 Laplacian 0.3167400E-01 (-1/4)Del**2(Rho)) -0.7918501E-02 Diamond 0.1032710E-02 Metallicity 0.5725117E+00 Ellipticity -0.1952173E+01 Gb(Abramov) 0.6034573E-02 Vb(Abramov) -0.4150645E-02 Hb(Abramov) 0.1883928E-02 Ex_ueg -0.1010534E-02 Ec_ueg -0.2389990E-03 Delta_ex -0.1599026E-02 Delta_ec 0.8372279E-03 Delta_et -0.5113990E-02 Pxc 0.4228196E+01 Qxc -0.1909905E+01 3,+1 72 3 -1 -1.813630 1.597175 -2.376383 Rho 0.1604437E+00 |GRAD(Rho)| 0.1078014E-14 GRAD(Rho)x -0.5179505E-15 GRAD(Rho)y 0.3296720E-15 GRAD(Rho)z 0.8860913E-15 Laplacian 0.6567410E+00 (-1/4)Del**2(Rho)) -0.1641853E+00 Diamond 0.1445706E+01 Metallicity 0.4970769E+01 Ellipticity 0.1234613E-01 Gb(Abramov) 0.2454780E+00 Vb(Abramov) -0.3267708E+00 Hb(Abramov) -0.8129276E-01 Ex_ueg -0.6438955E-01 Ec_ueg -0.9115381E-02 Delta_ex -0.7173488E-01 Delta_ec 0.1642894E-01 Delta_et -0.2207856E+00 Pxc 0.7063836E+01 Qxc -0.4366373E+01 3,-1 73 3 +3 0.032304 1.576222 -1.654910 Rho 0.4630214E-02 |GRAD(Rho)| 0.2847483E-12 GRAD(Rho)x 0.4420225E-13 GRAD(Rho)y -0.2691417E-12 GRAD(Rho)z -0.8179537E-13 Laplacian 0.1888535E-01 (-1/4)Del**2(Rho)) -0.4721338E-02 Diamond 0.1516921E-03 Metallicity 0.4693425E+00 Ellipticity -0.2804124E+00 Gb(Abramov) 0.3516879E-02 Vb(Abramov) -0.2312421E-02 Hb(Abramov) 0.1204458E-02 Ex_ueg -0.5699715E-03 Ec_ueg -0.1310343E-03 Delta_ex -0.6726631E-03 Delta_ec 0.1437579E-03 Delta_et -0.9466244E-03 Pxc 0.4349790E+01 Qxc -0.4679137E+01 3,+3 74 3 +1 -1.991241 2.870615 0.008537 Rho 0.1269585E-01 |GRAD(Rho)| 0.1059134E-13 GRAD(Rho)x -0.4155994E-14 GRAD(Rho)y -0.9682197E-14 GRAD(Rho)z 0.1076722E-14 Laplacian 0.5816798E-01 (-1/4)Del**2(Rho)) -0.1454200E-01 Diamond 0.1837047E-02 Metallicity 0.8185249E+00 Ellipticity -0.1075914E+01 Gb(Abramov) 0.1167849E-01 Vb(Abramov) -0.8814994E-02 Hb(Abramov) 0.2863501E-02 Ex_ueg -0.2187429E-02 Ec_ueg -0.4917862E-03 Delta_ex -0.2719549E-02 Delta_ec 0.4290235E-03 Delta_et -0.3504244E-02 Pxc 0.4447926E+01 Qxc -0.6338927E+01 3,+1 75 3 +1 -0.266349 -2.514855 1.220952 Rho 0.3077997E-02 |GRAD(Rho)| 0.1528339E-10 GRAD(Rho)x 0.1401625E-10 GRAD(Rho)y -0.5522644E-11 GRAD(Rho)z 0.2574318E-11 Laplacian 0.1215133E-01 (-1/4)Del**2(Rho)) -0.3037833E-02 Diamond 0.1090533E-03 Metallicity 0.3693485E+00 Ellipticity -0.1234651E+01 Gb(Abramov) 0.2212225E-02 Vb(Abramov) -0.1386617E-02 Hb(Abramov) 0.8256077E-03 Ex_ueg -0.3306811E-03 Ec_ueg -0.6516265E-04 Delta_ex -0.4834718E-03 Delta_ec 0.2601411E-03 Delta_et -0.1271179E-02 Pxc 0.5074703E+01 Qxc -0.1858498E+01 3,+1 76 3 +1 0.508734 1.494645 0.848040 Rho 0.8119356E-02 |GRAD(Rho)| 0.8844445E-17 GRAD(Rho)x -0.8250393E-17 GRAD(Rho)y -0.1003847E-17 GRAD(Rho)z -0.3024485E-17 Laplacian 0.3249458E-01 (-1/4)Del**2(Rho)) -0.8123645E-02 Diamond 0.7971522E-03 Metallicity 0.6955658E+00 Ellipticity -0.1388001E+01 Gb(Abramov) 0.6357518E-02 Vb(Abramov) -0.4591391E-02 Hb(Abramov) 0.1766127E-02 Ex_ueg -0.1205259E-02 Ec_ueg -0.2835263E-03 Delta_ex -0.1459716E-02 Delta_ec 0.4512466E-03 Delta_et -0.3043854E-02 Pxc 0.4250961E+01 Qxc -0.3234852E+01 3,+1 77 3 -1 -0.506231 -0.597739 -0.009503 Rho 0.1401204E+00 |GRAD(Rho)| 0.2877050E-12 GRAD(Rho)x 0.1999878E-12 GRAD(Rho)y 0.2064972E-12 GRAD(Rho)z 0.1174716E-13 Laplacian 0.7383036E+00 (-1/4)Del**2(Rho)) -0.1845759E+00 Diamond 0.1650095E+01 Metallicity 0.3528151E+01 Ellipticity 0.3583109E-01 Gb(Abramov) 0.2315859E+00 Vb(Abramov) -0.2785959E+00 Hb(Abramov) -0.4700998E-01 Ex_ueg -0.5375105E-01 Ec_ueg -0.7814109E-02 Delta_ex -0.8093753E-01 Delta_ec 0.2433677E-01 Delta_et -0.3318222E+00 Pxc 0.6878717E+01 Qxc -0.3325730E+01 3,-1 78 3 +1 1.692544 0.722762 -0.002448 Rho 0.7094450E-02 |GRAD(Rho)| 0.7730350E-16 GRAD(Rho)x -0.4094094E-17 GRAD(Rho)y 0.5641341E-16 GRAD(Rho)z 0.5269343E-16 Laplacian 0.2776986E-01 (-1/4)Del**2(Rho)) -0.6942465E-02 Diamond 0.5823234E-03 Metallicity 0.6499860E+00 Ellipticity -0.1387556E+01 Gb(Abramov) 0.5380395E-02 Vb(Abramov) -0.3818324E-02 Hb(Abramov) 0.1562071E-02 Ex_ueg -0.1006800E-02 Ec_ueg -0.2381299E-03 Delta_ex -0.1214900E-02 Delta_ec 0.4015973E-03 Delta_et -0.2602317E-02 Pxc 0.4227946E+01 Qxc -0.3025170E+01 3,+1 79 3 +1 -0.578274 -0.850333 1.486867 Rho 0.9689771E-02 |GRAD(Rho)| 0.1920851E-16 GRAD(Rho)x -0.1840510E-16 GRAD(Rho)y -0.2190250E-17 GRAD(Rho)z 0.5042032E-17 Laplacian 0.3968717E-01 (-1/4)Del**2(Rho)) -0.9921792E-02 Diamond 0.1221896E-02 Metallicity 0.7646902E+00 Ellipticity -0.1416857E+01 Gb(Abramov) 0.7879044E-02 Vb(Abramov) -0.5836297E-02 Hb(Abramov) 0.2042748E-02 Ex_ueg -0.1525702E-02 Ec_ueg -0.3539995E-03 Delta_ex -0.1858246E-02 Delta_ec 0.5393274E-03 Delta_et -0.3815574E-02 Pxc 0.4309899E+01 Qxc -0.3445487E+01 3,+1 80 3 +1 -0.244525 -2.609325 1.906885 Rho 0.3448394E-02 |GRAD(Rho)| 0.1623063E-13 GRAD(Rho)x -0.8266990E-14 GRAD(Rho)y 0.1363206E-13 GRAD(Rho)z 0.3042601E-14 Laplacian 0.1360047E-01 (-1/4)Del**2(Rho)) -0.3400118E-02 Diamond 0.1591778E-03 Metallicity 0.3987988E+00 Ellipticity -0.1520065E+01 Gb(Abramov) 0.2492739E-02 Vb(Abramov) -0.1585360E-02 Hb(Abramov) 0.9073788E-03 Ex_ueg -0.3847756E-03 Ec_ueg -0.8076439E-04 Delta_ex -0.5798015E-03 Delta_ec 0.3373748E-03 Delta_et -0.1675743E-02 Pxc 0.4764174E+01 Qxc -0.1718568E+01 3,+1 81 3 +3 -0.229766 -2.340878 1.395096 Rho 0.3053773E-02 |GRAD(Rho)| 0.3071423E-13 GRAD(Rho)x -0.1816005E-13 GRAD(Rho)y 0.2358551E-13 GRAD(Rho)z 0.7569670E-14 Laplacian 0.1212935E-01 (-1/4)Del**2(Rho)) -0.3032336E-02 Diamond 0.9551064E-04 Metallicity 0.3651773E+00 Ellipticity -0.7190370E+00 Gb(Abramov) 0.2206114E-02 Vb(Abramov) -0.1379892E-02 Hb(Abramov) 0.8262221E-03 Ex_ueg -0.3272157E-03 Ec_ueg -0.6414490E-04 Delta_ex -0.4599655E-03 Delta_ec 0.2206505E-03 Delta_et -0.1099555E-02 Pxc 0.5101196E+01 Qxc -0.2084588E+01 3,+3 82 3 -1 2.976208 0.068653 0.055297 Rho 0.5551012E-02 |GRAD(Rho)| 0.1286533E-12 GRAD(Rho)x 0.3524986E-13 GRAD(Rho)y 0.1193343E-12 GRAD(Rho)z -0.3268693E-13 Laplacian 0.2233890E-01 (-1/4)Del**2(Rho)) -0.5584725E-02 Diamond 0.6946573E-03 Metallicity 0.5368319E+00 Ellipticity 0.3346341E+01 Gb(Abramov) 0.4222826E-02 Vb(Abramov) -0.2860928E-02 Hb(Abramov) 0.1361899E-02 Ex_ueg -0.7259075E-03 Ec_ueg -0.1707016E-03 Delta_ex -0.1210277E-02 Delta_ec 0.8405543E-03 Delta_et -0.4655626E-02 Pxc 0.4252493E+01 Qxc -0.1439856E+01 3,-1 83 3 +1 1.755622 2.488457 0.013316 Rho 0.1246020E-01 |GRAD(Rho)| 0.7197086E-15 GRAD(Rho)x -0.5543541E-15 GRAD(Rho)y 0.3690047E-15 GRAD(Rho)z -0.2729606E-15 Laplacian 0.6238335E-01 (-1/4)Del**2(Rho)) -0.1559584E-01 Diamond 0.2590034E-02 Metallicity 0.7397517E+00 Ellipticity -0.1249300E+01 Gb(Abramov) 0.1232007E-01 Vb(Abramov) -0.9044294E-02 Hb(Abramov) 0.3275771E-02 Ex_ueg -0.2133462E-02 Ec_ueg -0.4808548E-03 Delta_ex -0.3085478E-02 Delta_ec 0.7890710E-03 Delta_et -0.5986883E-02 Pxc 0.4436812E+01 Qxc -0.3910267E+01 3,+1 84 3 +1 0.177455 1.986360 -2.234225 Rho 0.5719285E-02 |GRAD(Rho)| 0.1694852E-15 GRAD(Rho)x 0.8309074E-16 GRAD(Rho)y 0.1438311E-15 GRAD(Rho)z 0.3367146E-16 Laplacian 0.2316615E-01 (-1/4)Del**2(Rho)) -0.5791537E-02 Diamond 0.5811211E-03 Metallicity 0.5440794E+00 Ellipticity -0.2299863E+01 Gb(Abramov) 0.4386200E-02 Vb(Abramov) -0.2980864E-02 Hb(Abramov) 0.1405336E-02 Ex_ueg -0.7553949E-03 Ec_ueg -0.1779967E-03 Delta_ex -0.1131020E-02 Delta_ec 0.6378089E-03 Delta_et -0.3642737E-02 Pxc 0.4243870E+01 Qxc -0.1773290E+01 3,+1 85 3 +3 1.111447 1.472126 -0.001068 Rho 0.4428891E-02 |GRAD(Rho)| 0.5574709E-15 GRAD(Rho)x 0.2773649E-15 GRAD(Rho)y 0.3626198E-15 GRAD(Rho)z 0.3199209E-15 Laplacian 0.1756333E-01 (-1/4)Del**2(Rho)) -0.4390834E-02 Diamond 0.1100204E-03 Metallicity 0.4686312E+00 Ellipticity -0.7585634E-01 Gb(Abramov) 0.3270169E-02 Vb(Abramov) -0.2149505E-02 Hb(Abramov) 0.1120664E-02 Ex_ueg -0.5371700E-03 Ec_ueg -0.1224191E-03 Delta_ex -0.5934745E-03 Delta_ec 0.8930340E-04 Delta_et -0.6572859E-03 Pxc 0.4387961E+01 Qxc -0.6645598E+01 3,+3 86 3 +1 1.646134 -0.749907 0.004159 Rho 0.9186913E-02 |GRAD(Rho)| 0.6470752E-17 GRAD(Rho)x 0.6424400E-17 GRAD(Rho)y -0.4138412E-18 GRAD(Rho)z 0.6530310E-18 Laplacian 0.3826705E-01 (-1/4)Del**2(Rho)) -0.9566763E-02 Diamond 0.1093054E-02 Metallicity 0.7256673E+00 Ellipticity -0.1376483E+01 Gb(Abramov) 0.7534889E-02 Vb(Abramov) -0.5503016E-02 Hb(Abramov) 0.2031873E-02 Ex_ueg -0.1421056E-02 Ec_ueg -0.3313161E-03 Delta_ex -0.1766399E-02 Delta_ec 0.5182342E-03 Delta_et -0.3618712E-02 Pxc 0.4289125E+01 Qxc -0.3408496E+01 3,+1 87 3 +1 1.220036 0.658131 -2.401611 Rho 0.2439101E-01 |GRAD(Rho)| 0.2976215E-16 GRAD(Rho)x 0.1419302E-16 GRAD(Rho)y -0.3922690E-17 GRAD(Rho)z 0.2586420E-16 Laplacian 0.8704756E-01 (-1/4)Del**2(Rho)) -0.2176189E-01 Diamond 0.1057692E-01 Metallicity 0.1623950E+01 Ellipticity -0.4262035E+01 Gb(Abramov) 0.2039797E-01 Vb(Abramov) -0.1903404E-01 Hb(Abramov) 0.1363925E-02 Ex_ueg -0.5224259E-02 Ec_ueg -0.1058101E-02 Delta_ex -0.5330341E-02 Delta_ec 0.1391376E-02 Delta_et -0.1222929E-01 Pxc 0.4937390E+01 Qxc -0.3830985E+01 3,+1 88 3 -1 1.663807 -0.930702 1.557075 Rho 0.4993725E-01 |GRAD(Rho)| 0.7260463E-15 GRAD(Rho)x 0.4476069E-15 GRAD(Rho)y -0.5477279E-15 GRAD(Rho)z 0.1636622E-15 Laplacian 0.1852175E+00 (-1/4)Del**2(Rho)) -0.4630436E-01 Diamond 0.9205536E-01 Metallicity 0.2519449E+01 Ellipticity 0.1526478E-01 Gb(Abramov) 0.5031316E-01 Vb(Abramov) -0.5432195E-01 Hb(Abramov) -0.4008795E-02 Ex_ueg -0.1358161E-01 Ec_ueg -0.2411406E-02 Delta_ex -0.1516852E-01 Delta_ec 0.5389589E-02 Delta_et -0.5677688E-01 Pxc 0.5632237E+01 Qxc -0.2814411E+01 3,-1 89 3 +1 1.315536 -0.777376 2.327098 Rho 0.2940588E-01 |GRAD(Rho)| 0.4571926E-16 GRAD(Rho)x -0.3988183E-17 GRAD(Rho)y 0.1590240E-16 GRAD(Rho)z -0.4267855E-16 Laplacian 0.1135590E+00 (-1/4)Del**2(Rho)) -0.2838975E-01 Diamond 0.1755563E-01 Metallicity 0.1699998E+01 Ellipticity -0.3713443E+01 Gb(Abramov) 0.2697026E-01 Vb(Abramov) -0.2555076E-01 Hb(Abramov) 0.1419495E-02 Ex_ueg -0.6703433E-02 Ec_ueg -0.1313003E-02 Delta_ex -0.7288298E-02 Delta_ec 0.1768023E-02 Delta_et -0.1624679E-01 Pxc 0.5105423E+01 Qxc -0.4122286E+01 3,+1 90 3 +1 2.020220 0.021033 -2.805407 Rho 0.1176755E-01 |GRAD(Rho)| 0.1556536E-16 GRAD(Rho)x -0.4438539E-17 GRAD(Rho)y -0.1312398E-16 GRAD(Rho)z 0.7095129E-17 Laplacian 0.5037998E-01 (-1/4)Del**2(Rho)) -0.1259500E-01 Diamond 0.1358396E-02 Metallicity 0.8327191E+00 Ellipticity -0.1041470E+01 Gb(Abramov) 0.1014468E-01 Vb(Abramov) -0.7694363E-02 Hb(Abramov) 0.2450316E-02 Ex_ueg -0.1976817E-02 Ec_ueg -0.4488489E-03 Delta_ex -0.2283645E-02 Delta_ec 0.3325256E-03 Delta_et -0.2731012E-02 Pxc 0.4404192E+01 Qxc -0.6867577E+01 3,+1 91 3 +1 2.985936 0.066519 -0.252493 Rho 0.5474338E-02 |GRAD(Rho)| 0.9381425E-15 GRAD(Rho)x 0.1057719E-15 GRAD(Rho)y 0.1305568E-15 GRAD(Rho)z -0.9229727E-15 Laplacian 0.2258380E-01 (-1/4)Del**2(Rho)) -0.5645949E-02 Diamond 0.5552278E-03 Metallicity 0.5188425E+00 Ellipticity -0.2364890E+01 Gb(Abramov) 0.4252192E-02 Vb(Abramov) -0.2858436E-02 Hb(Abramov) 0.1393757E-02 Ex_ueg -0.7125694E-03 Ec_ueg -0.1673823E-03 Delta_ex -0.1110129E-02 Delta_ec 0.6528387E-03 Delta_et -0.3666510E-02 Pxc 0.4257138E+01 Qxc -0.1700465E+01 3,+1 92 3 +3 1.955505 0.012232 2.711893 Rho 0.1226600E-01 |GRAD(Rho)| 0.5843355E-16 GRAD(Rho)x -0.3555204E-16 GRAD(Rho)y 0.1011949E-16 GRAD(Rho)z -0.4525625E-16 Laplacian 0.5545289E-01 (-1/4)Del**2(Rho)) -0.1386322E-01 Diamond 0.1428734E-02 Metallicity 0.8107005E+00 Ellipticity -0.8650461E+00 Gb(Abramov) 0.1111530E-01 Vb(Abramov) -0.8367382E-02 Hb(Abramov) 0.2747921E-02 Ex_ueg -0.2089243E-02 Ec_ueg -0.4718623E-03 Delta_ex -0.2499905E-02 Delta_ec 0.2882948E-03 Delta_et -0.2501003E-02 Pxc 0.4427654E+01 Qxc -0.8671351E+01 3,+3 93 3 +1 2.028564 0.018772 2.823663 Rho 0.1229442E-01 |GRAD(Rho)| 0.1308988E-16 GRAD(Rho)x 0.6043795E-18 GRAD(Rho)y 0.1197844E-16 GRAD(Rho)z 0.5243731E-17 Laplacian 0.5629354E-01 (-1/4)Del**2(Rho)) -0.1407338E-01 Diamond 0.1776567E-02 Metallicity 0.8016808E+00 Ellipticity -0.1098897E+01 Gb(Abramov) 0.1126265E-01 Vb(Abramov) -0.8451916E-02 Hb(Abramov) 0.2810734E-02 Ex_ueg -0.2095701E-02 Ec_ueg -0.4731776E-03 Delta_ex -0.2629453E-02 Delta_ec 0.4532573E-03 Delta_et -0.3629267E-02 Pxc 0.4428994E+01 Qxc -0.5801237E+01 3,+1 94 3 +1 2.199191 -0.178359 -1.730246 Rho 0.2375904E-01 |GRAD(Rho)| 0.1224367E-15 GRAD(Rho)x 0.1134000E-15 GRAD(Rho)y 0.3659591E-16 GRAD(Rho)z -0.2814086E-16 Laplacian 0.8870007E-01 (-1/4)Del**2(Rho)) -0.2217502E-01 Diamond 0.1008960E-01 Metallicity 0.1525471E+01 Ellipticity -0.2962638E+01 Gb(Abramov) 0.2042124E-01 Vb(Abramov) -0.1866746E-01 Hb(Abramov) 0.1753781E-02 Ex_ueg -0.5044563E-02 Ec_ueg -0.1026439E-02 Delta_ex -0.5357856E-02 Delta_ec 0.1354447E-02 Delta_et -0.1184763E-01 Pxc 0.4914626E+01 Qxc -0.3955753E+01 3,+1 95 3 +1 2.175910 -0.156880 1.731968 Rho 0.2427894E-01 |GRAD(Rho)| 0.3793656E-16 GRAD(Rho)x 0.3584329E-16 GRAD(Rho)y 0.1127511E-16 GRAD(Rho)z 0.5226153E-17 Laplacian 0.9103129E-01 (-1/4)Del**2(Rho)) -0.2275782E-01 Diamond 0.1088104E-01 Metallicity 0.1541010E+01 Ellipticity -0.3221256E+01 Gb(Abramov) 0.2101689E-01 Vb(Abramov) -0.1927595E-01 Hb(Abramov) 0.1740936E-02 Ex_ueg -0.5192280E-02 Ec_ueg -0.1052479E-02 Delta_ex -0.5554964E-02 Delta_ec 0.1432880E-02 Delta_et -0.1258609E-01 Pxc 0.4933381E+01 Qxc -0.3876781E+01 3,+1 96 3 +3 1.992433 0.018369 -2.766689 Rho 0.1176633E-01 |GRAD(Rho)| 0.2333422E-14 GRAD(Rho)x 0.2134419E-14 GRAD(Rho)y 0.3330095E-16 GRAD(Rho)z 0.9423413E-15 Laplacian 0.5013576E-01 (-1/4)Del**2(Rho)) -0.1253394E-01 Diamond 0.1253331E-02 Metallicity 0.8366312E+00 Ellipticity -0.9536571E+00 Gb(Abramov) 0.1010367E-01 Vb(Abramov) -0.7673409E-02 Hb(Abramov) 0.2430266E-02 Ex_ueg -0.1976544E-02 Ec_ueg -0.4487928E-03 Delta_ex -0.2243351E-02 Delta_ec 0.2788565E-03 Delta_et -0.2369675E-02 Pxc 0.4404135E+01 Qxc -0.8044824E+01 3,+3 97 3 -1 1.715905 0.800450 1.580614 Rho 0.3837576E-01 |GRAD(Rho)| 0.2473217E-12 GRAD(Rho)x -0.2342633E-12 GRAD(Rho)y -0.7960253E-14 GRAD(Rho)z -0.7890119E-13 Laplacian 0.1404056E+00 (-1/4)Del**2(Rho)) -0.3510141E-01 Diamond 0.4730945E-01 Metallicity 0.2142843E+01 Ellipticity 0.3030365E-01 Gb(Abramov) 0.3593707E-01 Vb(Abramov) -0.3677274E-01 Hb(Abramov) -0.8356639E-03 Ex_ueg -0.9560070E-02 Ec_ueg -0.1783202E-02 Delta_ex -0.1067441E-01 Delta_ec 0.3932678E-02 Delta_et -0.3862590E-01 Pxc 0.5361182E+01 Qxc -0.2714286E+01 3,-1 98 3 -1 1.722940 0.794686 -1.600863 Rho 0.3808765E-01 |GRAD(Rho)| 0.1560843E-12 GRAD(Rho)x 0.1463926E-12 GRAD(Rho)y -0.2342401E-13 GRAD(Rho)z -0.4881450E-13 Laplacian 0.1388682E+00 (-1/4)Del**2(Rho)) -0.3471705E-01 Diamond 0.4619813E-01 Metallicity 0.2139525E+01 Ellipticity 0.2364753E-01 Gb(Abramov) 0.3552436E-01 Vb(Abramov) -0.3633168E-01 Hb(Abramov) -0.8073184E-03 Ex_ueg -0.9464493E-02 Ec_ueg -0.1767845E-02 Delta_ex -0.1053047E-01 Delta_ec 0.3876998E-02 Delta_et -0.3800136E-01 Pxc 0.5353688E+01 Qxc -0.2716139E+01 3,-1 99 3 -1 3.209788 2.345542 -2.215481 Rho 0.2295323E+00 |GRAD(Rho)| 0.2559235E-14 GRAD(Rho)x -0.2141137E-14 GRAD(Rho)y 0.9382143E-15 GRAD(Rho)z 0.1041620E-14 Laplacian 0.8414312E+00 (-1/4)Del**2(Rho)) -0.2103578E+00 Diamond 0.2825700E+01 Metallicity 0.7046945E+01 Ellipticity 0.4759334E-02 Gb(Abramov) 0.3873019E+00 Vb(Abramov) -0.5642459E+00 Hb(Abramov) -0.1769440E+00 Ex_ueg -0.1037951E+00 Ec_ueg -0.1371851E-01 Delta_ex -0.1005176E+00 Delta_ec 0.1888613E-01 Delta_et -0.2613627E+00 Pxc 0.7566060E+01 Qxc -0.5322301E+01 3,-1 100 3 -1 3.198111 2.339666 2.212721 Rho 0.2298114E+00 |GRAD(Rho)| 0.1377937E-15 GRAD(Rho)x 0.9578926E-16 GRAD(Rho)y 0.6575686E-16 GRAD(Rho)z 0.7407811E-16 Laplacian 0.8421733E+00 (-1/4)Del**2(Rho)) -0.2105433E+00 Diamond 0.2831636E+01 Metallicity 0.7055008E+01 Ellipticity 0.6027171E-02 Gb(Abramov) 0.3879264E+00 Vb(Abramov) -0.5653094E+00 Hb(Abramov) -0.1773830E+00 Ex_ueg -0.1039634E+00 Ec_ueg -0.1373765E-01 Delta_ex -0.1006341E+00 Delta_ec 0.1888913E-01 Delta_et -0.2613900E+00 Pxc 0.7567772E+01 Qxc -0.5327622E+01 3,-1 101 3 +1 2.972559 0.066052 0.228322 Rho 0.5534719E-02 |GRAD(Rho)| 0.1582574E-12 GRAD(Rho)x -0.5200585E-13 GRAD(Rho)y -0.9625811E-13 GRAD(Rho)z 0.1143467E-12 Laplacian 0.2272000E-01 (-1/4)Del**2(Rho)) -0.5680001E-02 Diamond 0.6088819E-03 Metallicity 0.5252475E+00 Ellipticity -0.3584240E+01 Gb(Abramov) 0.4283902E-02 Vb(Abramov) -0.2887803E-02 Hb(Abramov) 0.1396099E-02 Ex_ueg -0.7230680E-03 Ec_ueg -0.1699960E-03 Delta_ex -0.1153352E-02 Delta_ec 0.7175804E-03 Delta_et -0.4016821E-02 Pxc 0.4253441E+01 Qxc -0.1607279E+01 3,+1 102 3 -1 -2.742701 -0.929327 1.625197 Rho 0.7071812E-01 |GRAD(Rho)| 0.7275508E-16 GRAD(Rho)x -0.3178872E-16 GRAD(Rho)y 0.6493524E-16 GRAD(Rho)z 0.8135963E-17 Laplacian 0.2936732E+00 (-1/4)Del**2(Rho)) -0.7341830E-01 Diamond 0.2398691E+00 Metallicity 0.2837701E+01 Ellipticity 0.4902780E-02 Gb(Abramov) 0.8366874E-01 Vb(Abramov) -0.9391917E-01 Hb(Abramov) -0.1025043E-01 Ex_ueg -0.2159862E-01 Ec_ueg -0.3588625E-02 Delta_ex -0.2644369E-01 Delta_ec 0.8792942E-02 Delta_et -0.1012749E+00 Pxc 0.6018634E+01 Qxc -0.3007376E+01 3,-1 103 3 -1 -0.205730 -3.406380 -1.587704 Rho 0.4158544E-02 |GRAD(Rho)| 0.1228787E-16 GRAD(Rho)x 0.7311573E-17 GRAD(Rho)y 0.9800023E-17 GRAD(Rho)z 0.1221553E-17 Laplacian 0.1548378E-01 (-1/4)Del**2(Rho)) -0.3870946E-02 Diamond 0.4380598E-03 Metallicity 0.4785987E+00 Ellipticity 0.1842950E+00 Gb(Abramov) 0.2889402E-02 Vb(Abramov) -0.1907858E-02 Hb(Abramov) 0.9815436E-03 Ex_ueg -0.4939012E-03 Ec_ueg -0.1108832E-03 Delta_ex -0.9287168E-03 Delta_ec 0.8185788E-03 Delta_et -0.4069802E-02 Pxc 0.4454248E+01 Qxc -0.1134548E+01 3,-1 104 3 -1 -2.810439 0.896085 -1.641387 Rho 0.1973272E+00 |GRAD(Rho)| 0.2854742E-15 GRAD(Rho)x -0.1399705E-15 GRAD(Rho)y 0.2482823E-15 GRAD(Rho)z 0.1611395E-16 Laplacian 0.7981142E+00 (-1/4)Del**2(Rho)) -0.1995285E+00 Diamond 0.2213510E+01 Metallicity 0.5774659E+01 Ellipticity 0.2322262E-01 Gb(Abramov) 0.3250539E+00 Vb(Abramov) -0.4505793E+00 Hb(Abramov) -0.1255254E+00 Ex_ueg -0.8484657E-01 Ec_ueg -0.1153935E-01 Delta_ex -0.9155745E-01 Delta_ec 0.1842951E-01 Delta_et -0.2516418E+00 Pxc 0.7352803E+01 Qxc -0.4967981E+01 3,-1 105 3 -1 -3.008539 2.072431 0.787062 Rho 0.1498994E+00 |GRAD(Rho)| 0.1625603E-12 GRAD(Rho)x 0.4735687E-13 GRAD(Rho)y -0.6957149E-13 GRAD(Rho)z 0.1390790E-12 Laplacian 0.5839529E+00 (-1/4)Del**2(Rho)) -0.1459882E+00 Diamond 0.1189949E+01 Metallicity 0.4991546E+01 Ellipticity 0.4861755E-01 Gb(Abramov) 0.2187766E+00 Vb(Abramov) -0.2915650E+00 Hb(Abramov) -0.7278841E-01 Ex_ueg -0.5881004E-01 Ec_ueg -0.8437073E-02 Delta_ex -0.6277569E-01 Delta_ec 0.1495260E-01 Delta_et -0.1993385E+00 Pxc 0.6970432E+01 Qxc -0.4198314E+01 3,-1 106 3 -1 -3.191473 2.213736 2.289995 Rho 0.2258036E+00 |GRAD(Rho)| 0.9180013E-12 GRAD(Rho)x 0.6048759E-12 GRAD(Rho)y -0.3570296E-12 GRAD(Rho)z -0.5910850E-12 Laplacian 0.8442337E+00 (-1/4)Del**2(Rho)) -0.2110584E+00 Diamond 0.2764688E+01 Metallicity 0.6834427E+01 Ellipticity 0.7782382E-02 Gb(Abramov) 0.3811162E+00 Vb(Abramov) -0.5511739E+00 Hb(Abramov) -0.1700577E+00 Ex_ueg -0.1015531E+00 Ec_ueg -0.1346328E-01 Delta_ex -0.1003375E+00 Delta_ec 0.1888317E-01 Delta_et -0.2604776E+00 Pxc 0.7542964E+01 Qxc -0.5313596E+01 3,-1 107 3 -1 -1.727050 1.572312 0.815126 Rho 0.5000715E-01 |GRAD(Rho)| 0.1020492E-16 GRAD(Rho)x 0.7849454E-17 GRAD(Rho)y -0.6472602E-17 GRAD(Rho)z 0.7949404E-18 Laplacian 0.1880710E+00 (-1/4)Del**2(Rho)) -0.4701774E-01 Diamond 0.9266059E-01 Metallicity 0.2487014E+01 Ellipticity 0.1360349E-01 Gb(Abramov) 0.5083413E-01 Vb(Abramov) -0.5465051E-01 Hb(Abramov) -0.3816386E-02 Ex_ueg -0.1360696E-01 Ec_ueg -0.2415269E-02 Delta_ex -0.1536496E-01 Delta_ec 0.5396321E-02 Delta_et -0.5684620E-01 Pxc 0.5633725E+01 Qxc -0.2847302E+01 3,-1 108 3 +1 -2.267420 -1.793524 -0.053389 Rho 0.3336155E-01 |GRAD(Rho)| 0.6850490E-16 GRAD(Rho)x 0.2290752E-17 GRAD(Rho)y -0.2253250E-16 GRAD(Rho)z 0.6465261E-16 Laplacian 0.1366509E+00 (-1/4)Del**2(Rho)) -0.3416272E-01 Diamond 0.2575312E-01 Metallicity 0.1743456E+01 Ellipticity -0.4401617E+01 Gb(Abramov) 0.3270201E-01 Vb(Abramov) -0.3124131E-01 Hb(Abramov) 0.1460705E-02 Ex_ueg -0.7931950E-02 Ec_ueg -0.1518268E-02 Delta_ex -0.9123676E-02 Delta_ec 0.2207238E-02 Delta_et -0.2086944E-01 Pxc 0.5224342E+01 Qxc -0.4133526E+01 3,+1 109 3 +1 -1.303573 2.362525 -0.731118 Rho 0.2760254E-01 |GRAD(Rho)| 0.4064563E-16 GRAD(Rho)x 0.1726966E-16 GRAD(Rho)y 0.1078054E-16 GRAD(Rho)z -0.3517963E-16 Laplacian 0.1054390E+00 (-1/4)Del**2(Rho)) -0.2635975E-01 Diamond 0.1498936E-01 Metallicity 0.1647633E+01 Ellipticity -0.3578602E+01 Gb(Abramov) 0.2481170E-01 Vb(Abramov) -0.2326364E-01 Hb(Abramov) 0.1548051E-02 Ex_ueg -0.6160991E-02 Ec_ueg -0.1220620E-02 Delta_ex -0.6656418E-02 Delta_ec 0.1650572E-02 Delta_et -0.1494609E-01 Pxc 0.5047426E+01 Qxc -0.4032794E+01 3,+1 110 3 -1 -1.778612 -1.670174 -2.316114 Rho 0.1505693E+00 |GRAD(Rho)| 0.4702360E-14 GRAD(Rho)x 0.3296923E-14 GRAD(Rho)y -0.3165979E-14 GRAD(Rho)z -0.1104111E-14 Laplacian 0.6217638E+00 (-1/4)Del**2(Rho)) -0.1554410E+00 Diamond 0.1274535E+01 Metallicity 0.4722969E+01 Ellipticity 0.1446637E-01 Gb(Abramov) 0.2259845E+00 Vb(Abramov) -0.2965280E+00 Hb(Abramov) -0.7054350E-01 Ex_ueg -0.5916075E-01 Ec_ueg -0.8479968E-02 Delta_ex -0.6692086E-01 Delta_ec 0.1591618E-01 Delta_et -0.2123478E+00 Pxc 0.6976530E+01 Qxc -0.4204580E+01 3,-1 111 3 -1 -1.758835 -1.673083 -0.821965 Rho 0.6502388E-01 |GRAD(Rho)| 0.1183542E-14 GRAD(Rho)x 0.6302823E-15 GRAD(Rho)y -0.9710962E-15 GRAD(Rho)z 0.2459445E-15 Laplacian 0.2501078E+00 (-1/4)Del**2(Rho)) -0.6252694E-01 Diamond 0.1787626E+00 Metallicity 0.2896949E+01 Ellipticity 0.2309086E-01 Gb(Abramov) 0.7187419E-01 Vb(Abramov) -0.8122143E-01 Hb(Abramov) -0.9347242E-02 Ex_ueg -0.1931148E-01 Ec_ueg -0.3260784E-02 Delta_ex -0.2193431E-01 Delta_ec 0.7304221E-02 Delta_et -0.8229347E-01 Pxc 0.5922343E+01 Qxc -0.3002964E+01 3,-1 112 3 -1 -1.757047 -1.665084 0.808672 Rho 0.6628436E-01 |GRAD(Rho)| 0.2778428E-13 GRAD(Rho)x 0.1183093E-14 GRAD(Rho)y 0.2511937E-13 GRAD(Rho)z -0.1181456E-13 Laplacian 0.2560876E+00 (-1/4)Del**2(Rho)) -0.6402190E-01 Diamond 0.1877205E+00 Metallicity 0.2921302E+01 Ellipticity 0.2484243E-01 Gb(Abramov) 0.7385248E-01 Vb(Abramov) -0.8368306E-01 Hb(Abramov) -0.9830580E-02 Ex_ueg -0.1981222E-01 Ec_ueg -0.3333040E-02 Delta_ex -0.2256541E-01 Delta_ec 0.7469357E-02 Delta_et -0.8454947E-01 Pxc 0.5944190E+01 Qxc -0.3021064E+01 3,-1 113 3 -1 -1.749051 -1.643735 2.298915 Rho 0.1286642E+00 |GRAD(Rho)| 0.1552434E-12 GRAD(Rho)x -0.1925204E-14 GRAD(Rho)y -0.1490777E-12 GRAD(Rho)z -0.4327394E-13 Laplacian 0.5397316E+00 (-1/4)Del**2(Rho)) -0.1349329E+00 Diamond 0.9227798E+00 Metallicity 0.4186633E+01 Ellipticity 0.1012893E-01 Gb(Abramov) 0.1841077E+00 Vb(Abramov) -0.2332825E+00 Hb(Abramov) -0.4917479E-01 Ex_ueg -0.4797283E-01 Ec_ueg -0.7092051E-02 Delta_ex -0.5599882E-01 Delta_ec 0.1450125E-01 Delta_et -0.1891226E+00 Pxc 0.6764310E+01 Qxc -0.3861654E+01 3,-1 114 3 +1 -0.158768 2.213401 -1.979390 Rho 0.5806145E-02 |GRAD(Rho)| 0.4333915E-13 GRAD(Rho)x -0.1860062E-13 GRAD(Rho)y 0.3855474E-13 GRAD(Rho)z -0.6769880E-14 Laplacian 0.2381273E-01 (-1/4)Del**2(Rho)) -0.5953182E-02 Diamond 0.6747925E-03 Metallicity 0.5427717E+00 Ellipticity -0.4129292E+01 Gb(Abramov) 0.4507324E-02 Vb(Abramov) -0.3061467E-02 Hb(Abramov) 0.1445857E-02 Ex_ueg -0.7707300E-03 Ec_ueg -0.1817678E-03 Delta_ex -0.1215806E-02 Delta_ec 0.7441716E-03 Delta_et -0.4228989E-02 Pxc 0.4240190E+01 Qxc -0.1633771E+01 3,+1 115 3 +1 -1.270487 2.373921 0.708833 Rho 0.2736344E-01 |GRAD(Rho)| 0.1619972E-14 GRAD(Rho)x 0.1235575E-14 GRAD(Rho)y 0.5633518E-15 GRAD(Rho)z -0.8833453E-15 Laplacian 0.1037035E+00 (-1/4)Del**2(Rho)) -0.2592589E-01 Diamond 0.1452304E-01 Metallicity 0.1651089E+01 Ellipticity -0.3588002E+01 Gb(Abramov) 0.2441825E-01 Vb(Abramov) -0.2291061E-01 Hb(Abramov) 0.1507636E-02 Ex_ueg -0.6089934E-02 Ec_ueg -0.1208430E-02 Delta_ex -0.6527190E-02 Delta_ec 0.1615901E-02 Delta_et -0.1460385E-01 Pxc 0.5039541E+01 Qxc -0.4039349E+01 3,+1 116 3 +1 -0.219207 2.255596 1.935537 Rho 0.6369194E-02 |GRAD(Rho)| 0.2841423E-13 GRAD(Rho)x 0.1480594E-13 GRAD(Rho)y -0.2405757E-13 GRAD(Rho)z -0.3063649E-14 Laplacian 0.2695431E-01 (-1/4)Del**2(Rho)) -0.6738577E-02 Diamond 0.7460286E-03 Metallicity 0.5594901E+00 Ellipticity -0.1995263E+01 Gb(Abramov) 0.5120746E-02 Vb(Abramov) -0.3502915E-02 Hb(Abramov) 0.1617831E-02 Ex_ueg -0.8719623E-03 Ec_ueg -0.2063024E-03 Delta_ex -0.1321694E-02 Delta_ec 0.6993116E-03 Delta_et -0.4141778E-02 Pxc 0.4226621E+01 Qxc -0.1889993E+01 3,+1 117 3 -1 -0.567120 -0.706397 -3.196632 Rho 0.1229081E+00 |GRAD(Rho)| 0.3420327E-15 GRAD(Rho)x 0.1094096E-15 GRAD(Rho)y 0.2374403E-15 GRAD(Rho)z -0.2205403E-15 Laplacian 0.5361629E+00 (-1/4)Del**2(Rho)) -0.1340407E+00 Diamond 0.8849940E+00 Metallicity 0.3904964E+01 Ellipticity 0.6622807E-02 Gb(Abramov) 0.1765978E+00 Vb(Abramov) -0.2191550E+00 Hb(Abramov) -0.4255713E-01 Ex_ueg -0.4513279E-01 Ec_ueg -0.6732533E-02 Delta_ex -0.5524935E-01 Delta_ec 0.1496401E-01 Delta_et -0.1943089E+00 Pxc 0.6703687E+01 Qxc -0.3692149E+01 3,-1 118 3 -1 -0.539597 -0.679302 3.164537 Rho 0.1499397E+00 |GRAD(Rho)| 0.3551615E-13 GRAD(Rho)x 0.1751946E-13 GRAD(Rho)y 0.2603524E-13 GRAD(Rho)z 0.1663224E-13 Laplacian 0.6352778E+00 (-1/4)Del**2(Rho)) -0.1588194E+00 Diamond 0.1285194E+01 Metallicity 0.4590332E+01 Ellipticity 0.1948855E-01 Gb(Abramov) 0.2273853E+00 Vb(Abramov) -0.2959511E+00 Hb(Abramov) -0.6856585E-01 Ex_ueg -0.5883116E-01 Ec_ueg -0.8439657E-02 Delta_ex -0.6820041E-01 Delta_ec 0.1609204E-01 Delta_et -0.2141403E+00 Pxc 0.6970800E+01 Qxc -0.4238145E+01 3,-1 119 3 -1 0.014229 2.089267 2.095302 Rho 0.6518188E-02 |GRAD(Rho)| 0.2602918E-17 GRAD(Rho)x -0.2110103E-17 GRAD(Rho)y -0.2141924E-18 GRAD(Rho)z -0.1508896E-17 Laplacian 0.2638453E-01 (-1/4)Del**2(Rho)) -0.6596133E-02 Diamond 0.1022656E-02 Metallicity 0.5940303E+00 Ellipticity 0.1640800E+01 Gb(Abramov) 0.5050472E-02 Vb(Abramov) -0.3504812E-02 Hb(Abramov) 0.1545660E-02 Ex_ueg -0.8992647E-03 Ec_ueg -0.2128205E-03 Delta_ex -0.1475710E-02 Delta_ec 0.9979888E-03 Delta_et -0.5802907E-02 Pxc 0.4225461E+01 Qxc -0.1478684E+01 3,-1 120 3 -1 -0.540656 0.716908 3.182781 Rho 0.1468605E+00 |GRAD(Rho)| 0.7979828E-13 GRAD(Rho)x 0.4867793E-13 GRAD(Rho)y -0.5548523E-13 GRAD(Rho)z 0.3032514E-13 Laplacian 0.6151748E+00 (-1/4)Del**2(Rho)) -0.1537937E+00 Diamond 0.1213214E+01 Metallicity 0.4579200E+01 Ellipticity 0.1644767E-01 Gb(Abramov) 0.2199045E+00 Vb(Abramov) -0.2860153E+00 Hb(Abramov) -0.6611078E-01 Ex_ueg -0.5722578E-01 Ec_ueg -0.8242844E-02 Delta_ex -0.6569968E-01 Delta_ec 0.1565079E-01 Delta_et -0.2076343E+00 Pxc 0.6942480E+01 Qxc -0.4197849E+01 3,-1 121 3 -1 -0.060567 0.007253 4.444506 Rho 0.2289675E+00 |GRAD(Rho)| 0.2676238E-10 GRAD(Rho)x 0.5183047E-11 GRAD(Rho)y 0.1030305E-12 GRAD(Rho)z -0.2625548E-10 Laplacian 0.8675623E+00 (-1/4)Del**2(Rho)) -0.2168906E+00 Diamond 0.2882104E+01 Metallicity 0.6806684E+01 Ellipticity 0.1650317E-02 Gb(Abramov) 0.3906446E+00 Vb(Abramov) -0.5643987E+00 Hb(Abramov) -0.1737541E+00 Ex_ueg -0.1034547E+00 Ec_ueg -0.1367980E-01 Delta_ex -0.1034442E+00 Delta_ec 0.1925657E-01 Delta_et -0.2655048E+00 Pxc 0.7562586E+01 Qxc -0.5371888E+01 3,-1 122 3 -1 -0.534735 2.411591 -0.005894 Rho 0.5096525E-01 |GRAD(Rho)| 0.2231051E-15 GRAD(Rho)x 0.8656761E-16 GRAD(Rho)y 0.2056045E-15 GRAD(Rho)z 0.2950302E-17 Laplacian 0.1947446E+00 (-1/4)Del**2(Rho)) -0.4868615E-01 Diamond 0.9919851E-01 Metallicity 0.2478970E+01 Ellipticity 0.9327111E-02 Gb(Abramov) 0.5257268E-01 Vb(Abramov) -0.5645922E-01 Hb(Abramov) -0.3886535E-02 Ex_ueg -0.1395567E-01 Ec_ueg -0.2468298E-02 Delta_ex -0.1601814E-01 Delta_ec 0.5642554E-02 Delta_et -0.5974900E-01 Pxc 0.5653962E+01 Qxc -0.2838810E+01 3,-1 123 3 -1 -0.058678 2.146451 -2.055939 Rho 0.5815756E-02 |GRAD(Rho)| 0.2528817E-16 GRAD(Rho)x -0.2317622E-16 GRAD(Rho)y 0.6275743E-17 GRAD(Rho)z 0.7935329E-17 Laplacian 0.2330494E-01 (-1/4)Del**2(Rho)) -0.5826236E-02 Diamond 0.7470810E-03 Metallicity 0.5561289E+00 Ellipticity 0.3851498E+01 Gb(Abramov) 0.4424180E-02 Vb(Abramov) -0.3022125E-02 Hb(Abramov) 0.1402056E-02 Ex_ueg -0.7724316E-03 Ec_ueg -0.1821853E-03 Delta_ex -0.1254949E-02 Delta_ec 0.8437826E-03 Delta_et -0.4751314E-02 Pxc 0.4239813E+01 Qxc -0.1487289E+01 3,-1 124 3 +1 1.343501 0.740707 2.277172 Rho 0.2567393E-01 |GRAD(Rho)| 0.9334418E-15 GRAD(Rho)x 0.5226941E-15 GRAD(Rho)y 0.7688909E-15 GRAD(Rho)z 0.8313407E-16 Laplacian 0.9348940E-01 (-1/4)Del**2(Rho)) -0.2337235E-01 Diamond 0.1114312E-01 Metallicity 0.1646915E+01 Ellipticity -0.2806073E+01 Gb(Abramov) 0.2199695E-01 Vb(Abramov) -0.2062155E-01 Hb(Abramov) 0.1375403E-02 Ex_ueg -0.5593816E-02 Ec_ueg -0.1122705E-02 Delta_ex -0.5694566E-02 Delta_ec 0.1298168E-02 Delta_et -0.1159518E-01 Pxc 0.4982445E+01 Qxc -0.4386616E+01 3,+1 125 3 -1 0.857161 0.740884 3.479431 Rho 0.1400049E+00 |GRAD(Rho)| 0.7401538E-13 GRAD(Rho)x -0.2046095E-13 GRAD(Rho)y 0.7107754E-13 GRAD(Rho)z -0.2758346E-14 Laplacian 0.5513556E+00 (-1/4)Del**2(Rho)) -0.1378389E+00 Diamond 0.1030563E+01 Metallicity 0.4717952E+01 Ellipticity 0.4672841E-01 Gb(Abramov) 0.2002788E+00 Vb(Abramov) -0.2627187E+00 Hb(Abramov) -0.6243991E-01 Ex_ueg -0.5369198E-01 Ec_ueg -0.7806787E-02 Delta_ex -0.5824221E-01 Delta_ec 0.1426863E-01 Delta_et -0.1881384E+00 Pxc 0.6877603E+01 Qxc -0.4081836E+01 3,-1 126 3 -1 0.881307 0.758565 -3.509501 Rho 0.1123681E+00 |GRAD(Rho)| 0.5772496E-15 GRAD(Rho)x 0.4295473E-15 GRAD(Rho)y 0.3442071E-15 GRAD(Rho)z 0.1738611E-15 Laplacian 0.4643839E+00 (-1/4)Del**2(Rho)) -0.1160960E+00 Diamond 0.6873696E+00 Metallicity 0.3882764E+01 Ellipticity 0.1326926E-01 Gb(Abramov) 0.1525262E+00 Vb(Abramov) -0.1889564E+00 Hb(Abramov) -0.3643021E-01 Ex_ueg -0.4004752E-01 Ec_ueg -0.6080172E-02 Delta_ex -0.4684279E-01 Delta_ec 0.1320710E-01 Delta_et -0.1686343E+00 Pxc 0.6586577E+01 Qxc -0.3546787E+01 3,-1 127 3 -1 2.969376 -0.801927 1.997355 Rho 0.7954669E-01 |GRAD(Rho)| 0.4500521E-15 GRAD(Rho)x -0.1903232E-15 GRAD(Rho)y -0.4047632E-15 GRAD(Rho)z -0.4990760E-16 Laplacian 0.3192821E+00 (-1/4)Del**2(Rho)) -0.7982053E-01 Diamond 0.2977938E+00 Metallicity 0.3175475E+01 Ellipticity 0.7929346E-02 Gb(Abramov) 0.9545837E-01 Vb(Abramov) -0.1110962E+00 Hb(Abramov) -0.1563784E-01 Ex_ueg -0.2526666E-01 Ec_ueg -0.4103747E-02 Delta_ex -0.2944731E-01 Delta_ec 0.9210115E-02 Delta_et -0.1088847E+00 Pxc 0.6156974E+01 Qxc -0.3197279E+01 3,-1 128 3 -1 2.017312 1.561137 -2.741474 Rho 0.1571024E+00 |GRAD(Rho)| 0.6084707E-12 GRAD(Rho)x 0.3328238E-12 GRAD(Rho)y 0.8857629E-13 GRAD(Rho)z 0.5016165E-12 Laplacian 0.6111339E+00 (-1/4)Del**2(Rho)) -0.1527835E+00 Diamond 0.1311319E+01 Metallicity 0.5157605E+01 Ellipticity 0.2981259E-01 Gb(Abramov) 0.2331885E+00 Vb(Abramov) -0.3135935E+00 Hb(Abramov) -0.8040499E-01 Ex_ueg -0.6260785E-01 Ec_ueg -0.8899709E-02 Delta_ex -0.6640257E-01 Delta_ec 0.1536254E-01 Delta_et -0.2058741E+00 Pxc 0.7034820E+01 Qxc -0.4322370E+01 3,-1 129 3 -1 0.512101 -0.034316 2.378194 Rho 0.5858207E-01 |GRAD(Rho)| 0.2194250E-13 GRAD(Rho)x 0.1255634E-13 GRAD(Rho)y 0.1235905E-15 GRAD(Rho)z -0.1799434E-13 Laplacian 0.2242345E+00 (-1/4)Del**2(Rho)) -0.5605863E-01 Diamond 0.1379364E+00 Metallicity 0.2715513E+01 Ellipticity 0.9419632E-02 Gb(Abramov) 0.6274374E-01 Vb(Abramov) -0.6942886E-01 Hb(Abramov) -0.6685111E-02 Ex_ueg -0.1680369E-01 Ec_ueg -0.2894478E-02 Delta_ex -0.1910638E-01 Delta_ec 0.6483309E-02 Delta_et -0.7113160E-01 Pxc 0.5805429E+01 Qxc -0.2947011E+01 3,-1 130 3 -1 1.994453 1.532890 2.713224 Rho 0.1343900E+00 |GRAD(Rho)| 0.6216277E-15 GRAD(Rho)x 0.3303564E-15 GRAD(Rho)y 0.1343902E-15 GRAD(Rho)z -0.5091413E-15 Laplacian 0.5268427E+00 (-1/4)Del**2(Rho)) -0.1317107E+00 Diamond 0.9407325E+00 Metallicity 0.4611871E+01 Ellipticity 0.3105531E-01 Gb(Abramov) 0.1890459E+00 Vb(Abramov) -0.2463811E+00 Hb(Abramov) -0.5733521E-01 Ex_ueg -0.5084025E-01 Ec_ueg -0.7451867E-02 Delta_ex -0.5513999E-01 Delta_ec 0.1383666E-01 Delta_et -0.1814226E+00 Pxc 0.6822484E+01 Qxc -0.3985064E+01 3,-1 131 3 -1 3.272408 -2.263409 -2.196816 Rho 0.2218144E+00 |GRAD(Rho)| 0.3780950E-14 GRAD(Rho)x -0.6007564E-15 GRAD(Rho)y 0.3692522E-14 GRAD(Rho)z 0.5476847E-15 Laplacian 0.8231291E+00 (-1/4)Del**2(Rho)) -0.2057823E+00 Diamond 0.2651970E+01 Metallicity 0.6804475E+01 Ellipticity 0.1879357E-01 Gb(Abramov) 0.3705616E+00 Vb(Abramov) -0.5353409E+00 Hb(Abramov) -0.1647793E+00 Ex_ueg -0.9916793E-01 Ec_ueg -0.1319106E-01 Delta_ex -0.9745839E-01 Delta_ec 0.1864924E-01 Delta_et -0.2575967E+00 Pxc 0.7517815E+01 Qxc -0.5225865E+01 3,-1 132 3 +3 2.291041 0.071973 -0.002398 Rho 0.4432989E-02 |GRAD(Rho)| 0.5026733E-17 GRAD(Rho)x -0.3787653E-17 GRAD(Rho)y -0.6758020E-18 GRAD(Rho)z -0.3234969E-17 Laplacian 0.1857216E-01 (-1/4)Del**2(Rho)) -0.4643039E-02 Diamond 0.1493350E-03 Metallicity 0.4438592E+00 Ellipticity -0.2838939E+00 Gb(Abramov) 0.3438835E-02 Vb(Abramov) -0.2234631E-02 Hb(Abramov) 0.1204204E-02 Ex_ueg -0.5378327E-03 Ec_ueg -0.1225942E-03 Delta_ex -0.6635325E-03 Delta_ec 0.1583709E-03 Delta_et -0.1003910E-02 Pxc 0.4387098E+01 Qxc -0.4189738E+01 3,+3 133 3 -1 3.233672 -2.264937 2.193656 Rho 0.2219654E+00 |GRAD(Rho)| 0.7524540E-15 GRAD(Rho)x 0.4029979E-15 GRAD(Rho)y -0.5403664E-15 GRAD(Rho)z 0.3343408E-15 Laplacian 0.8250661E+00 (-1/4)Del**2(Rho)) -0.2062665E+00 Diamond 0.2659054E+01 Metallicity 0.6796208E+01 Ellipticity 0.1992948E-01 Gb(Abramov) 0.3711494E+00 Vb(Abramov) -0.5360323E+00 Hb(Abramov) -0.1648829E+00 Ex_ueg -0.9925801E-01 Ec_ueg -0.1320135E-01 Delta_ex -0.9769706E-01 Delta_ec 0.1867541E-01 Delta_et -0.2579118E+00 Pxc 0.7518776E+01 Qxc -0.5231322E+01 3,-1 134 3 -1 2.747967 -1.682385 -0.870272 Rho 0.1322081E+00 |GRAD(Rho)| 0.1022479E-12 GRAD(Rho)x 0.6534661E-13 GRAD(Rho)y 0.1982559E-13 GRAD(Rho)z 0.7610119E-13 Laplacian 0.5449443E+00 (-1/4)Del**2(Rho)) -0.1362361E+00 Diamond 0.9591251E+00 Metallicity 0.4338680E+01 Ellipticity 0.6251529E-02 Gb(Abramov) 0.1893382E+00 Vb(Abramov) -0.2424403E+00 Hb(Abramov) -0.5310211E-01 Ex_ueg -0.4974266E-01 Ec_ueg -0.7314498E-02 Delta_ex -0.5686867E-01 Delta_ec 0.1447397E-01 Delta_et -0.1894825E+00 Pxc 0.6800557E+01 Qxc -0.3929031E+01 3,-1 135 3 -1 2.741268 -1.677340 0.853592 Rho 0.1485010E+00 |GRAD(Rho)| 0.4646685E-14 GRAD(Rho)x 0.2629848E-14 GRAD(Rho)y 0.2368992E-14 GRAD(Rho)z 0.3010558E-14 Laplacian 0.6091265E+00 (-1/4)Del**2(Rho)) -0.1522816E+00 Diamond 0.1227159E+01 Metallicity 0.4711089E+01 Ellipticity 0.1032892E-01 Gb(Abramov) 0.2210898E+00 Vb(Abramov) -0.2898980E+00 Hb(Abramov) -0.6880818E-01 Ex_ueg -0.5807968E-01 Ec_ueg -0.8347626E-02 Delta_ex -0.6532963E-01 Delta_ec 0.1562987E-01 Delta_et -0.2080821E+00 Pxc 0.6957629E+01 Qxc -0.4179794E+01 3,-1 136 3 -1 -2.997857 2.063978 -0.794862 Rho 0.1227434E+00 |GRAD(Rho)| 0.1822269E-15 GRAD(Rho)x -0.1713649E-15 GRAD(Rho)y -0.6195877E-16 GRAD(Rho)z -0.1341700E-17 Laplacian 0.4841910E+00 (-1/4)Del**2(Rho)) -0.1210478E+00 Diamond 0.7749472E+00 Metallicity 0.4314461E+01 Ellipticity 0.3219112E-01 Gb(Abramov) 0.1677412E+00 Vb(Abramov) -0.2144346E+00 Hb(Abramov) -0.4669340E-01 Ex_ueg -0.4505219E-01 Ec_ueg -0.6722281E-02 Delta_ex -0.4957903E-01 Delta_ec 0.1298381E-01 Delta_et -0.1676868E+00 Pxc 0.6701920E+01 Qxc -0.3818526E+01 3,-1 137 3 -1 -3.207553 2.219217 -2.288424 Rho 0.2246813E+00 |GRAD(Rho)| 0.3894222E-15 GRAD(Rho)x -0.3324706E-15 GRAD(Rho)y 0.1722255E-15 GRAD(Rho)z -0.1070108E-15 Laplacian 0.8385947E+00 (-1/4)Del**2(Rho)) -0.2096487E+00 Diamond 0.2731020E+01 Metallicity 0.6823481E+01 Ellipticity 0.5763152E-02 Gb(Abramov) 0.3781881E+00 Vb(Abramov) -0.5467275E+00 Hb(Abramov) -0.1685394E+00 Ex_ueg -0.1008806E+00 Ec_ueg -0.1338661E-01 Delta_ex -0.9954557E-01 Delta_ec 0.1879662E-01 Delta_et -0.2592725E+00 Pxc 0.7535935E+01 Qxc -0.5295930E+01 3,-1 138 3 -1 -2.130611 -2.961132 -1.665935 Rho 0.2279120E+00 |GRAD(Rho)| 0.2535085E-13 GRAD(Rho)x -0.9892288E-14 GRAD(Rho)y -0.1862171E-13 GRAD(Rho)z 0.1407266E-13 Laplacian 0.8687618E+00 (-1/4)Del**2(Rho)) -0.2171905E+00 Diamond 0.2867342E+01 Metallicity 0.6745141E+01 Ellipticity 0.7449285E-02 Gb(Abramov) 0.3889570E+00 Vb(Abramov) -0.5607235E+00 Hb(Abramov) -0.1717665E+00 Ex_ueg -0.1028193E+00 Ec_ueg -0.1360751E-01 Delta_ex -0.1034471E+00 Delta_ec 0.1928119E-01 Delta_et -0.2656745E+00 Pxc 0.7556071E+01 Qxc -0.5365183E+01 3,-1 139 3 -1 -2.108815 -2.938260 1.672262 Rho 0.2279065E+00 |GRAD(Rho)| 0.2572144E-10 GRAD(Rho)x 0.9677614E-11 GRAD(Rho)y -0.2382969E-10 GRAD(Rho)z 0.2869543E-12 Laplacian 0.8747469E+00 (-1/4)Del**2(Rho)) -0.2186867E+00 Diamond 0.2879273E+01 Metallicity 0.6698721E+01 Ellipticity 0.9333547E-02 Gb(Abramov) 0.3899447E+00 Vb(Abramov) -0.5612027E+00 Hb(Abramov) -0.1712580E+00 Ex_ueg -0.1028160E+00 Ec_ueg -0.1360713E-01 Delta_ex -0.1041150E+00 Delta_ec 0.1933537E-01 Delta_et -0.2660916E+00 Pxc 0.7556037E+01 Qxc -0.5384692E+01 3,-1 140 3 -1 -1.983581 2.724593 -1.503537 Rho 0.1106226E+00 |GRAD(Rho)| 0.2137547E-15 GRAD(Rho)x 0.1243377E-15 GRAD(Rho)y 0.1724966E-15 GRAD(Rho)z 0.2182126E-16 Laplacian 0.4375626E+00 (-1/4)Del**2(Rho)) -0.1093907E+00 Diamond 0.6136224E+00 Metallicity 0.4014634E+01 Ellipticity 0.1579619E-01 Gb(Abramov) 0.1461210E+00 Vb(Abramov) -0.1828514E+00 Hb(Abramov) -0.3673035E-01 Ex_ueg -0.3922023E-01 Ec_ueg -0.5972905E-02 Delta_ex -0.4364795E-01 Delta_ec 0.1190198E-01 Delta_et -0.1507037E+00 Pxc 0.6566357E+01 Qxc -0.3667285E+01 3,-1 141 3 -1 -0.857631 3.537737 -0.704563 Rho 0.1553530E+00 |GRAD(Rho)| 0.5828302E-14 GRAD(Rho)x -0.4996546E-15 GRAD(Rho)y -0.5620120E-14 GRAD(Rho)z 0.1460718E-14 Laplacian 0.6082196E+00 (-1/4)Del**2(Rho)) -0.1520549E+00 Diamond 0.1286812E+01 Metallicity 0.5086497E+01 Ellipticity 0.5217220E-01 Gb(Abramov) 0.2302744E+00 Vb(Abramov) -0.3084939E+00 Hb(Abramov) -0.7821950E-01 Ex_ueg -0.6168003E-01 Ec_ueg -0.8787058E-02 Delta_ex -0.6589556E-01 Delta_ec 0.1531842E-01 Delta_et -0.2049446E+00 Pxc 0.7019417E+01 Qxc -0.4301722E+01 3,-1 142 3 -1 -0.845964 3.526875 0.729452 Rho 0.1497107E+00 |GRAD(Rho)| 0.5246205E-14 GRAD(Rho)x 0.3746515E-14 GRAD(Rho)y 0.7155108E-15 GRAD(Rho)z -0.3601991E-14 Laplacian 0.5853623E+00 (-1/4)Del**2(Rho)) -0.1463406E+00 Diamond 0.1186658E+01 Metallicity 0.4969086E+01 Ellipticity 0.4449102E-01 Gb(Abramov) 0.2187569E+00 Vb(Abramov) -0.2911732E+00 Hb(Abramov) -0.7241629E-01 Ex_ueg -0.5871137E-01 Ec_ueg -0.8424998E-02 Delta_ex -0.6286422E-01 Delta_ec 0.1491561E-01 Delta_et -0.1986329E+00 Pxc 0.6968710E+01 Qxc -0.4214659E+01 3,-1 143 3 +3 -1.933999 2.779130 0.005844 Rho 0.1268050E-01 |GRAD(Rho)| 0.1101698E-13 GRAD(Rho)x -0.6055091E-14 GRAD(Rho)y 0.9203601E-14 GRAD(Rho)z 0.5881238E-16 Laplacian 0.5744574E-01 (-1/4)Del**2(Rho)) -0.1436144E-01 Diamond 0.1539266E-02 Metallicity 0.8271467E+00 Ellipticity -0.9026166E+00 Gb(Abramov) 0.1155413E-01 Vb(Abramov) -0.8746817E-02 Hb(Abramov) 0.2807309E-02 Ex_ueg -0.2183904E-02 Ec_ueg -0.4910736E-03 Delta_ex -0.2611854E-02 Delta_ec 0.2933444E-03 Delta_et -0.2566426E-02 Pxc 0.4447202E+01 Qxc -0.8903710E+01 3,+3 144 3 -1 0.548716 3.209949 -0.678091 Rho 0.1475789E+00 |GRAD(Rho)| 0.4527467E-13 GRAD(Rho)x 0.2359956E-13 GRAD(Rho)y -0.3851697E-13 GRAD(Rho)z -0.3049495E-14 Laplacian 0.6181855E+00 (-1/4)Del**2(Rho)) -0.1545464E+00 Diamond 0.1230807E+01 Metallicity 0.4594112E+01 Ellipticity 0.1655772E-01 Gb(Abramov) 0.2213648E+00 Vb(Abramov) -0.2881832E+00 Hb(Abramov) -0.6681843E-01 Ex_ueg -0.5759934E-01 Ec_ueg -0.8288711E-02 Delta_ex -0.6614599E-01 Delta_ec 0.1578998E-01 Delta_et -0.2098100E+00 Pxc 0.6949131E+01 Qxc -0.4189111E+01 3,-1 145 3 -1 -0.215860 -3.381080 1.603050 Rho 0.4953258E-02 |GRAD(Rho)| 0.7208630E-17 GRAD(Rho)x -0.7177517E-17 GRAD(Rho)y -0.6505894E-18 GRAD(Rho)z -0.1560242E-18 Laplacian 0.1891936E-01 (-1/4)Del**2(Rho)) -0.4729840E-02 Diamond 0.6618684E-03 Metallicity 0.5242338E+00 Ellipticity 0.1569769E+00 Gb(Abramov) 0.3566483E-02 Vb(Abramov) -0.2403127E-02 Hb(Abramov) 0.1163356E-02 Ex_ueg -0.6236004E-03 Ec_ueg -0.1449019E-03 Delta_ex -0.1151641E-02 Delta_ec 0.9754965E-03 Delta_et -0.5129155E-02 Pxc 0.4303605E+01 Qxc -0.1180569E+01 3,-1 146 3 -1 1.468391 -3.085177 0.002796 Rho 0.7382284E-02 |GRAD(Rho)| 0.4083307E-16 GRAD(Rho)x 0.2062223E-16 GRAD(Rho)y 0.2692748E-16 GRAD(Rho)z 0.2273707E-16 Laplacian 0.2996963E-01 (-1/4)Del**2(Rho)) -0.7492407E-02 Diamond 0.1522374E-02 Metallicity 0.6435511E+00 Ellipticity 0.6053314E+00 Gb(Abramov) 0.5798563E-02 Vb(Abramov) -0.4104718E-02 Hb(Abramov) 0.1693845E-02 Ex_ueg -0.1061629E-02 Ec_ueg -0.2508301E-03 Delta_ex -0.1798571E-02 Delta_ec 0.1280490E-02 Delta_et -0.7686262E-02 Pxc 0.4232463E+01 Qxc -0.1404597E+01 3,-1 147 3 -1 1.978791 -1.527612 2.713204 Rho 0.1267308E+00 |GRAD(Rho)| 0.2688889E-12 GRAD(Rho)x 0.7527804E-13 GRAD(Rho)y 0.2058836E-12 GRAD(Rho)z 0.1557124E-12 Laplacian 0.4865921E+00 (-1/4)Del**2(Rho)) -0.1216480E+00 Diamond 0.8173049E+00 Metallicity 0.4528125E+01 Ellipticity 0.2945376E-01 Gb(Abramov) 0.1729049E+00 Vb(Abramov) -0.2241618E+00 Hb(Abramov) -0.5125690E-01 Ex_ueg -0.4701408E-01 Ec_ueg -0.6971044E-02 Delta_ex -0.5030747E-01 Delta_ec 0.1312866E-01 Delta_et -0.1707985E+00 Pxc 0.6744195E+01 Qxc -0.3831882E+01 3,-1 148 3 +1 1.154428 -0.648359 -2.484421 Rho 0.2771220E-01 |GRAD(Rho)| 0.3307703E-16 GRAD(Rho)x 0.1534607E-17 GRAD(Rho)y -0.1131013E-16 GRAD(Rho)z -0.3104539E-16 Laplacian 0.1041812E+00 (-1/4)Del**2(Rho)) -0.2604531E-01 Diamond 0.1495742E-01 Metallicity 0.1678580E+01 Ellipticity -0.4085831E+01 Gb(Abramov) 0.2465006E-01 Vb(Abramov) -0.2325481E-01 Hb(Abramov) 0.1395246E-02 Ex_ueg -0.6193647E-02 Ec_ueg -0.1226215E-02 Delta_ex -0.6590321E-02 Delta_ec 0.1641971E-02 Delta_et -0.1488007E-01 Pxc 0.5051027E+01 Qxc -0.4013665E+01 3,+1 149 3 -1 1.679141 -0.941945 -1.577120 Rho 0.4899099E-01 |GRAD(Rho)| 0.5110217E-12 GRAD(Rho)x 0.3337526E-12 GRAD(Rho)y -0.3680830E-12 GRAD(Rho)z -0.1194458E-12 Laplacian 0.1812758E+00 (-1/4)Del**2(Rho)) -0.4531894E-01 Diamond 0.8751245E-01 Metallicity 0.2493449E+01 Ellipticity 0.2356001E-01 Gb(Abramov) 0.4904604E-01 Vb(Abramov) -0.5277314E-01 Hb(Abramov) -0.3727098E-02 Ex_ueg -0.1323955E-01 Ec_ueg -0.2359176E-02 Delta_ex -0.1476213E-01 Delta_ec 0.5254307E-02 Delta_et -0.5507150E-01 Pxc 0.5611940E+01 Qxc -0.2809529E+01 3,-1 150 3 -1 0.541133 3.205638 0.698679 Rho 0.1416817E+00 |GRAD(Rho)| 0.9914538E-13 GRAD(Rho)x -0.1645903E-13 GRAD(Rho)y 0.5815118E-14 GRAD(Rho)z 0.9759657E-13 Laplacian 0.5914586E+00 (-1/4)Del**2(Rho)) -0.1478647E+00 Diamond 0.1123308E+01 Metallicity 0.4486196E+01 Ellipticity 0.1332045E-01 Gb(Abramov) 0.2091347E+00 Vb(Abramov) -0.2704048E+00 Hb(Abramov) -0.6127009E-01 Ex_ueg -0.5455107E-01 Ec_ueg -0.7913166E-02 Delta_ex -0.6267996E-01 Delta_ec 0.1529786E-01 Delta_et -0.2021462E+00 Pxc 0.6893710E+01 Qxc -0.4097302E+01 3,-1 151 3 -1 1.871414 -2.531958 1.664409 Rho 0.2333714E+00 |GRAD(Rho)| 0.3275528E-15 GRAD(Rho)x -0.9763241E-16 GRAD(Rho)y -0.2683400E-15 GRAD(Rho)z 0.1604755E-15 Laplacian 0.8994430E+00 (-1/4)Del**2(Rho)) -0.2248607E+00 Diamond 0.3047376E+01 Metallicity 0.6777229E+01 Ellipticity 0.9838488E-02 Gb(Abramov) 0.4038960E+00 Vb(Abramov) -0.5829312E+00 Hb(Abramov) -0.1790352E+00 Ex_ueg -0.1061162E+00 Ec_ueg -0.1398210E-01 Delta_ex -0.1077241E+00 Delta_ec 0.1975525E-01 Delta_et -0.2721674E+00 Pxc 0.7589435E+01 Qxc -0.5452933E+01 3,-1 152 3 -1 2.023875 -1.553352 -2.744593 Rho 0.1463566E+00 |GRAD(Rho)| 0.2097111E-15 GRAD(Rho)x 0.9194034E-16 GRAD(Rho)y 0.1278342E-15 GRAD(Rho)z 0.1385068E-15 Laplacian 0.5571387E+00 (-1/4)Del**2(Rho)) -0.1392847E+00 Diamond 0.1108912E+01 Metallicity 0.5027327E+01 Ellipticity 0.2310842E-01 Gb(Abramov) 0.2095614E+00 Vb(Abramov) -0.2798381E+00 Hb(Abramov) -0.7027671E-01 Ex_ueg -0.5696414E-01 Ec_ueg -0.8210695E-02 Delta_ex -0.5960250E-01 Delta_ec 0.1445611E-01 Delta_et -0.1922929E+00 Pxc 0.6937798E+01 Qxc -0.4122996E+01 3,-1 153 3 -1 2.804605 1.703961 0.873876 Rho 0.1503142E+00 |GRAD(Rho)| 0.7709569E-13 GRAD(Rho)x -0.5896080E-13 GRAD(Rho)y 0.4208233E-13 GRAD(Rho)z 0.2639029E-13 Laplacian 0.6285232E+00 (-1/4)Del**2(Rho)) -0.1571308E+00 Diamond 0.1279581E+01 Metallicity 0.4658992E+01 Ellipticity 0.1769032E-01 Gb(Abramov) 0.2267657E+00 Vb(Abramov) -0.2964007E+00 Hb(Abramov) -0.6963494E-01 Ex_ueg -0.5902716E-01 Ec_ueg -0.8463632E-02 Delta_ex -0.6755876E-01 Delta_ec 0.1598620E-01 Delta_et -0.2129795E+00 Pxc 0.6974211E+01 Qxc -0.4226067E+01 3,-1 154 3 -1 -3.226038 -2.168549 -2.250468 Rho 0.2196395E+00 |GRAD(Rho)| 0.2777961E-15 GRAD(Rho)x -0.2145636E-15 GRAD(Rho)y 0.4782687E-16 GRAD(Rho)z 0.1698403E-15 Laplacian 0.8267203E+00 (-1/4)Del**2(Rho)) -0.2066801E+00 Diamond 0.2625548E+01 Metallicity 0.6664568E+01 Ellipticity 0.2077318E-01 Gb(Abramov) 0.3673589E+00 Vb(Abramov) -0.5280378E+00 Hb(Abramov) -0.1606789E+00 Ex_ueg -0.9787362E-01 Ec_ueg -0.1304302E-01 Delta_ex -0.9759492E-01 Delta_ec 0.1871257E-01 Delta_et -0.2580493E+00 Pxc 0.7503910E+01 Qxc -0.5215475E+01 3,-1 155 3 -1 -3.198579 -2.150418 2.268848 Rho 0.2201184E+00 |GRAD(Rho)| 0.5162527E-12 GRAD(Rho)x 0.3947652E-12 GRAD(Rho)y 0.4445894E-13 GRAD(Rho)z -0.3296979E-12 Laplacian 0.8329478E+00 (-1/4)Del**2(Rho)) -0.2082369E+00 Diamond 0.2649082E+01 Metallicity 0.6638795E+01 Ellipticity 0.2413854E-01 Gb(Abramov) 0.3692317E+00 Vb(Abramov) -0.5302264E+00 Hb(Abramov) -0.1609947E+00 Ex_ueg -0.9815825E-01 Ec_ueg -0.1307559E-01 Delta_ex -0.9836647E-01 Delta_ec 0.1880788E-01 Delta_et -0.2592611E+00 Pxc 0.7506983E+01 Qxc -0.5230067E+01 3,-1 156 3 -1 -2.764926 -0.931763 -1.621273 Rho 0.6457852E-01 |GRAD(Rho)| 0.3875083E-12 GRAD(Rho)x 0.2329704E-12 GRAD(Rho)y -0.2690665E-12 GRAD(Rho)z 0.1532666E-12 Laplacian 0.2647252E+00 (-1/4)Del**2(Rho)) -0.6618130E-01 Diamond 0.1921476E+00 Metallicity 0.2705814E+01 Ellipticity 0.6425908E-02 Gb(Abramov) 0.7396658E-01 Vb(Abramov) -0.8175187E-01 Hb(Abramov) -0.7785285E-02 Ex_ueg -0.1913532E-01 Ec_ueg -0.3235298E-02 Delta_ex -0.2331917E-01 Delta_ec 0.7988534E-02 Delta_et -0.8999050E-01 Pxc 0.5914548E+01 Qxc -0.2919079E+01 3,-1 157 3 -1 -0.567150 0.735044 -3.233242 Rho 0.1130786E+00 |GRAD(Rho)| 0.9993670E-14 GRAD(Rho)x 0.9701590E-14 GRAD(Rho)y 0.1725304E-14 GRAD(Rho)z -0.1666107E-14 Laplacian 0.4887182E+00 (-1/4)Del**2(Rho)) -0.1221795E+00 Diamond 0.7323595E+00 Metallicity 0.3728399E+01 Ellipticity 0.1175409E-01 Gb(Abramov) 0.1573754E+00 Vb(Abramov) -0.1925712E+00 Hb(Abramov) -0.3519583E-01 Ex_ueg -0.4038554E-01 Ec_ueg -0.6123903E-02 Delta_ex -0.4942043E-01 Delta_ec 0.1396924E-01 Delta_et -0.1787087E+00 Pxc 0.6594738E+01 Qxc -0.3537805E+01 3,-1 158 3 -1 0.924205 -0.709231 -3.531290 Rho 0.1205838E+00 |GRAD(Rho)| 0.2749884E-15 GRAD(Rho)x -0.1930557E-15 GRAD(Rho)y 0.1949667E-15 GRAD(Rho)z 0.1833360E-16 Laplacian 0.4970952E+00 (-1/4)Del**2(Rho)) -0.1242738E+00 Diamond 0.7981187E+00 Metallicity 0.4079955E+01 Ellipticity 0.3804075E-01 Gb(Abramov) 0.1673545E+00 Vb(Abramov) -0.2104351E+00 Hb(Abramov) -0.4308065E-01 Ex_ueg -0.4399843E-01 Ec_ueg -0.6588006E-02 Delta_ex -0.5094272E-01 Delta_ec 0.1384490E-01 Delta_et -0.1790148E+00 Pxc 0.6678565E+01 Qxc -0.3679530E+01 3,-1 159 3 -1 0.884544 -0.681633 3.497475 Rho 0.1448177E+00 |GRAD(Rho)| 0.2693652E-12 GRAD(Rho)x -0.2036521E-12 GRAD(Rho)y 0.1748035E-12 GRAD(Rho)z 0.2296130E-13 Laplacian 0.5729625E+00 (-1/4)Del**2(Rho)) -0.1432406E+00 Diamond 0.1113209E+01 Metallicity 0.4803114E+01 Ellipticity 0.6482506E-01 Gb(Abramov) 0.2101606E+00 Vb(Abramov) -0.2770805E+00 Hb(Abramov) -0.6691996E-01 Ex_ueg -0.5616690E-01 Ec_ueg -0.8112599E-02 Delta_ex -0.6100369E-01 Delta_ec 0.1466639E-01 Delta_et -0.1942702E+00 Pxc 0.6923416E+01 Qxc -0.4159421E+01 3,-1 160 3 -1 1.910493 -2.556284 -1.678345 Rho 0.2329956E+00 |GRAD(Rho)| 0.8718961E-13 GRAD(Rho)x -0.6322005E-13 GRAD(Rho)y -0.1086620E-13 GRAD(Rho)z 0.5905235E-13 Laplacian 0.8944458E+00 (-1/4)Del**2(Rho)) -0.2236114E+00 Diamond 0.3027548E+01 Metallicity 0.6796815E+01 Ellipticity 0.8180498E-02 Gb(Abramov) 0.4023819E+00 Vb(Abramov) -0.5811523E+00 Hb(Abramov) -0.1787704E+00 Ex_ueg -0.1058885E+00 Ec_ueg -0.1395627E-01 Delta_ex -0.1070970E+00 Delta_ec 0.1968422E-01 Delta_et -0.2713001E+00 Pxc 0.7587165E+01 Qxc -0.5440753E+01 3,-1 161 3 -1 3.027634 0.843748 2.019454 Rho 0.1807248E+00 |GRAD(Rho)| 0.3581207E-15 GRAD(Rho)x -0.2969630E-15 GRAD(Rho)y 0.1991137E-15 GRAD(Rho)z -0.2042366E-16 Laplacian 0.7045227E+00 (-1/4)Del**2(Rho)) -0.1761307E+00 Diamond 0.1778424E+01 Metallicity 0.5650427E+01 Ellipticity 0.4973745E-01 Gb(Abramov) 0.2832894E+00 Vb(Abramov) -0.3904481E+00 Hb(Abramov) -0.1071587E+00 Ex_ueg -0.7546442E-01 Ec_ueg -0.1043858E-01 Delta_ex -0.7919240E-01 Delta_ec 0.1694120E-01 Delta_et -0.2304073E+00 Pxc 0.7229379E+01 Qxc -0.4674546E+01 3,-1 162 3 -1 2.803965 1.703407 -0.885955 Rho 0.1289962E+00 |GRAD(Rho)| 0.2865893E-15 GRAD(Rho)x -0.8204022E-16 GRAD(Rho)y 0.1603772E-16 GRAD(Rho)z 0.2741270E-15 Laplacian 0.5429037E+00 (-1/4)Del**2(Rho)) -0.1357259E+00 Diamond 0.9243841E+00 Metallicity 0.4180086E+01 Ellipticity 0.1062676E-01 Gb(Abramov) 0.1850416E+00 Vb(Abramov) -0.2343574E+00 Hb(Abramov) -0.4931571E-01 Ex_ueg -0.4813796E-01 Ec_ueg -0.7112856E-02 Delta_ex -0.5628117E-01 Delta_ec 0.1443194E-01 Delta_et -0.1880372E+00 Pxc 0.6767740E+01 Qxc -0.3899764E+01 3,-1 163 3 -1 -2.791868 0.897970 1.633484 Rho 0.1936989E+00 |GRAD(Rho)| 0.4498208E-15 GRAD(Rho)x -0.7781861E-16 GRAD(Rho)y -0.4430050E-15 GRAD(Rho)z 0.5441340E-17 Laplacian 0.7913925E+00 (-1/4)Del**2(Rho)) -0.1978481E+00 Diamond 0.2146208E+01 Metallicity 0.5646335E+01 Ellipticity 0.2475561E-01 Gb(Abramov) 0.3180849E+00 Vb(Abramov) -0.4383216E+00 Hb(Abramov) -0.1202368E+00 Ex_ueg -0.8277288E-01 Ec_ueg -0.1129746E-01 Delta_ex -0.9035533E-01 Delta_ec 0.1836421E-01 Delta_et -0.2503670E+00 Pxc 0.7326681E+01 Qxc -0.4920187E+01 3,-1 164 3 -1 0.521295 -0.046518 -2.398316 Rho 0.5184807E-01 |GRAD(Rho)| 0.3027850E-13 GRAD(Rho)x -0.1208716E-13 GRAD(Rho)y 0.2100505E-14 GRAD(Rho)z -0.2768169E-13 Laplacian 0.2115236E+00 (-1/4)Del**2(Rho)) -0.5288089E-01 Diamond 0.1177095E+00 Metallicity 0.2348598E+01 Ellipticity 0.9885866E-02 Gb(Abramov) 0.5595325E-01 Vb(Abramov) -0.5902562E-01 Hb(Abramov) -0.3072366E-02 Ex_ueg -0.1427891E-01 Ec_ueg -0.2517280E-02 Delta_ex -0.1777883E-01 Delta_ec 0.6671749E-02 Delta_et -0.7113749E-01 Pxc 0.5672358E+01 Qxc -0.2664792E+01 3,-1 165 3 -1 -0.048672 -0.015463 -4.509535 Rho 0.2053839E+00 |GRAD(Rho)| 0.3604925E-14 GRAD(Rho)x 0.3082820E-14 GRAD(Rho)y -0.6383571E-15 GRAD(Rho)z 0.1756191E-14 Laplacian 0.7904406E+00 (-1/4)Del**2(Rho)) -0.1976101E+00 Diamond 0.2311572E+01 Metallicity 0.6232869E+01 Ellipticity 0.2264743E-02 Gb(Abramov) 0.3370198E+00 Vb(Abramov) -0.4764294E+00 Hb(Abramov) -0.1394096E+00 Ex_ueg -0.8949669E-01 Ec_ueg -0.1207912E-01 Delta_ex -0.9168612E-01 Delta_ec 0.1818365E-01 Delta_et -0.2494980E+00 Pxc 0.7409208E+01 Qxc -0.5042227E+01 3,-1 166 3 -1 -0.434048 0.511388 -0.012836 Rho 0.1326253E+00 |GRAD(Rho)| 0.2404744E-13 GRAD(Rho)x 0.1275025E-13 GRAD(Rho)y -0.1832147E-13 GRAD(Rho)z 0.8946198E-14 Laplacian 0.6704035E+00 (-1/4)Del**2(Rho)) -0.1676009E+00 Diamond 0.1401108E+01 Metallicity 0.3545312E+01 Ellipticity 0.5151252E-02 Gb(Abramov) 0.2107668E+00 Vb(Abramov) -0.2539327E+00 Hb(Abramov) -0.4316593E-01 Ex_ueg -0.4995210E-01 Ec_ueg -0.7340744E-02 Delta_ex -0.7255791E-01 Delta_ec 0.2233422E-01 Delta_et -0.3011285E+00 Pxc 0.6804773E+01 Qxc -0.3248733E+01 3,-1 167 3 -1 3.047370 0.849901 -2.016518 Rho 0.1848813E+00 |GRAD(Rho)| 0.1518257E-08 GRAD(Rho)x -0.7262674E-09 GRAD(Rho)y 0.1322459E-08 GRAD(Rho)z 0.1695328E-09 Laplacian 0.7169022E+00 (-1/4)Del**2(Rho)) -0.1792255E+00 Diamond 0.1861771E+01 Metallicity 0.5767332E+01 Ellipticity 0.4949620E-01 Gb(Abramov) 0.2917592E+00 Vb(Abramov) -0.4042929E+00 Hb(Abramov) -0.1125337E+00 Ex_ueg -0.7778736E-01 Ec_ueg -0.1071269E-01 Delta_ex -0.8106286E-01 Delta_ec 0.1716197E-01 Delta_et -0.2340254E+00 Pxc 0.7261235E+01 Qxc -0.4723402E+01 3,-1 168 3 -1 -2.986756 -2.129042 -0.770908 Rho 0.1301532E+00 |GRAD(Rho)| 0.1106399E-14 GRAD(Rho)x 0.1736079E-16 GRAD(Rho)y -0.1098221E-14 GRAD(Rho)z 0.1331536E-15 Laplacian 0.4997010E+00 (-1/4)Del**2(Rho)) -0.1249253E+00 Diamond 0.8679800E+00 Metallicity 0.4609574E+01 Ellipticity 0.4558126E-01 Gb(Abramov) 0.1792589E+00 Vb(Abramov) -0.2335925E+00 Hb(Abramov) -0.5433362E-01 Ex_ueg -0.4871448E-01 Ec_ueg -0.7185411E-02 Delta_ex -0.5200984E-01 Delta_ec 0.1342679E-01 Delta_et -0.1755155E+00 Pxc 0.6779636E+01 Qxc -0.3873588E+01 3,-1 169 3 -1 -2.990226 -2.123418 0.779785 Rho 0.1472705E+00 |GRAD(Rho)| 0.3286779E-13 GRAD(Rho)x 0.1832307E-13 GRAD(Rho)y -0.2350357E-13 GRAD(Rho)z 0.1386142E-13 Laplacian 0.5578354E+00 (-1/4)Del**2(Rho)) -0.1394588E+00 Diamond 0.1126817E+01 Metallicity 0.5073411E+01 Ellipticity 0.5439076E-01 Gb(Abramov) 0.2108946E+00 Vb(Abramov) -0.2823303E+00 Hb(Abramov) -0.7143573E-01 Ex_ueg -0.5743889E-01 Ec_ueg -0.8269016E-02 Delta_ex -0.5985140E-01 Delta_ec 0.1460131E-01 Delta_et -0.1947313E+00 Pxc 0.6946279E+01 Qxc -0.4099042E+01 3,-1 170 3 -1 0.078674 4.496386 0.009243 Rho 0.2274562E+00 |GRAD(Rho)| 0.1784046E-14 GRAD(Rho)x 0.3822084E-15 GRAD(Rho)y 0.1742530E-14 GRAD(Rho)z 0.1807822E-16 Laplacian 0.8514566E+00 (-1/4)Del**2(Rho)) -0.2128642E+00 Diamond 0.2815425E+01 Metallicity 0.6859308E+01 Ellipticity 0.1117614E-02 Gb(Abramov) 0.3852596E+00 Vb(Abramov) -0.5576550E+00 Hb(Abramov) -0.1723954E+00 Ex_ueg -0.1025452E+00 Ec_ueg -0.1357631E-01 Delta_ex -0.1014021E+00 Delta_ec 0.1903022E-01 Delta_et -0.2627022E+00 Pxc 0.7553248E+01 Qxc -0.5328479E+01 3,-1 171 3 -1 1.809236 2.342539 -1.567873 Rho 0.1278062E+00 |GRAD(Rho)| 0.1494660E-12 GRAD(Rho)x 0.1138540E-12 GRAD(Rho)y -0.7758013E-13 GRAD(Rho)z -0.5795395E-13 Laplacian 0.5387780E+00 (-1/4)Del**2(Rho)) -0.1346945E+00 Diamond 0.9027696E+00 Metallicity 0.4147534E+01 Ellipticity 0.9919178E-02 Gb(Abramov) 0.1829047E+00 Vb(Abramov) -0.2311149E+00 Hb(Abramov) -0.4821017E-01 Ex_ueg -0.4754678E-01 Ec_ueg -0.7038322E-02 Delta_ex -0.5567467E-01 Delta_ec 0.1425622E-01 Delta_et -0.1852864E+00 Pxc 0.6755414E+01 Qxc -0.3905289E+01 3,-1 172 3 -1 1.801027 2.339862 1.567922 Rho 0.1347207E+00 |GRAD(Rho)| 0.3005015E-15 GRAD(Rho)x -0.2636644E-15 GRAD(Rho)y 0.1334111E-15 GRAD(Rho)z -0.5462346E-16 Laplacian 0.5684488E+00 (-1/4)Del**2(Rho)) -0.1421122E+00 Diamond 0.1012537E+01 Metallicity 0.4291860E+01 Ellipticity 0.8930235E-02 Gb(Abramov) 0.1963957E+00 Vb(Abramov) -0.2506793E+00 Hb(Abramov) -0.5428354E-01 Ex_ueg -0.5100711E-01 Ec_ueg -0.7472713E-02 Delta_ex -0.5946680E-01 Delta_ec 0.1480791E-01 Delta_et -0.1940131E+00 Pxc 0.6825782E+01 Qxc -0.4015880E+01 3,-1 173 3 -1 0.342175 -0.081913 -0.560665 Rho 0.1362747E+00 |GRAD(Rho)| 0.2258238E-16 GRAD(Rho)x -0.2032313E-16 GRAD(Rho)y 0.4307296E-17 GRAD(Rho)z 0.8853334E-17 Laplacian 0.7016276E+00 (-1/4)Del**2(Rho)) -0.1754069E+00 Diamond 0.1519394E+01 Metallicity 0.3544314E+01 Ellipticity 0.5966041E-02 Gb(Abramov) 0.2205541E+00 Vb(Abramov) -0.2657013E+00 Hb(Abramov) -0.4514721E-01 Ex_ueg -0.5179314E-01 Ec_ueg -0.7570776E-02 Delta_ex -0.7645959E-01 Delta_ec 0.2332618E-01 Delta_et -0.3163730E+00 Pxc 0.6841192E+01 Qxc -0.3277845E+01 3,-1 174 3 -1 0.333522 -0.077350 0.545725 Rho 0.1337160E+00 |GRAD(Rho)| 0.6942287E-16 GRAD(Rho)x -0.6544194E-16 GRAD(Rho)y -0.2480621E-17 GRAD(Rho)z -0.2303766E-16 Laplacian 0.6789637E+00 (-1/4)Del**2(Rho)) -0.1697409E+00 Diamond 0.1438724E+01 Metallicity 0.3548722E+01 Ellipticity 0.4826858E-02 Gb(Abramov) 0.2135545E+00 Vb(Abramov) -0.2573681E+00 Hb(Abramov) -0.4381358E-01 Ex_ueg -0.5050054E-01 Ec_ueg -0.7409398E-02 Delta_ex -0.7368787E-01 Delta_ec 0.2269727E-01 Delta_et -0.3067130E+00 Pxc 0.6815741E+01 Qxc -0.3246552E+01 3,-1 175 3 -1 2.993803 -0.800453 -1.995359 Rho 0.7567616E-01 |GRAD(Rho)| 0.2085804E-15 GRAD(Rho)x 0.1271634E-15 GRAD(Rho)y 0.1597470E-15 GRAD(Rho)z -0.4261635E-16 Laplacian 0.3025843E+00 (-1/4)Del**2(Rho)) -0.7564608E-01 Diamond 0.2653391E+00 Metallicity 0.3083414E+01 Ellipticity 0.6096764E-02 Gb(Abramov) 0.8930542E-01 Vb(Abramov) -0.1029648E+00 Hb(Abramov) -0.1365934E-01 Ex_ueg -0.2364089E-01 Ec_ueg -0.3876937E-02 Delta_ex -0.2758680E-01 Delta_ec 0.8804371E-02 Delta_et -0.1029166E+00 Pxc 0.6097827E+01 Qxc -0.3133308E+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 76 129 120 118 125 159 121 174 77 173 166 164 117 157 158 126 165 122 150 144 142 141 170 88 135 151 127 147 133 98 162 171 167 128 99 52 104 72 136 140 137 112 102 113 169 139 155 111 156 110 168 138 154 107 163 56 105 55 106 97 153 172 161 130 100 149 134 160 175 152 131 82 146 103 119 123 145 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 18 21 21 22 25 28 13 24 26 33 39 41 13 14 15 16 15 23 25 34 40 43 16 22 27 35 38 44 13 18 28 29 39 45 15 20 27 31 40 46 16 19 25 32 38 47 14 17 26 30 37 48 14 19 23 30 36 49 16 17 24 32 35 50 13 20 22 29 33 51 15 18 21 31 34 42 20 28 36 24 27 37 2.317480 1.922526 1.912238 1.951923 1.938943 1.760655 1.669699 1.648595 1.661881 1.673144 2.360140 1.984800 2.019624 2.004776 2.031704 1.802726 2.373702 1.937121 1.920642 1.927060 1.912333 1.763360 2.384463 1.917876 1.753852 2.181249 1.993390 1.773286 2.504198 1.971910 1.977291 1.844290 1.906936 1.760328 2.383466 1.811869 1.890232 2.004443 2.047877 1.768350 2.258148 2.216694 1.971429 1.934682 1.762128 1.776366 2.266137 2.253635 1.912485 1.982922 1.762167 1.777382 2.385476 1.818078 1.965187 1.925778 2.020451 1.766291 2.500532 1.912257 1.956784 1.853263 1.968171 1.759840 2.391862 1.963308 1.754446 2.201104 1.936902 1.773589 3.253474 3.039912 3.314640 3.165265 3.238360 3.219028 2.318144 1.923005 1.912659 1.952436 1.939466 1.760667 1.669720 1.648646 1.661902 1.673148 2.361024 1.985044 2.019921 2.005110 2.031976 1.802737 2.374476 1.937485 1.921080 1.927535 1.912788 1.763374 2.385199 1.918251 1.753880 2.181668 1.993902 1.773303 2.504752 1.972304 1.977702 1.844639 1.907351 1.760343 2.384009 1.812229 1.890474 2.004933 2.048320 1.768363 2.259132 2.217017 1.971827 1.935145 1.762143 1.776388 2.266984 2.253947 1.912817 1.983453 1.762178 1.777406 2.386081 1.818450 1.965500 1.926239 2.020904 1.766308 2.501063 1.912700 1.957213 1.853629 1.968666 1.759851 2.392652 1.963681 1.754464 2.201540 1.937329 1.773607 3.256979 3.050544 3.316852 3.167683 3.243603 3.220848 27 26 27 25 25 25 22 23 22 21 27 26 25 25 24 25 32 23 28 28 24 23 29 23 22 25 26 23 29 23 23 23 24 23 27 25 26 24 24 22 27 25 25 23 22 23 27 26 26 23 22 23 27 23 25 26 26 23 29 25 25 23 25 23 29 23 22 25 23 23 35 33 35 33 35 35 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 W Si Ta W W W W W W W W W O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O 2.4247 2.3881 2.1813 2.4349 2.3172 2.3909 2.3860 2.3569 2.3476 2.3931 2.3983 2.3120 -1.1605 -1.1136 -1.1552 -1.1554 -0.9227 -0.9958 -0.9161 -0.9782 -0.8003 -0.9729 -1.0092 -0.9709 -0.9873 -0.9846 -0.9741 -0.7926 -0.9738 -1.0235 -0.9665 -1.0060 -0.9955 -1.0292 -1.0014 -0.8491 -0.8431 -1.0006 -1.0046 -1.0069 -0.8552 -0.8938 -0.9559 -0.8688 -0.8912 -0.8655 -0.8832 -0.8904 -0.8985 -0.8754 -0.8637 2.1103 2.3296 2.1223 2.1019 2.1422 2.1186 2.1173 2.1460 2.1518 2.1118 2.1114 2.1491 1.8985 1.8984 1.8970 1.8959 1.9415 1.9294 1.9430 1.9289 1.9616 1.9291 1.9256 1.9293 1.9287 1.9286 1.9291 1.9630 1.9410 1.9362 1.9416 1.9365 1.9357 1.9333 1.9362 1.9500 1.9501 1.9368 1.9365 1.9342 1.9545 1.9490 1.9381 1.9513 1.9491 1.9535 1.9513 1.9475 1.9471 1.9516 1.9537 6.1039 6.7050 6.0911 6.0933 6.1207 6.1090 6.1069 6.1009 6.1048 6.1035 6.1060 6.1229 5.2341 5.1887 5.2315 5.2311 4.9504 5.0368 4.9422 5.0199 4.8044 5.0150 5.0567 5.0121 5.0307 5.0268 5.0164 4.7951 5.0034 5.0556 4.9952 5.0386 5.0290 5.0672 5.0358 4.8677 4.8615 5.0346 5.0375 5.0434 4.8689 4.9149 4.9925 4.8861 4.9122 4.8801 4.9013 4.9133 4.9221 4.8929 4.8780 3.3307 0.5774 2.5698 3.3394 3.3910 3.3516 3.3598 3.3670 3.3667 3.3613 3.3543 3.3873 0.0279 0.0265 0.0267 0.0283 0.0307 0.0296 0.0308 0.0294 0.0343 0.0288 0.0269 0.0295 0.0280 0.0292 0.0286 0.0346 0.0294 0.0317 0.0297 0.0309 0.0308 0.0288 0.0294 0.0314 0.0314 0.0293 0.0305 0.0294 0.0318 0.0299 0.0253 0.0313 0.0300 0.0318 0.0306 0.0296 0.0294 0.0309 0.0319 14.0305 0.0000 14.0355 14.0304 14.0290 14.0299 14.0300 14.0292 14.0291 14.0302 14.0300 14.0288 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 W Si Ta W W W W W W W W W O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O 2.514124 1.779719 2.375326 2.507138 2.467023 2.494495 2.484655 2.497200 2.491753 2.490662 2.495967 2.466520 -1.058185 -1.018579 -1.063205 -1.064456 -0.959776 -0.998280 -0.960288 -0.989675 -0.868674 -0.994491 -1.017929 -0.988522 -1.011336 -0.984624 -0.995110 -0.860291 -0.993335 -1.001959 -0.990461 -1.004211 -0.995826 -1.030944 -1.006461 -0.905463 -0.900023 -1.006306 -0.998451 -1.016027 -0.904162 -0.953519 -1.046312 -0.923458 -0.950711 -0.916849 -0.939620 -0.946466 -0.955033 -0.930859 -0.914707 1.928356 1.394953 1.846971 1.921548 1.931676 1.926333 1.916050 1.951314 1.950143 1.915578 1.919446 1.936296 -0.713324 -0.712071 -0.722848 -0.713830 -0.743822 -0.731013 -0.748188 -0.741521 -0.763437 -0.736181 -0.757411 -0.737984 -0.777220 -0.720614 -0.738059 -0.753107 -0.851729 -0.831060 -0.847466 -0.839671 -0.831409 -0.867470 -0.850905 -0.822035 -0.816295 -0.852658 -0.831607 -0.861941 -0.828908 -0.888179 -0.992483 -0.849933 -0.884327 -0.839219 -0.863486 -0.887563 -0.897870 -0.853993 -0.837826 2.032830 1.343108 1.954719 2.025895 2.022476 2.034842 2.022151 2.051715 2.052875 2.023280 2.030644 2.028990 -0.782787 -0.772413 -0.792429 -0.788487 -0.807951 -0.825738 -0.806161 -0.837330 -0.769865 -0.820031 -0.858581 -0.813935 -0.849698 -0.815475 -0.823767 -0.760012 -0.870889 -0.871182 -0.864799 -0.880166 -0.863003 -0.916242 -0.883777 -0.808063 -0.802951 -0.884989 -0.877227 -0.887168 -0.791897 -0.859827 -0.964715 -0.815411 -0.856017 -0.805178 -0.825802 -0.869404 -0.879651 -0.817239 -0.803271 2.62523027 0.56721499 5.56522496 6.17942519 -19.35368128 -1.50514919 -1.71373562 31.41193708 -0.63371683 -12.05825579 -374.2337 407.5437 16.3439 -420.2633 -96.8986 -467.5080 Apr20-2024 03:24:20 Nodes: 1 Procs: 1 Apr20-2024 03:24:20 Nodes: 1 Procs: 1 0 Apr20-2024 03:24:21 Nodes: 1 Procs: 1 Apr20-2024 03:24:22 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Apr20-2024 03:24:24 Nodes: 1 Procs: 1 Apr20-2024 03:24:24 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Apr20-2024 03:24:25 Nodes: 1 Procs: 1 Apr20-2024 03:24:26 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Apr20-2024 03:24:28 Nodes: 1 Procs: 24 *** (NO TITLE) *** -9 -16.62204821 -17.00700737 -17.00594777 -17.00505403 -17.10375231 -17.14871639 -17.16258499 -17.16681659 -17.16939231 -17.17601512 -17.17709178 -17.17775594 -17.17824057 -17.17995009 -17.18010378 -17.18037855 -17.18049747 -17.18053205 -17.18055217 -17.18057208 -17.18060217 GEOMETRY CONVERGED