ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 09:03:57 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.54 0.03 1.46 1 2 3 1 1.000 0.000 0.000 0.000 -6.493 2.471 41.409 11.031 S S S P S S P S 1 2 1 3 1.00 0.00 0.00 0.00 -6.4931 2.4706 11.0309 41.4090 1 H -0.0000 1.0000 0.0000 0.0000 0.0000 Jun20-2024 09:03:57 Nodes: 1 Procs: 1 Jun20-2024 09:03:59 Nodes: 1 Procs: 1 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 09:04:01 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.01 0.04 1.91 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 09:03:57 Nodes: 1 Procs: 1 Jun20-2024 09:03:59 Nodes: 1 Procs: 1 0 Jun20-2024 09:04:01 Nodes: 1 Procs: 1 Jun20-2024 09:04:03 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 09:04:05 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.81 0.04 2.13 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 09:03:57 Nodes: 1 Procs: 1 Jun20-2024 09:03:59 Nodes: 1 Procs: 1 0 Jun20-2024 09:04:01 Nodes: 1 Procs: 1 Jun20-2024 09:04:03 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 09:04:05 Nodes: 1 Procs: 1 Jun20-2024 09:04:07 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 09:04:11 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.69 0.03 1.00 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 09:03:57 Nodes: 1 Procs: 1 Jun20-2024 09:03:59 Nodes: 1 Procs: 1 0 Jun20-2024 09:04:01 Nodes: 1 Procs: 1 Jun20-2024 09:04:03 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 09:04:05 Nodes: 1 Procs: 1 Jun20-2024 09:04:07 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 09:04:11 Nodes: 1 Procs: 1 Jun20-2024 09:04:12 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 09:04:14 Hydrogen (TZP) c10-6 c10-6 c10-6 c10-6 c10-6 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.81 0.04 2.57 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 09:03:57 Nodes: 1 Procs: 1 Jun20-2024 09:03:59 Nodes: 1 Procs: 1 0 Jun20-2024 09:04:01 Nodes: 1 Procs: 1 Jun20-2024 09:04:03 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 09:04:05 Nodes: 1 Procs: 1 Jun20-2024 09:04:07 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 09:04:11 Nodes: 1 Procs: 1 Jun20-2024 09:04:12 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun20-2024 09:04:14 Nodes: 1 Procs: 1 Jun20-2024 09:04:16 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 09:04:21 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.W ADF 2019.304 Jun20-2024 09:04:16 1 1 Tungsten TZP 4d t21.As ADF 2019.304 Jun20-2024 09:04:03 1 1 Arsenic TZP 3p t21.Ta ADF 2019.304 Jun20-2024 09:04:07 1 1 Tantalum TZP 4d t21.O ADF 2019.304 Jun20-2024 09:04:12 1 1 Oxygen TZP 1s t21.H ADF 2019.304 Jun20-2024 09:03:59 1 1 Hydrogen TZP 1 1 -16.96117452 0.27441423 0.00100000 F 0.08688761 0.00066667 F 0.27441423 0.08688761 0.29190051 0.01000000 F 0.06547114 0.00666667 F Cartesian 2703.7856000000056 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0.3190672E+03 3,-3 15 3 -3 0.922597 0.913391 -1.046140 Rho 0.3190598E+03 3,-3 16 3 -3 -1.002150 0.979532 1.011623 Rho 0.3189648E+03 3,-3 17 3 -3 -3.028761 -1.193937 1.166298 Rho 0.3188695E+03 3,-3 18 3 -3 2.954719 -1.292414 -1.272459 Rho 0.3187604E+03 3,-3 19 3 -3 -3.020842 1.144512 -1.124949 Rho 0.3188818E+03 3,-3 20 3 -3 3.058336 1.173620 1.200588 Rho 0.3188408E+03 3,-3 21 3 -3 1.595241 -1.148908 -3.785528 Rho 0.3190706E+03 3,-3 22 3 -3 1.166733 1.096522 3.023604 Rho 0.3188607E+03 3,-3 23 3 -3 -1.159777 1.218210 -3.125764 Rho 0.3188474E+03 3,-3 24 3 -3 -1.141259 -1.163749 3.096275 Rho 0.3188545E+03 3,-3 25 3 -3 -1.090215 3.038437 -1.175947 Rho 0.3188624E+03 3,-3 26 3 -3 -1.183820 -3.030150 1.265869 Rho 0.3188614E+03 3,-3 27 3 -3 1.198954 3.006034 1.151403 Rho 0.3188473E+03 3,-3 28 3 -3 1.094082 -3.486896 -1.074606 Rho 0.3189896E+03 3,-3 29 3 -3 3.378837 -1.502652 1.559273 Rho 0.3189705E+03 3,-3 30 3 -3 -3.499336 -1.696348 -1.529224 Rho 0.3188856E+03 3,-3 31 3 -3 3.473394 1.577935 -1.395382 Rho 0.3190212E+03 3,-3 32 3 -3 -3.547175 1.552575 1.604494 Rho 0.3188355E+03 3,-3 33 3 -3 1.496414 -1.504426 3.482159 Rho 0.3188857E+03 3,-3 34 3 -3 1.554792 1.633379 -3.428913 Rho 0.3188786E+03 3,-3 35 3 -3 -1.548066 1.559084 3.580781 Rho 0.3188396E+03 3,-3 36 3 -3 -1.905333 -1.428473 -3.891197 Rho 0.3190437E+03 3,-3 37 3 -3 -1.510953 -3.678699 -1.232510 Rho 0.3186996E+03 3,-3 38 3 -3 -1.530351 3.512808 1.562774 Rho 0.3188512E+03 3,-3 39 3 -3 1.467708 -3.473797 1.683450 Rho 0.3189037E+03 3,-3 40 3 -3 1.537677 3.459162 -1.481530 Rho 0.3188953E+03 3,-3 41 3 -3 -0.258533 -3.743384 3.891776 Rho 0.3191532E+03 3,-3 42 3 -3 4.162666 0.017397 -3.696490 Rho 0.3189864E+03 3,-3 43 3 -3 -0.193032 3.819314 -3.749510 Rho 0.3191499E+03 3,-3 44 3 -3 0.299397 3.837462 3.840381 Rho 0.3190270E+03 3,-3 45 3 -3 3.801027 -3.894704 -0.159019 Rho 0.3189988E+03 3,-3 46 3 -3 3.775964 3.837289 0.252034 Rho 0.3191452E+03 3,-3 47 3 -3 -3.842588 3.831196 -0.273184 Rho 0.3190115E+03 3,-3 48 3 -3 -3.838207 -3.748998 0.311622 Rho 0.3191629E+03 3,-3 49 3 -3 -4.060233 0.357568 -3.651186 Rho 0.3190016E+03 3,-3 50 3 -3 -3.840222 -0.252647 3.885713 Rho 0.3190408E+03 3,-3 51 3 -3 3.775638 0.194973 3.788284 Rho 0.3191486E+03 3,-3 52 3 -3 -0.489464 -3.504002 -1.166865 Rho 0.3993390E+00 3,-3 53 3 -1 -0.586354 -0.516894 -0.499889 Rho 0.1865020E+00 |GRAD(Rho)| 0.1235922E-15 GRAD(Rho)x -0.9714451E-16 GRAD(Rho)y 0.3469447E-17 GRAD(Rho)z -0.7632783E-16 Laplacian 0.4938728E+00 (-1/4)Del**2(Rho)) -0.1234682E+00 Diamond 0.1308843E+01 Metallicity 0.8494484E+01 Ellipticity 0.2593462E-01 Gb(Abramov) 0.2571119E+00 Vb(Abramov) -0.3907556E+00 Hb(Abramov) -0.1336437E+00 Ex_ueg -0.7869786E-01 Ec_ueg -0.1081984E-01 Delta_ex -0.5606250E-01 Delta_ec 0.1196505E-01 Delta_et -0.1638315E+00 Pxc 0.7273478E+01 Qxc -0.4685521E+01 3,-1 54 3 -1 -1.813999 -1.742943 -0.526304 Rho 0.5631956E-01 |GRAD(Rho)| 0.1203864E-14 GRAD(Rho)x 0.5728187E-15 GRAD(Rho)y -0.3661020E-15 GRAD(Rho)z 0.9935472E-15 Laplacian 0.2217282E+00 (-1/4)Del**2(Rho)) -0.5543206E-01 Diamond 0.1319460E+00 Metallicity 0.2571723E+01 Ellipticity 0.1858525E-01 Gb(Abramov) 0.6071403E-01 Vb(Abramov) -0.6599599E-01 Hb(Abramov) -0.5281968E-02 Ex_ueg -0.1594400E-01 Ec_ueg -0.2767063E-02 Delta_ex -0.1880150E-01 Delta_ec 0.6587868E-02 Delta_et -0.7163382E-01 Pxc 0.5762068E+01 Qxc -0.2853958E+01 3,-1 55 3 +1 -1.712973 -0.516895 0.601182 Rho 0.9124063E-02 |GRAD(Rho)| 0.1084692E-12 GRAD(Rho)x -0.6324670E-13 GRAD(Rho)y 0.6178455E-13 GRAD(Rho)z -0.6283382E-13 Laplacian 0.3485598E-01 (-1/4)Del**2(Rho)) -0.8713995E-02 Diamond 0.1038578E-02 Metallicity 0.7876192E+00 Ellipticity -0.1531970E+01 Gb(Abramov) 0.6953215E-02 Vb(Abramov) -0.5192435E-02 Hb(Abramov) 0.1760780E-02 Ex_ueg -0.1408108E-02 Ec_ueg -0.3284887E-03 Delta_ex -0.1627872E-02 Delta_ec 0.5108799E-03 Delta_et -0.3528992E-02 Pxc 0.4286627E+01 Qxc -0.3186408E+01 3,+1 56 3 -1 -1.807758 -0.603195 -1.814408 Rho 0.4316448E-01 |GRAD(Rho)| 0.3928439E-15 GRAD(Rho)x 0.3035952E-15 GRAD(Rho)y -0.8620318E-16 GRAD(Rho)z 0.2339344E-15 Laplacian 0.1819922E+00 (-1/4)Del**2(Rho)) -0.4549804E-01 Diamond 0.8315741E-01 Metallicity 0.2011120E+01 Ellipticity 0.2481286E-01 Gb(Abramov) 0.4558237E-01 Vb(Abramov) -0.4566669E-01 Hb(Abramov) -0.8432464E-04 Ex_ueg -0.1118288E-01 Ec_ueg -0.2040670E-02 Delta_ex -0.1483791E-01 Delta_ec 0.6141084E-02 Delta_et -0.6241094E-01 Pxc 0.5480006E+01 Qxc -0.2416171E+01 3,-1 57 3 +3 -2.368055 0.007153 0.071348 Rho 0.4941031E-02 |GRAD(Rho)| 0.1857897E-15 GRAD(Rho)x 0.8431323E-16 GRAD(Rho)y 0.1266325E-15 GRAD(Rho)z 0.1066457E-15 Laplacian 0.1985625E-01 (-1/4)Del**2(Rho)) -0.4964062E-02 Diamond 0.1889722E-03 Metallicity 0.4974452E+00 Ellipticity -0.3429482E+00 Gb(Abramov) 0.3720933E-02 Vb(Abramov) -0.2477804E-02 Hb(Abramov) 0.1243129E-02 Ex_ueg -0.6215486E-03 Ec_ueg -0.1443760E-03 Delta_ex -0.7333334E-03 Delta_ec 0.1759694E-03 Delta_et -0.1134144E-02 Pxc 0.4305069E+01 Qxc -0.4167393E+01 3,+3 58 3 -1 0.821376 -3.033322 2.107549 Rho 0.1584112E+00 |GRAD(Rho)| 0.1069304E-15 GRAD(Rho)x 0.9307876E-16 GRAD(Rho)y 0.4965646E-16 GRAD(Rho)z 0.1745565E-16 Laplacian 0.6274608E+00 (-1/4)Del**2(Rho)) -0.1568652E+00 Diamond 0.1344020E+01 Metallicity 0.5093342E+01 Ellipticity 0.5001701E-01 Gb(Abramov) 0.2377382E+00 Vb(Abramov) -0.3186111E+00 Hb(Abramov) -0.8087297E-01 Ex_ueg -0.6330424E-01 Ec_ueg -0.8984106E-02 Delta_ex -0.6817014E-01 Delta_ec 0.1547852E-01 Delta_et -0.2070026E+00 Pxc 0.7046248E+01 Qxc -0.4404177E+01 3,-1 59 3 -1 -3.060728 -0.991632 -2.079276 Rho 0.9549163E-01 |GRAD(Rho)| 0.3501236E-15 GRAD(Rho)x 0.7575185E-16 GRAD(Rho)y 0.3068699E-15 GRAD(Rho)z -0.1505957E-15 Laplacian 0.3913098E+00 (-1/4)Del**2(Rho)) -0.9782745E-01 Diamond 0.4812458E+00 Metallicity 0.3513187E+01 Ellipticity 0.1929662E-01 Gb(Abramov) 0.1224993E+00 Vb(Abramov) -0.1471712E+00 Hb(Abramov) -0.2467187E-01 Ex_ueg -0.3223582E-01 Ec_ueg -0.5052769E-02 Delta_ex -0.3810853E-01 Delta_ec 0.1170185E-01 Delta_et -0.1447836E+00 Pxc 0.6379833E+01 Qxc -0.3256624E+01 3,-1 60 3 +1 -2.905544 -0.289049 -0.256996 Rho 0.5519142E-02 |GRAD(Rho)| 0.8455009E-17 GRAD(Rho)x -0.6764795E-18 GRAD(Rho)y 0.5514026E-17 GRAD(Rho)z -0.6373780E-17 Laplacian 0.2185577E-01 (-1/4)Del**2(Rho)) -0.5463943E-02 Diamond 0.4395290E-03 Metallicity 0.5434584E+00 Ellipticity -0.1573191E+01 Gb(Abramov) 0.4137533E-02 Vb(Abramov) -0.2811123E-02 Hb(Abramov) 0.1326410E-02 Ex_ueg -0.7203560E-03 Ec_ueg -0.1693216E-03 Delta_ex -0.9916766E-03 Delta_ec 0.4810487E-03 Delta_et -0.2773823E-02 Pxc 0.4254366E+01 Qxc -0.2061489E+01 3,+1 61 3 +1 -0.572163 -0.543899 1.703070 Rho 0.8123078E-02 |GRAD(Rho)| 0.1026213E-12 GRAD(Rho)x 0.2766136E-13 GRAD(Rho)y 0.6160432E-13 GRAD(Rho)z -0.7727150E-13 Laplacian 0.3149271E-01 (-1/4)Del**2(Rho)) -0.7873179E-02 Diamond 0.7726277E-03 Metallicity 0.7182420E+00 Ellipticity -0.1418127E+01 Gb(Abramov) 0.6191260E-02 Vb(Abramov) -0.4509342E-02 Hb(Abramov) 0.1681918E-02 Ex_ueg -0.1205996E-02 Ec_ueg -0.2836921E-03 Delta_ex -0.1414665E-02 Delta_ec 0.4369613E-03 Delta_et -0.2948153E-02 Pxc 0.4251074E+01 Qxc -0.3237507E+01 3,+1 62 3 -1 -3.381434 0.090045 -3.211137 Rho 0.1890647E+00 |GRAD(Rho)| 0.5655421E-15 GRAD(Rho)x 0.3561604E-15 GRAD(Rho)y -0.2354074E-15 GRAD(Rho)z 0.3709056E-15 Laplacian 0.7160815E+00 (-1/4)Del**2(Rho)) -0.1790204E+00 Diamond 0.1922286E+01 Metallicity 0.5993330E+01 Ellipticity 0.2823614E-01 Gb(Abramov) 0.2981683E+00 Vb(Abramov) -0.4173162E+00 Hb(Abramov) -0.1191479E+00 Ex_ueg -0.8014302E-01 Ec_ueg -0.1098958E-01 Delta_ex -0.8151760E-01 Delta_ec 0.1719668E-01 Delta_et -0.2355047E+00 Pxc 0.7292639E+01 Qxc -0.4740311E+01 3,-1 63 3 -1 -2.964287 -0.002738 0.054745 Rho 0.5727440E-02 |GRAD(Rho)| 0.7940739E-17 GRAD(Rho)x -0.1139759E-17 GRAD(Rho)y 0.7496299E-17 GRAD(Rho)z -0.2358345E-17 Laplacian 0.2169601E-01 (-1/4)Del**2(Rho)) -0.5424003E-02 Diamond 0.6725300E-03 Metallicity 0.5823277E+00 Ellipticity 0.1583790E+01 Gb(Abramov) 0.4142427E-02 Vb(Abramov) -0.2860850E-02 Hb(Abramov) 0.1281577E-02 Ex_ueg -0.7568313E-03 Ec_ueg -0.1783506E-03 Delta_ex -0.1158135E-02 Delta_ec 0.7733382E-03 Delta_et -0.4338674E-02 Pxc 0.4243504E+01 Qxc -0.1497579E+01 3,-1 64 3 +1 -2.965257 0.186002 0.257156 Rho 0.5659171E-02 |GRAD(Rho)| 0.1391324E-16 GRAD(Rho)x 0.1210476E-17 GRAD(Rho)y 0.9681182E-17 GRAD(Rho)z -0.9919064E-17 Laplacian 0.2182057E-01 (-1/4)Del**2(Rho)) -0.5455142E-02 Diamond 0.5106661E-03 Metallicity 0.5675470E+00 Ellipticity -0.2305199E+01 Gb(Abramov) 0.4152769E-02 Vb(Abramov) -0.2850397E-02 Hb(Abramov) 0.1302372E-02 Ex_ueg -0.7448271E-03 Ec_ueg -0.1753890E-03 Delta_ex -0.1040210E-02 Delta_ec 0.5600489E-03 Delta_et -0.3207199E-02 Pxc 0.4246715E+01 Qxc -0.1857356E+01 3,+1 65 3 -1 -3.257987 -0.053503 3.309280 Rho 0.1975561E+00 |GRAD(Rho)| 0.4708924E-15 GRAD(Rho)x 0.4494560E-15 GRAD(Rho)y -0.1406752E-16 GRAD(Rho)z -0.1397537E-15 Laplacian 0.7536610E+00 (-1/4)Del**2(Rho)) -0.1884153E+00 Diamond 0.2115894E+01 Metallicity 0.6127094E+01 Ellipticity 0.1771765E-02 Gb(Abramov) 0.3180165E+00 Vb(Abramov) -0.4476178E+00 Hb(Abramov) -0.1296013E+00 Ex_ueg -0.8497784E-01 Ec_ueg -0.1155464E-01 Delta_ex -0.8664057E-01 Delta_ec 0.1767783E-01 Delta_et -0.2423713E+00 Pxc 0.7354436E+01 Qxc -0.4901086E+01 3,-1 66 3 +1 -1.390249 2.214943 1.132634 Rho 0.2508773E-01 |GRAD(Rho)| 0.1397692E-15 GRAD(Rho)x -0.7504226E-16 GRAD(Rho)y 0.1154303E-15 GRAD(Rho)z -0.2408180E-16 Laplacian 0.9171100E-01 (-1/4)Del**2(Rho)) -0.2292775E-01 Diamond 0.1174345E-01 Metallicity 0.1615452E+01 Ellipticity -0.4397937E+01 Gb(Abramov) 0.2145828E-01 Vb(Abramov) -0.1998881E-01 Hb(Abramov) 0.1469469E-02 Ex_ueg -0.5424175E-02 Ec_ueg -0.1093133E-02 Delta_ex -0.5675831E-02 Delta_ec 0.1496567E-02 Delta_et -0.1323550E-01 Pxc 0.4962047E+01 Qxc -0.3792567E+01 3,+1 67 3 -1 -2.814122 0.500210 -1.868231 Rho 0.8763200E-01 |GRAD(Rho)| 0.2378026E-16 GRAD(Rho)x 0.3667653E-17 GRAD(Rho)y 0.2282923E-16 GRAD(Rho)z -0.5556536E-17 Laplacian 0.3823316E+00 (-1/4)Del**2(Rho)) -0.9558290E-01 Diamond 0.4169835E+00 Metallicity 0.3116096E+01 Ellipticity 0.1978721E-02 Gb(Abramov) 0.1133628E+00 Vb(Abramov) -0.1311428E+00 Hb(Abramov) -0.1777995E-01 Ex_ueg -0.2874763E-01 Ec_ueg -0.4582146E-02 Delta_ex -0.3637691E-01 Delta_ec 0.1139101E-01 Delta_et -0.1381035E+00 Pxc 0.6273834E+01 Qxc -0.3193475E+01 3,-1 68 3 +1 -0.676224 0.485707 -1.740788 Rho 0.7715491E-02 |GRAD(Rho)| 0.3188697E-14 GRAD(Rho)x 0.1530430E-14 GRAD(Rho)y -0.1580247E-14 GRAD(Rho)z 0.2308331E-14 Laplacian 0.2924171E-01 (-1/4)Del**2(Rho)) -0.7310429E-02 Diamond 0.6947022E-03 Metallicity 0.7099313E+00 Ellipticity -0.1465017E+01 Gb(Abramov) 0.5738603E-02 Vb(Abramov) -0.4166777E-02 Hb(Abramov) 0.1571826E-02 Ex_ueg -0.1125995E-02 Ec_ueg -0.2655802E-03 Delta_ex -0.1310097E-02 Delta_ec 0.4297724E-03 Delta_et -0.2841028E-02 Pxc 0.4239755E+01 Qxc -0.3048350E+01 3,+1 69 3 -1 -3.085235 0.905066 2.083394 Rho 0.1308586E+00 |GRAD(Rho)| 0.2464356E-15 GRAD(Rho)x 0.1609227E-15 GRAD(Rho)y -0.1459472E-15 GRAD(Rho)z 0.1163349E-15 Laplacian 0.5293227E+00 (-1/4)Del**2(Rho)) -0.1323307E+00 Diamond 0.9255566E+00 Metallicity 0.4390997E+01 Ellipticity 0.2474408E-01 Gb(Abramov) 0.1850644E+00 Vb(Abramov) -0.2377981E+00 Hb(Abramov) -0.5273371E-01 Ex_ueg -0.4906685E-01 Ec_ueg -0.7229695E-02 Delta_ex -0.5516602E-01 Delta_ec 0.1420735E-01 Delta_et -0.1858915E+00 Pxc 0.6786848E+01 Qxc -0.3882920E+01 3,-1 70 3 +1 -1.189201 1.324216 2.260129 Rho 0.2416418E-01 |GRAD(Rho)| 0.4036155E-16 GRAD(Rho)x 0.2929585E-16 GRAD(Rho)y -0.2612478E-16 GRAD(Rho)z 0.9397012E-17 Laplacian 0.8718335E-01 (-1/4)Del**2(Rho)) -0.2179584E-01 Diamond 0.1090440E-01 Metallicity 0.1596368E+01 Ellipticity -0.5676178E+01 Gb(Abramov) 0.2032959E-01 Vb(Abramov) -0.1886334E-01 Hb(Abramov) 0.1466250E-02 Ex_ueg -0.5159581E-02 Ec_ueg -0.1046724E-02 Delta_ex -0.5375996E-02 Delta_ec 0.1484140E-02 Delta_et -0.1299077E-01 Pxc 0.4929263E+01 Qxc -0.3622298E+01 3,+1 71 3 -1 -3.270211 -3.190871 0.124223 Rho 0.2217342E+00 |GRAD(Rho)| 0.1464769E-10 GRAD(Rho)x -0.1016307E-10 GRAD(Rho)y -0.1001209E-10 GRAD(Rho)z 0.3320360E-11 Laplacian 0.8359892E+00 (-1/4)Del**2(Rho)) -0.2089973E+00 Diamond 0.2682825E+01 Metallicity 0.6695768E+01 Ellipticity 0.2768766E-02 Gb(Abramov) 0.3725644E+00 Vb(Abramov) -0.5361316E+00 Hb(Abramov) -0.1635671E+00 Ex_ueg -0.9912017E-01 Ec_ueg -0.1318560E-01 Delta_ex -0.9891612E-01 Delta_ec 0.1884320E-01 Delta_et -0.2598752E+00 Pxc 0.7517305E+01 Qxc -0.5249434E+01 3,-1 72 3 -1 -3.068369 -2.080214 -0.861356 Rho 0.1639049E+00 |GRAD(Rho)| 0.1935354E-11 GRAD(Rho)x -0.8516269E-12 GRAD(Rho)y 0.9018471E-12 GRAD(Rho)z -0.1485597E-11 Laplacian 0.6368051E+00 (-1/4)Del**2(Rho)) -0.1592013E+00 Diamond 0.1431761E+01 Metallicity 0.5312019E+01 Ellipticity 0.6708863E-01 Gb(Abramov) 0.2470809E+00 Vb(Abramov) -0.3349605E+00 Hb(Abramov) -0.8787962E-01 Ex_ueg -0.6624821E-01 Ec_ueg -0.9339487E-02 Delta_ex -0.6986964E-01 Delta_ec 0.1574209E-01 Delta_et -0.2118583E+00 Pxc 0.7093346E+01 Qxc -0.4438396E+01 3,-1 73 3 -1 -2.822191 1.786740 -0.550294 Rho 0.1579957E+00 |GRAD(Rho)| 0.5348584E-15 GRAD(Rho)x 0.1177715E-16 GRAD(Rho)y 0.8229094E-16 GRAD(Rho)z 0.5283588E-15 Laplacian 0.6520755E+00 (-1/4)Del**2(Rho)) -0.1630189E+00 Diamond 0.1417003E+01 Metallicity 0.4879673E+01 Ellipticity 0.1741191E-01 Gb(Abramov) 0.2412590E+00 Vb(Abramov) -0.3194992E+00 Hb(Abramov) -0.7824018E-01 Ex_ueg -0.6308296E-01 Ec_ueg -0.8957303E-02 Delta_ex -0.7102739E-01 Delta_ec 0.1650564E-01 Delta_et -0.2216979E+00 Pxc 0.7042629E+01 Qxc -0.4303219E+01 3,-1 74 3 -1 -3.097429 2.007747 0.899762 Rho 0.1177449E+00 |GRAD(Rho)| 0.8659062E-15 GRAD(Rho)x -0.2986977E-15 GRAD(Rho)y -0.4528577E-15 GRAD(Rho)z 0.6749023E-15 Laplacian 0.4728265E+00 (-1/4)Del**2(Rho)) -0.1182066E+00 Diamond 0.7359872E+00 Metallicity 0.4122383E+01 Ellipticity 0.4734189E-02 Gb(Abramov) 0.1600199E+00 Vb(Abramov) -0.2018332E+00 Hb(Abramov) -0.4181329E-01 Ex_ueg -0.4262274E-01 Ec_ueg -0.6411986E-02 Delta_ex -0.4816021E-01 Delta_ec 0.1319864E-01 Delta_et -0.1698522E+00 Pxc 0.6647354E+01 Qxc -0.3648878E+01 3,-1 75 3 -1 -2.816336 -1.818747 0.583199 Rho 0.1611693E+00 |GRAD(Rho)| 0.1320037E-15 GRAD(Rho)x -0.1229960E-15 GRAD(Rho)y -0.2873136E-17 GRAD(Rho)z 0.4784042E-16 Laplacian 0.6620589E+00 (-1/4)Del**2(Rho)) -0.1655147E+00 Diamond 0.1450197E+01 Metallicity 0.4968061E+01 Ellipticity 0.1796390E-01 Gb(Abramov) 0.2473910E+00 Vb(Abramov) -0.3292673E+00 Hb(Abramov) -0.8187630E-01 Ex_ueg -0.6477808E-01 Ec_ueg -0.9162300E-02 Delta_ex -0.7225970E-01 Delta_ec 0.1629847E-01 Delta_et -0.2185345E+00 Pxc 0.7070067E+01 Qxc -0.4433526E+01 3,-1 76 3 +1 -2.278880 -1.077266 -1.522446 Rho 0.2614292E-01 |GRAD(Rho)| 0.4935678E-16 GRAD(Rho)x 0.4817622E-16 GRAD(Rho)y 0.7717767E-17 GRAD(Rho)z 0.7455147E-17 Laplacian 0.1035727E+00 (-1/4)Del**2(Rho)) -0.2589317E-01 Diamond 0.1175634E-01 Metallicity 0.1532116E+01 Ellipticity -0.2002747E+01 Gb(Abramov) 0.2387400E-01 Vb(Abramov) -0.2185483E-01 Hb(Abramov) 0.2019168E-02 Ex_ueg -0.5730474E-02 Ec_ueg -0.1146429E-02 Delta_ex -0.6248015E-02 Delta_ec 0.1273472E-02 Delta_et -0.1146093E-01 Pxc 0.4998543E+01 Qxc -0.4906283E+01 3,+1 77 3 -1 -2.224779 -0.866945 -3.339890 Rho 0.1905482E+00 |GRAD(Rho)| 0.2139840E-13 GRAD(Rho)x -0.1776167E-13 GRAD(Rho)y 0.1080131E-13 GRAD(Rho)z -0.5074066E-14 Laplacian 0.7652227E+00 (-1/4)Del**2(Rho)) -0.1913057E+00 Diamond 0.2035864E+01 Metallicity 0.5681985E+01 Ellipticity 0.1610825E-01 Gb(Abramov) 0.3087031E+00 Vb(Abramov) -0.4261005E+00 Hb(Abramov) -0.1173974E+00 Ex_ueg -0.8098257E-01 Ec_ueg -0.1108800E-01 Delta_ex -0.8701121E-01 Delta_ec 0.1785085E-01 Delta_et -0.2430812E+00 Pxc 0.7303620E+01 Qxc -0.4874346E+01 3,-1 78 3 -1 0.486917 -1.763143 1.746289 Rho 0.4495086E-01 |GRAD(Rho)| 0.1317094E-12 GRAD(Rho)x -0.8041267E-13 GRAD(Rho)y -0.9900288E-13 GRAD(Rho)z 0.3285726E-13 Laplacian 0.1764508E+00 (-1/4)Del**2(Rho)) -0.4411269E-01 Diamond 0.7644984E-01 Metallicity 0.2219318E+01 Ellipticity 0.2300344E-01 Gb(Abramov) 0.4572515E-01 Vb(Abramov) -0.4733760E-01 Hb(Abramov) -0.1612451E-02 Ex_ueg -0.1180418E-01 Ec_ueg -0.2137738E-02 Delta_ex -0.1409445E-01 Delta_ec 0.5177733E-02 Delta_et -0.5307268E-01 Pxc 0.5521808E+01 Qxc -0.2722128E+01 3,-1 79 3 -1 -1.819243 -0.535987 2.871249 Rho 0.1133746E+00 |GRAD(Rho)| 0.4722407E-15 GRAD(Rho)x 0.3224824E-15 GRAD(Rho)y -0.3074662E-15 GRAD(Rho)z 0.1564639E-15 Laplacian 0.4879736E+00 (-1/4)Del**2(Rho)) -0.1219934E+00 Diamond 0.7303625E+00 Metallicity 0.3750388E+01 Ellipticity 0.1014997E-01 Gb(Abramov) 0.1575827E+00 Vb(Abramov) -0.1931720E+00 Hb(Abramov) -0.3558929E-01 Ex_ueg -0.4052651E-01 Ec_ueg -0.6142125E-02 Delta_ex -0.4932921E-01 Delta_ec 0.1385751E-01 Delta_et -0.1772506E+00 Pxc 0.6598125E+01 Qxc -0.3559746E+01 3,-1 80 3 -1 -1.839613 0.539853 -2.915457 Rho 0.9726288E-01 |GRAD(Rho)| 0.1407083E-15 GRAD(Rho)x 0.1364197E-15 GRAD(Rho)y 0.3137410E-16 GRAD(Rho)z -0.1428775E-16 Laplacian 0.4211455E+00 (-1/4)Del**2(Rho)) -0.1052864E+00 Diamond 0.5293893E+00 Metallicity 0.3365835E+01 Ellipticity 0.1035983E-01 Gb(Abramov) 0.1292537E+00 Vb(Abramov) -0.1532210E+00 Hb(Abramov) -0.2396731E-01 Ex_ueg -0.3303553E-01 Ec_ueg -0.5159547E-02 Delta_ex -0.4118347E-01 Delta_ec 0.1253956E-01 Delta_et -0.1557474E+00 Pxc 0.6402795E+01 Qxc -0.3284284E+01 3,-1 81 3 +1 -0.636890 -1.695647 0.547645 Rho 0.8564766E-02 |GRAD(Rho)| 0.2907289E-13 GRAD(Rho)x 0.2731206E-13 GRAD(Rho)y 0.7144757E-14 GRAD(Rho)z 0.6945260E-14 Laplacian 0.3284676E-01 (-1/4)Del**2(Rho)) -0.8211689E-02 Diamond 0.8661215E-03 Metallicity 0.7521651E+00 Ellipticity -0.1452240E+01 Gb(Abramov) 0.6503884E-02 Vb(Abramov) -0.4796079E-02 Hb(Abramov) 0.1707805E-02 Ex_ueg -0.1294213E-02 Ec_ueg -0.3034039E-03 Delta_ex -0.1495387E-02 Delta_ec 0.4557398E-03 Delta_et -0.3116936E-02 Pxc 0.4265643E+01 Qxc -0.3281230E+01 3,+1 82 3 +3 -1.142891 -1.115798 1.193592 Rho 0.5090212E-02 |GRAD(Rho)| 0.6386949E-17 GRAD(Rho)x 0.4703470E-17 GRAD(Rho)y 0.1440349E-17 GRAD(Rho)z -0.4073805E-17 Laplacian 0.1973625E-01 (-1/4)Del**2(Rho)) -0.4934063E-02 Diamond 0.1411971E-03 Metallicity 0.5259062E+00 Ellipticity -0.2019363E+00 Gb(Abramov) 0.3721851E-02 Vb(Abramov) -0.2509639E-02 Hb(Abramov) 0.1212212E-02 Ex_ueg -0.6466951E-03 Ec_ueg -0.1507971E-03 Delta_ex -0.6852275E-03 Delta_ec 0.8686526E-04 Delta_et -0.6900013E-03 Pxc 0.4288513E+01 Qxc -0.7888395E+01 3,+3 83 3 -1 -0.148105 -1.278573 -3.842609 Rho 0.3461044E-02 |GRAD(Rho)| 0.5379396E-11 GRAD(Rho)x 0.5061622E-11 GRAD(Rho)y 0.1434060E-11 GRAD(Rho)z 0.1123100E-11 Laplacian 0.1086215E-01 (-1/4)Del**2(Rho)) -0.2715538E-02 Diamond 0.2216936E-03 Metallicity 0.5023917E+00 Ellipticity 0.9888031E-01 Gb(Abramov) 0.2037736E-02 Vb(Abramov) -0.1359934E-02 Hb(Abramov) 0.6778021E-03 Ex_ueg -0.3866588E-03 Ec_ueg -0.8129856E-04 Delta_ex -0.6058524E-03 Delta_ec 0.5237838E-03 Delta_et -0.2470693E-02 Pxc 0.4756035E+01 Qxc -0.1156684E+01 3,-1 84 3 +1 -1.761031 1.753264 -1.800209 Rho 0.1101658E-01 |GRAD(Rho)| 0.3520896E-16 GRAD(Rho)x -0.1875026E-16 GRAD(Rho)y 0.5604790E-17 GRAD(Rho)z 0.2926919E-16 Laplacian 0.5101943E-01 (-1/4)Del**2(Rho)) -0.1275486E-01 Diamond 0.1759744E-02 Metallicity 0.7366973E+00 Ellipticity -0.1277973E+01 Gb(Abramov) 0.1006932E-01 Vb(Abramov) -0.7383775E-02 Hb(Abramov) 0.2685541E-02 Ex_ueg -0.1810426E-02 Ec_ueg -0.4143635E-03 Delta_ex -0.2433124E-02 Delta_ec 0.6283758E-03 Delta_et -0.4641012E-02 Pxc 0.4369175E+01 Qxc -0.3872085E+01 3,+1 85 3 +1 -1.695995 0.535445 -0.517385 Rho 0.9751360E-02 |GRAD(Rho)| 0.7857806E-13 GRAD(Rho)x -0.7681557E-13 GRAD(Rho)y -0.1647565E-13 GRAD(Rho)z 0.1559798E-14 Laplacian 0.3578610E-01 (-1/4)Del**2(Rho)) -0.8946526E-02 Diamond 0.1145228E-02 Metallicity 0.8570524E+00 Ellipticity -0.1599132E+01 Gb(Abramov) 0.7242291E-02 Vb(Abramov) -0.5538056E-02 Hb(Abramov) 0.1704235E-02 Ex_ueg -0.1538646E-02 Ec_ueg -0.3567852E-03 Delta_ex -0.1691228E-02 Delta_ec 0.5093528E-03 Delta_et -0.3590716E-02 Pxc 0.4312527E+01 Qxc -0.3320346E+01 3,+1 86 3 -1 -1.757985 0.562610 1.788046 Rho 0.4418569E-01 |GRAD(Rho)| 0.3182076E-16 GRAD(Rho)x -0.1542447E-17 GRAD(Rho)y 0.9469617E-17 GRAD(Rho)z 0.3033987E-16 Laplacian 0.1868873E+00 (-1/4)Del**2(Rho)) -0.4672183E-01 Diamond 0.8569816E-01 Metallicity 0.2036274E+01 Ellipticity 0.1950075E-01 Gb(Abramov) 0.4700429E-01 Vb(Abramov) -0.4728675E-01 Hb(Abramov) -0.2824608E-03 Ex_ueg -0.1153703E-01 Ec_ueg -0.2096095E-02 Delta_ex -0.1519921E-01 Delta_ec 0.6083097E-02 Delta_et -0.6218304E-01 Pxc 0.5504058E+01 Qxc -0.2498598E+01 3,-1 87 3 -1 -2.027294 0.909330 3.130580 Rho 0.1337243E+00 |GRAD(Rho)| 0.2482692E-15 GRAD(Rho)x -0.2001437E-15 GRAD(Rho)y -0.1455812E-15 GRAD(Rho)z -0.1965116E-16 Laplacian 0.5351094E+00 (-1/4)Del**2(Rho)) -0.1337773E+00 Diamond 0.9636959E+00 Metallicity 0.4503202E+01 Ellipticity 0.1736002E-01 Gb(Abramov) 0.1895893E+00 Vb(Abramov) -0.2454012E+00 Hb(Abramov) -0.5581195E-01 Ex_ueg -0.5050477E-01 Ec_ueg -0.7409926E-02 Delta_ex -0.5609922E-01 Delta_ec 0.1435835E-01 Delta_et -0.1886697E+00 Pxc 0.6815826E+01 Qxc -0.3907079E+01 3,-1 88 3 +3 1.118351 1.071068 1.058503 Rho 0.4445617E-02 |GRAD(Rho)| 0.3992665E-12 GRAD(Rho)x 0.8198915E-14 GRAD(Rho)y 0.5494691E-14 GRAD(Rho)z 0.3991444E-12 Laplacian 0.1708503E-01 (-1/4)Del**2(Rho)) -0.4271258E-02 Diamond 0.1080023E-03 Metallicity 0.4847869E+00 Ellipticity -0.1746723E+00 Gb(Abramov) 0.3192613E-02 Vb(Abramov) -0.2113969E-02 Hb(Abramov) 0.1078644E-02 Ex_ueg -0.5398766E-03 Ec_ueg -0.1231340E-03 Delta_ex -0.5783679E-03 Delta_ec 0.8769762E-04 Delta_et -0.6438402E-03 Pxc 0.4384463E+01 Qxc -0.6595024E+01 3,+3 89 3 +1 0.127797 -3.193784 0.284950 Rho 0.5843939E-02 |GRAD(Rho)| 0.6225307E-17 GRAD(Rho)x -0.5533837E-17 GRAD(Rho)y 0.2874913E-18 GRAD(Rho)z 0.2836977E-17 Laplacian 0.2288889E-01 (-1/4)Del**2(Rho)) -0.5722223E-02 Diamond 0.5574618E-03 Metallicity 0.5708182E+00 Ellipticity -0.2144034E+01 Gb(Abramov) 0.4359207E-02 Vb(Abramov) -0.2996191E-02 Hb(Abramov) 0.1363016E-02 Ex_ueg -0.7774263E-03 Ec_ueg -0.1834098E-03 Delta_ex -0.1097101E-02 Delta_ec 0.5848975E-03 Delta_et -0.3382363E-02 Pxc 0.4238740E+01 Qxc -0.1875715E+01 3,+1 90 3 +1 -0.247029 0.232477 3.025294 Rho 0.5806879E-02 |GRAD(Rho)| 0.6085812E-17 GRAD(Rho)x 0.5296324E-17 GRAD(Rho)y -0.2713724E-17 GRAD(Rho)z 0.1273483E-17 Laplacian 0.2280522E-01 (-1/4)Del**2(Rho)) -0.5701304E-02 Diamond 0.5220565E-03 Metallicity 0.5668701E+00 Ellipticity -0.1896013E+01 Gb(Abramov) 0.4339519E-02 Vb(Abramov) -0.2977734E-02 Hb(Abramov) 0.1361785E-02 Ex_ueg -0.7708598E-03 Ec_ueg -0.1817996E-03 Delta_ex -0.1069850E-02 Delta_ec 0.5438849E-03 Delta_et -0.3158345E-02 Pxc 0.4240161E+01 Qxc -0.1967052E+01 3,+1 91 3 +3 -1.135135 1.095866 -1.219892 Rho 0.5154478E-02 |GRAD(Rho)| 0.1043692E-13 GRAD(Rho)x 0.9819610E-14 GRAD(Rho)y -0.3501173E-14 GRAD(Rho)z 0.4963514E-15 Laplacian 0.1923583E-01 (-1/4)Del**2(Rho)) -0.4808958E-02 Diamond 0.1361399E-03 Metallicity 0.5509895E+00 Ellipticity -0.4080215E+00 Gb(Abramov) 0.3647586E-02 Vb(Abramov) -0.2486215E-02 Hb(Abramov) 0.1161372E-02 Ex_ueg -0.6576043E-03 Ec_ueg -0.1535667E-03 Delta_ex -0.6667423E-03 Delta_ec 0.7851149E-04 Delta_et -0.6427078E-03 Pxc 0.4282207E+01 Qxc -0.8492290E+01 3,+3 92 3 +1 1.778979 1.754376 1.785270 Rho 0.1209339E-01 |GRAD(Rho)| 0.1494983E-16 GRAD(Rho)x -0.5201108E-17 GRAD(Rho)y 0.1369488E-16 GRAD(Rho)z -0.2982644E-17 Laplacian 0.5863911E-01 (-1/4)Del**2(Rho)) -0.1465978E-01 Diamond 0.2288008E-02 Metallicity 0.7487539E+00 Ellipticity -0.1252223E+01 Gb(Abramov) 0.1160261E-01 Vb(Abramov) -0.8545447E-02 Hb(Abramov) 0.3057165E-02 Ex_ueg -0.2050134E-02 Ec_ueg -0.4638818E-03 Delta_ex -0.2863451E-02 Delta_ec 0.7168190E-03 Delta_et -0.5419059E-02 Pxc 0.4419519E+01 Qxc -0.3994664E+01 3,+1 93 3 +1 0.303994 -1.994404 -0.651099 Rho 0.5231810E-02 |GRAD(Rho)| 0.3670778E-14 GRAD(Rho)x 0.1150979E-14 GRAD(Rho)y 0.1866127E-14 GRAD(Rho)z 0.2944050E-14 Laplacian 0.1913403E-01 (-1/4)Del**2(Rho)) -0.4783507E-02 Diamond 0.3543135E-03 Metallicity 0.5678410E+00 Ellipticity -0.1761862E+01 Gb(Abramov) 0.3641716E-02 Vb(Abramov) -0.2499926E-02 Hb(Abramov) 0.1141790E-02 Ex_ueg -0.6707917E-03 Ec_ueg -0.1569021E-03 Delta_ex -0.8548780E-03 Delta_ec 0.4153519E-03 Delta_et -0.2361878E-02 Pxc 0.4275224E+01 Qxc -0.2058201E+01 3,+1 94 3 -1 -2.003527 -3.130473 -0.687078 Rho 0.1433071E+00 |GRAD(Rho)| 0.2937755E-12 GRAD(Rho)x 0.1703780E-12 GRAD(Rho)y -0.1687318E-12 GRAD(Rho)z -0.1697203E-12 Laplacian 0.5383336E+00 (-1/4)Del**2(Rho)) -0.1345834E+00 Diamond 0.1050383E+01 Metallicity 0.5023519E+01 Ellipticity 0.1009393E+00 Gb(Abramov) 0.2024026E+00 Vb(Abramov) -0.2702219E+00 Hb(Abramov) -0.6781925E-01 Ex_ueg -0.5538713E-01 Ec_ueg -0.8016461E-02 Delta_ex -0.5735573E-01 Delta_ec 0.1414713E-01 Delta_et -0.1878209E+00 Pxc 0.6909175E+01 Qxc -0.4054230E+01 3,-1 95 3 +1 -1.787986 -1.749562 1.838323 Rho 0.1193106E-01 |GRAD(Rho)| 0.3366641E-13 GRAD(Rho)x -0.4246608E-14 GRAD(Rho)y 0.2597842E-13 GRAD(Rho)z 0.2098847E-13 Laplacian 0.5796828E-01 (-1/4)Del**2(Rho)) -0.1449207E-01 Diamond 0.2240751E-02 Metallicity 0.7405506E+00 Ellipticity -0.1257509E+01 Gb(Abramov) 0.1145007E-01 Vb(Abramov) -0.8408061E-02 Hb(Abramov) 0.3042005E-02 Ex_ueg -0.2013526E-02 Ec_ueg -0.4563876E-03 Delta_ex -0.2826501E-02 Delta_ec 0.7192730E-03 Delta_et -0.5411309E-02 Pxc 0.4411878E+01 Qxc -0.3929663E+01 3,+1 96 3 +1 -0.147623 -0.404230 -3.528160 Rho 0.2290185E-02 |GRAD(Rho)| 0.1469699E-16 GRAD(Rho)x -0.1235147E-16 GRAD(Rho)y 0.7654509E-17 GRAD(Rho)z 0.2202584E-17 Laplacian 0.7751162E-02 (-1/4)Del**2(Rho)) -0.1937791E-02 Diamond 0.5220279E-04 Metallicity 0.3537506E+00 Ellipticity -0.1545976E+01 Gb(Abramov) 0.1406109E-02 Vb(Abramov) -0.8744284E-03 Hb(Abramov) 0.5316811E-03 Ex_ueg -0.2229525E-03 Ec_ueg -0.3222979E-04 Delta_ex -0.3049754E-03 Delta_ec 0.1913995E-03 Delta_et -0.8423453E-03 Pxc 0.6917592E+01 Qxc -0.1593397E+01 3,+1 97 3 -1 -1.850895 -2.782513 0.625714 Rho 0.1132835E+00 |GRAD(Rho)| 0.1911336E-15 GRAD(Rho)x 0.1528793E-15 GRAD(Rho)y -0.2934461E-16 GRAD(Rho)z -0.1109003E-15 Laplacian 0.4648426E+00 (-1/4)Del**2(Rho)) -0.1162106E+00 Diamond 0.6720359E+00 Metallicity 0.3931740E+01 Ellipticity 0.1176054E-01 Gb(Abramov) 0.1536254E+00 Vb(Abramov) -0.1910402E+00 Hb(Abramov) -0.3741479E-01 Ex_ueg -0.4048310E-01 Ec_ueg -0.6136515E-02 Delta_ex -0.4664845E-01 Delta_ec 0.1260739E-01 Delta_et -0.1603815E+00 Pxc 0.6597083E+01 Qxc -0.3700087E+01 3,-1 98 3 +1 1.663881 0.539313 0.516726 Rho 0.6769503E-02 |GRAD(Rho)| 0.8901628E-17 GRAD(Rho)x -0.7783311E-17 GRAD(Rho)y 0.3023535E-17 GRAD(Rho)z 0.3085009E-17 Laplacian 0.2575923E-01 (-1/4)Del**2(Rho)) -0.6439808E-02 Diamond 0.5154829E-03 Metallicity 0.6480496E+00 Ellipticity -0.1415226E+01 Gb(Abramov) 0.4988758E-02 Vb(Abramov) -0.3537708E-02 Hb(Abramov) 0.1451050E-02 Ex_ueg -0.9457887E-03 Ec_ueg -0.2238389E-03 Delta_ex -0.1119334E-02 Delta_ec 0.3820947E-03 Delta_et -0.2437629E-02 Pxc 0.4225310E+01 Qxc -0.2929469E+01 3,+1 99 3 -1 -1.808113 2.789267 -0.570903 Rho 0.1031153E+00 |GRAD(Rho)| 0.8571521E-16 GRAD(Rho)x 0.4750161E-16 GRAD(Rho)y 0.6413056E-16 GRAD(Rho)z -0.3127246E-16 Laplacian 0.4420263E+00 (-1/4)Del**2(Rho)) -0.1105066E+00 Diamond 0.5935184E+00 Metallicity 0.3534842E+01 Ellipticity 0.1609069E-01 Gb(Abramov) 0.1387749E+00 Vb(Abramov) -0.1670433E+00 Hb(Abramov) -0.2826835E-01 Ex_ueg -0.3571212E-01 Ec_ueg -0.5514147E-02 Delta_ex -0.4376438E-01 Delta_ec 0.1291777E-01 Delta_et -0.1623052E+00 Pxc 0.6476455E+01 Qxc -0.3387919E+01 3,-1 100 3 +1 -0.593405 1.648731 -0.527155 Rho 0.8555889E-02 |GRAD(Rho)| 0.8991503E-17 GRAD(Rho)x -0.5007199E-17 GRAD(Rho)y 0.6904761E-17 GRAD(Rho)z 0.2845938E-17 Laplacian 0.3255450E-01 (-1/4)Del**2(Rho)) -0.8138625E-02 Diamond 0.8615199E-03 Metallicity 0.7576071E+00 Ellipticity -0.1465632E+01 Gb(Abramov) 0.6453397E-02 Vb(Abramov) -0.4768168E-02 Hb(Abramov) 0.1685228E-02 Ex_ueg -0.1292425E-02 Ec_ueg -0.3030069E-03 Delta_ex -0.1483651E-02 Delta_ec 0.4551818E-03 Delta_et -0.3109407E-02 Pxc 0.4265331E+01 Qxc -0.3259468E+01 3,+1 101 3 +1 -0.195688 2.988606 0.225258 Rho 0.5490292E-02 |GRAD(Rho)| 0.2285094E-14 GRAD(Rho)x -0.1511734E-14 GRAD(Rho)y 0.3048349E-15 GRAD(Rho)z 0.1686235E-14 Laplacian 0.2148692E-01 (-1/4)Del**2(Rho)) -0.5371730E-02 Diamond 0.4736582E-03 Metallicity 0.5479801E+00 Ellipticity -0.1989855E+01 Gb(Abramov) 0.4071754E-02 Vb(Abramov) -0.2771777E-02 Hb(Abramov) 0.1299976E-02 Ex_ueg -0.7153398E-03 Ec_ueg -0.1680727E-03 Delta_ex -0.1010374E-02 Delta_ec 0.5381877E-03 Delta_et -0.3061325E-02 Pxc 0.4256132E+01 Qxc -0.1877364E+01 3,+1 102 3 -1 -0.532440 0.448358 0.465221 Rho 0.1744681E+00 |GRAD(Rho)| 0.3202414E-14 GRAD(Rho)x 0.1769418E-14 GRAD(Rho)y -0.1897787E-14 GRAD(Rho)z -0.1876971E-14 Laplacian 0.4474770E+00 (-1/4)Del**2(Rho)) -0.1118693E+00 Diamond 0.1104828E+01 Metallicity 0.8388847E+01 Ellipticity 0.3091037E-02 Gb(Abramov) 0.2309885E+00 Vb(Abramov) -0.3501078E+00 Hb(Abramov) -0.1191193E+00 Ex_ueg -0.7200118E-01 Ec_ueg -0.1002781E-01 Delta_ex -0.5003489E-01 Delta_ec 0.1118111E-01 Delta_et -0.1524233E+00 Pxc 0.7180149E+01 Qxc -0.4474948E+01 3,-1 103 3 +3 0.014126 2.270138 0.014832 Rho 0.4456896E-02 |GRAD(Rho)| 0.6728446E-17 GRAD(Rho)x -0.1136154E-18 GRAD(Rho)y 0.2146945E-17 GRAD(Rho)z -0.6375712E-17 Laplacian 0.1806707E-01 (-1/4)Del**2(Rho)) -0.4516768E-02 Diamond 0.1395439E-03 Metallicity 0.4603762E+00 Ellipticity -0.3211014E+00 Gb(Abramov) 0.3357747E-02 Vb(Abramov) -0.2198727E-02 Hb(Abramov) 0.1159021E-02 Ex_ueg -0.5417035E-03 Ec_ueg -0.1236162E-03 Delta_ex -0.6390275E-03 Delta_ec 0.1409326E-03 Delta_et -0.9143195E-03 Pxc 0.4382141E+01 Qxc -0.4534276E+01 3,+3 104 3 -1 -0.595524 -2.792794 1.892296 Rho 0.1528624E+00 |GRAD(Rho)| 0.5833508E-15 GRAD(Rho)x 0.1887596E-15 GRAD(Rho)y 0.4978521E-16 GRAD(Rho)z 0.5497176E-15 Laplacian 0.6283776E+00 (-1/4)Del**2(Rho)) -0.1570944E+00 Diamond 0.1296196E+01 Metallicity 0.4792477E+01 Ellipticity 0.2289060E-01 Gb(Abramov) 0.2302082E+00 Vb(Abramov) -0.3033219E+00 Hb(Abramov) -0.7311375E-01 Ex_ueg -0.6036508E-01 Ec_ueg -0.8626997E-02 Delta_ex -0.6773385E-01 Delta_ec 0.1575660E-01 Delta_et -0.2100320E+00 Pxc 0.6997230E+01 Qxc -0.4298761E+01 3,-1 105 3 +1 1.602105 -0.619798 -0.617558 Rho 0.7654939E-02 |GRAD(Rho)| 0.1759959E-16 GRAD(Rho)x -0.1660006E-16 GRAD(Rho)y 0.3180068E-17 GRAD(Rho)z 0.4906202E-17 Laplacian 0.2911120E-01 (-1/4)Del**2(Rho)) -0.7277800E-02 Diamond 0.6789977E-03 Metallicity 0.7038108E+00 Ellipticity -0.1450835E+01 Gb(Abramov) 0.5705566E-02 Vb(Abramov) -0.4133332E-02 Hb(Abramov) 0.1572234E-02 Ex_ueg -0.1114228E-02 Ec_ueg -0.2628960E-03 Delta_ex -0.1298944E-02 Delta_ec 0.4229377E-03 Delta_et -0.2794037E-02 Pxc 0.4238285E+01 Qxc -0.3071242E+01 3,+1 106 3 +3 -0.077727 -2.376045 -0.109811 Rho 0.3936811E-02 |GRAD(Rho)| 0.4838210E-17 GRAD(Rho)x -0.2151270E-17 GRAD(Rho)y 0.4155529E-17 GRAD(Rho)z 0.1229593E-17 Laplacian 0.1564972E-01 (-1/4)Del**2(Rho)) -0.3912429E-02 Diamond 0.9219713E-04 Metallicity 0.4321962E+00 Ellipticity -0.2332443E+00 Gb(Abramov) 0.2890109E-02 Vb(Abramov) -0.1867789E-02 Hb(Abramov) 0.1022320E-02 Ex_ueg -0.4591041E-03 Ec_ueg -0.1014503E-03 Delta_ex -0.5233156E-03 Delta_ec 0.9942513E-04 Delta_et -0.6646046E-03 Pxc 0.4525407E+01 Qxc -0.5263414E+01 3,+3 107 3 -1 1.716460 0.419733 -1.875225 Rho 0.3011619E-01 |GRAD(Rho)| 0.1497919E-13 GRAD(Rho)x -0.5058198E-14 GRAD(Rho)y -0.1096225E-13 GRAD(Rho)z -0.8866788E-14 Laplacian 0.1235156E+00 (-1/4)Del**2(Rho)) -0.3087891E-01 Diamond 0.3382392E-01 Metallicity 0.1626390E+01 Ellipticity 0.6468417E-01 Gb(Abramov) 0.2895613E-01 Vb(Abramov) -0.2703335E-01 Hb(Abramov) 0.1922780E-02 Ex_ueg -0.6920197E-02 Ec_ueg -0.1349602E-02 Delta_ex -0.9172979E-02 Delta_ec 0.4054420E-02 Delta_et -0.3726067E-01 Pxc 0.5127583E+01 Qxc -0.2262464E+01 3,-1 108 3 -1 -0.584302 1.819400 -2.856082 Rho 0.1655418E+00 |GRAD(Rho)| 0.8503913E-15 GRAD(Rho)x 0.5927604E-15 GRAD(Rho)y 0.5346743E-15 GRAD(Rho)z 0.2931276E-15 Laplacian 0.6806322E+00 (-1/4)Del**2(Rho)) -0.1701580E+00 Diamond 0.1534989E+01 Metallicity 0.5052969E+01 Ellipticity 0.2042484E-01 Gb(Abramov) 0.2567392E+00 Vb(Abramov) -0.3433204E+00 Hb(Abramov) -0.8658120E-01 Ex_ueg -0.6713183E-01 Ec_ueg -0.9445723E-02 Delta_ex -0.7474381E-01 Delta_ec 0.1656937E-01 Delta_et -0.2226919E+00 Pxc 0.7107114E+01 Qxc -0.4510962E+01 3,-1 109 3 -1 -0.555189 1.748073 1.759227 Rho 0.4342104E-01 |GRAD(Rho)| 0.4796206E-15 GRAD(Rho)x -0.2249772E-15 GRAD(Rho)y -0.4234339E-15 GRAD(Rho)z -0.1117660E-16 Laplacian 0.1858568E+00 (-1/4)Del**2(Rho)) -0.4646420E-01 Diamond 0.8375778E-01 Metallicity 0.1988849E+01 Ellipticity 0.2401702E-01 Gb(Abramov) 0.4637785E-01 Vb(Abramov) -0.4629149E-01 Hb(Abramov) 0.8635311E-04 Ex_ueg -0.1127160E-01 Ec_ueg -0.2054578E-02 Delta_ex -0.1507848E-01 Delta_ec 0.6099322E-02 Delta_et -0.6206126E-01 Pxc 0.5486088E+01 Qxc -0.2472156E+01 3,-1 110 3 -1 -0.881207 2.038578 3.099648 Rho 0.1172008E+00 |GRAD(Rho)| 0.3365520E-15 GRAD(Rho)x -0.2811201E-15 GRAD(Rho)y -0.1439414E-15 GRAD(Rho)z 0.1162739E-15 Laplacian 0.4770575E+00 (-1/4)Del**2(Rho)) -0.1192644E+00 Diamond 0.7347647E+00 Metallicity 0.4054400E+01 Ellipticity 0.6661572E-02 Gb(Abramov) 0.1601005E+00 Vb(Abramov) -0.2009366E+00 Hb(Abramov) -0.4083613E-01 Ex_ueg -0.4236030E-01 Ec_ueg -0.6378312E-02 Delta_ex -0.4848716E-01 Delta_ec 0.1323982E-01 Delta_et -0.1700979E+00 Pxc 0.6641304E+01 Qxc -0.3662222E+01 3,-1 111 3 -1 -1.772405 1.718921 0.547650 Rho 0.4394708E-01 |GRAD(Rho)| 0.3125114E-16 GRAD(Rho)x -0.8267465E-17 GRAD(Rho)y 0.2688567E-16 GRAD(Rho)z -0.1361775E-16 Laplacian 0.1870028E+00 (-1/4)Del**2(Rho)) -0.4675069E-01 Diamond 0.8536906E-01 Metallicity 0.2016733E+01 Ellipticity 0.2423155E-01 Gb(Abramov) 0.4688107E-01 Vb(Abramov) -0.4701146E-01 Hb(Abramov) -0.1303827E-03 Ex_ueg -0.1145403E-01 Ec_ueg -0.2083129E-02 Delta_ex -0.1520106E-01 Delta_ec 0.6109564E-02 Delta_et -0.6236546E-01 Pxc 0.5498476E+01 Qxc -0.2488076E+01 3,-1 112 3 +1 0.530530 1.654275 0.499704 Rho 0.7583803E-02 |GRAD(Rho)| 0.1372438E-16 GRAD(Rho)x -0.9412594E-17 GRAD(Rho)y -0.9957147E-17 GRAD(Rho)z 0.7854336E-18 Laplacian 0.2901948E-01 (-1/4)Del**2(Rho)) -0.7254869E-02 Diamond 0.6705600E-03 Metallicity 0.6951342E+00 Ellipticity -0.1443455E+01 Gb(Abramov) 0.5677097E-02 Vb(Abramov) -0.4099325E-02 Hb(Abramov) 0.1577772E-02 Ex_ueg -0.1100443E-02 Ec_ueg -0.2597446E-03 Delta_ex -0.1293040E-02 Delta_ec 0.4237376E-03 Delta_et -0.2790765E-02 Pxc 0.4236636E+01 Qxc -0.3051511E+01 3,+1 113 3 -1 -0.544247 2.780979 -1.824242 Rho 0.1576646E+00 |GRAD(Rho)| 0.3227222E-15 GRAD(Rho)x -0.1814141E-15 GRAD(Rho)y 0.2919214E-16 GRAD(Rho)z -0.2653043E-15 Laplacian 0.6499683E+00 (-1/4)Del**2(Rho)) -0.1624921E+00 Diamond 0.1380747E+01 Metallicity 0.4878409E+01 Ellipticity 0.9232706E-02 Gb(Abramov) 0.2404452E+00 Vb(Abramov) -0.3183983E+00 Hb(Abramov) -0.7795310E-01 Ex_ueg -0.6290678E-01 Ec_ueg -0.8935953E-02 Delta_ex -0.7049907E-01 Delta_ec 0.1599296E-01 Delta_et -0.2136042E+00 Pxc 0.7039740E+01 Qxc -0.4408132E+01 3,-1 114 3 +1 0.155289 -0.178686 3.018758 Rho 0.5986398E-02 |GRAD(Rho)| 0.5208661E-17 GRAD(Rho)x -0.4414704E-17 GRAD(Rho)y -0.2748825E-17 GRAD(Rho)z 0.2906895E-18 Laplacian 0.2432597E-01 (-1/4)Del**2(Rho)) -0.6081492E-02 Diamond 0.6951114E-03 Metallicity 0.5590950E+00 Ellipticity -0.3394504E+01 Gb(Abramov) 0.4621017E-02 Vb(Abramov) -0.3160541E-02 Hb(Abramov) 0.1460475E-02 Ex_ueg -0.8027971E-03 Ec_ueg -0.1896054E-03 Delta_ex -0.1232631E-02 Delta_ec 0.7299825E-03 Delta_et -0.4198475E-02 Pxc 0.4234041E+01 Qxc -0.1688576E+01 3,+1 115 3 -1 0.039956 -0.061746 3.016003 Rho 0.6004086E-02 |GRAD(Rho)| 0.4404888E-17 GRAD(Rho)x 0.4222682E-17 GRAD(Rho)y 0.1043820E-17 GRAD(Rho)z -0.6945768E-18 Laplacian 0.2357006E-01 (-1/4)Del**2(Rho)) -0.5892515E-02 Diamond 0.7864957E-03 Metallicity 0.5798699E+00 Ellipticity 0.2713102E+01 Gb(Abramov) 0.4497825E-02 Vb(Abramov) -0.3103136E-02 Hb(Abramov) 0.1394690E-02 Ex_ueg -0.8059614E-03 Ec_ueg -0.1903754E-03 Delta_ex -0.1275285E-02 Delta_ec 0.8505737E-03 Delta_et -0.4837059E-02 Pxc 0.4233538E+01 Qxc -0.1499324E+01 3,-1 116 3 -1 0.849663 2.997021 -1.989691 Rho 0.1088684E+00 |GRAD(Rho)| 0.1382350E-12 GRAD(Rho)x 0.1322399E-12 GRAD(Rho)y 0.4812696E-14 GRAD(Rho)z -0.3997949E-13 Laplacian 0.4247737E+00 (-1/4)Del**2(Rho)) -0.1061934E+00 Diamond 0.5829948E+00 Metallicity 0.4026788E+01 Ellipticity 0.3037518E-01 Gb(Abramov) 0.1420653E+00 Vb(Abramov) -0.1779373E+00 Hb(Abramov) -0.3587193E-01 Ex_ueg -0.3839320E-01 Ec_ueg -0.5865331E-02 Delta_ex -0.4219237E-01 Delta_ec 0.1155973E-01 Delta_et -0.1458838E+00 Pxc 0.6545785E+01 Qxc -0.3649944E+01 3,-1 117 3 -1 0.010581 -3.506594 -1.136968 Rho 0.6047831E-01 |GRAD(Rho)| 0.7106257E-13 GRAD(Rho)x 0.2707564E-13 GRAD(Rho)y 0.1606509E-13 GRAD(Rho)z -0.6370802E-13 Laplacian 0.1270911E+00 (-1/4)Del**2(Rho)) -0.3177278E-01 Diamond 0.1499276E+00 Metallicity 0.5052396E+01 Ellipticity 0.6006365E-02 Gb(Abramov) 0.4793663E-01 Vb(Abramov) -0.6410048E-01 Hb(Abramov) -0.1616385E-01 Ex_ueg -0.1753280E-01 Ec_ueg -0.3001775E-02 Delta_ex -0.1320158E-01 Delta_ec 0.7751021E-02 Delta_et -0.8767534E-01 Pxc 0.5840810E+01 Qxc -0.1703206E+01 3,-1 118 3 +1 0.500226 0.479945 1.674607 Rho 0.8054716E-02 |GRAD(Rho)| 0.1743960E-15 GRAD(Rho)x -0.1456942E-15 GRAD(Rho)y 0.7843967E-16 GRAD(Rho)z -0.5508527E-16 Laplacian 0.3149848E-01 (-1/4)Del**2(Rho)) -0.7874620E-02 Diamond 0.7669230E-03 Metallicity 0.7080663E+00 Ellipticity -0.1411195E+01 Gb(Abramov) 0.6179039E-02 Vb(Abramov) -0.4483458E-02 Hb(Abramov) 0.1695581E-02 Ex_ueg -0.1192483E-02 Ec_ueg -0.2806490E-03 Delta_ex -0.1413384E-02 Delta_ec 0.4396730E-03 Delta_et -0.2957797E-02 Pxc 0.4249017E+01 Qxc -0.3214626E+01 3,+1 119 3 -1 -0.101043 -3.197768 3.302869 Rho 0.2217184E+00 |GRAD(Rho)| 0.6818734E-15 GRAD(Rho)x 0.1871740E-15 GRAD(Rho)y 0.4267962E-15 GRAD(Rho)z -0.4977572E-15 Laplacian 0.8195528E+00 (-1/4)Del**2(Rho)) -0.2048882E+00 Diamond 0.2639019E+01 Metallicity 0.6829242E+01 Ellipticity 0.4967165E-02 Gb(Abramov) 0.3697973E+00 Vb(Abramov) -0.5347064E+00 Hb(Abramov) -0.1649091E+00 Ex_ueg -0.9911075E-01 Ec_ueg -0.1318452E-01 Delta_ex -0.9702377E-01 Delta_ec 0.1856992E-01 Delta_et -0.2564927E+00 Pxc 0.7517204E+01 Qxc -0.5224781E+01 3,-1 120 3 -1 1.908973 -3.101615 0.874065 Rho 0.9605157E-01 |GRAD(Rho)| 0.1276562E-15 GRAD(Rho)x 0.2055918E-16 GRAD(Rho)y 0.1225724E-15 GRAD(Rho)z -0.2914471E-16 Laplacian 0.3955502E+00 (-1/4)Del**2(Rho)) -0.9888755E-01 Diamond 0.4866263E+00 Metallicity 0.3509557E+01 Ellipticity 0.7800560E-02 Gb(Abramov) 0.1237670E+00 Vb(Abramov) -0.1486464E+00 Hb(Abramov) -0.2487940E-01 Ex_ueg -0.3248810E-01 Ec_ueg -0.5086497E-02 Delta_ex -0.3851366E-01 Delta_ec 0.1170827E-01 Delta_et -0.1449296E+00 Pxc 0.6387127E+01 Qxc -0.3289439E+01 3,-1 121 3 -1 -0.569186 -1.811412 2.858413 Rho 0.1501276E+00 |GRAD(Rho)| 0.3758991E-14 GRAD(Rho)x 0.2583762E-14 GRAD(Rho)y -0.2643122E-14 GRAD(Rho)z -0.6841722E-15 Laplacian 0.6221237E+00 (-1/4)Del**2(Rho)) -0.1555309E+00 Diamond 0.1253016E+01 Metallicity 0.4697182E+01 Ellipticity 0.1246471E-01 Gb(Abramov) 0.2254468E+00 Vb(Abramov) -0.2953627E+00 Hb(Abramov) -0.6991588E-01 Ex_ueg -0.5892947E-01 Ec_ueg -0.8451684E-02 Delta_ex -0.6673458E-01 Delta_ec 0.1562139E-01 Delta_et -0.2076067E+00 Pxc 0.6972512E+01 Qxc -0.4271999E+01 3,-1 122 3 +1 2.135142 -1.562570 0.936890 Rho 0.2349870E-01 |GRAD(Rho)| 0.3355155E-16 GRAD(Rho)x 0.2541670E-16 GRAD(Rho)y -0.2139313E-16 GRAD(Rho)z 0.4693787E-17 Laplacian 0.8772347E-01 (-1/4)Del**2(Rho)) -0.2193087E-01 Diamond 0.8240350E-02 Metallicity 0.1514388E+01 Ellipticity -0.1936920E+01 Gb(Abramov) 0.2015589E-01 Vb(Abramov) -0.1838091E-01 Hb(Abramov) 0.1774981E-02 Ex_ueg -0.4970998E-02 Ec_ueg -0.1013427E-02 Delta_ex -0.5095834E-02 Delta_ec 0.1005172E-02 Delta_et -0.8871365E-02 Pxc 0.4905136E+01 Qxc -0.5069614E+01 3,+1 123 3 -1 0.555809 1.799650 2.805131 Rho 0.1104745E+00 |GRAD(Rho)| 0.5025836E-15 GRAD(Rho)x 0.3726538E-15 GRAD(Rho)y -0.3302751E-15 GRAD(Rho)z 0.6810145E-16 Laplacian 0.4739676E+00 (-1/4)Del**2(Rho)) -0.1184919E+00 Diamond 0.6870554E+00 Metallicity 0.3698007E+01 Ellipticity 0.1606109E-01 Gb(Abramov) 0.1520252E+00 Vb(Abramov) -0.1855586E+00 Hb(Abramov) -0.3353334E-01 Ex_ueg -0.3915023E-01 Ec_ueg -0.5963813E-02 Delta_ex -0.4761571E-01 Delta_ec 0.1352324E-01 Delta_et -0.1720965E+00 Pxc 0.6564630E+01 Qxc -0.3521029E+01 3,-1 124 3 -1 0.573945 2.801229 1.821340 Rho 0.1204179E+00 |GRAD(Rho)| 0.2831157E-09 GRAD(Rho)x -0.1890397E-09 GRAD(Rho)y -0.5527591E-10 GRAD(Rho)z 0.2033791E-09 Laplacian 0.5152317E+00 (-1/4)Del**2(Rho)) -0.1288079E+00 Diamond 0.8312920E+00 Metallicity 0.3927313E+01 Ellipticity 0.1261959E-01 Gb(Abramov) 0.1701835E+00 Vb(Abramov) -0.2115590E+00 Hb(Abramov) -0.4137553E-01 Ex_ueg -0.4391771E-01 Ec_ueg -0.6577701E-02 Delta_ex -0.5285657E-01 Delta_ec 0.1448383E-01 Delta_et -0.1874349E+00 Pxc 0.6676757E+01 Qxc -0.3649351E+01 3,-1 125 3 -1 -0.065618 3.218280 -3.208059 Rho 0.2208295E+00 |GRAD(Rho)| 0.4407826E-13 GRAD(Rho)x 0.6584387E-14 GRAD(Rho)y -0.3258114E-13 GRAD(Rho)z 0.2894836E-13 Laplacian 0.8218033E+00 (-1/4)Del**2(Rho)) -0.2054508E+00 Diamond 0.2630794E+01 Metallicity 0.6765092E+01 Ellipticity 0.4885959E-02 Gb(Abramov) 0.3686162E+00 Vb(Abramov) -0.5317815E+00 Hb(Abramov) -0.1631653E+00 Ex_ueg -0.9858128E-01 Ec_ueg -0.1312399E-01 Delta_ex -0.9717301E-01 Delta_ec 0.1861344E-01 Delta_et -0.2569217E+00 Pxc 0.7511535E+01 Qxc -0.5220584E+01 3,-1 126 3 -1 0.098067 3.260302 3.255950 Rho 0.1951892E+00 |GRAD(Rho)| 0.3599079E-08 GRAD(Rho)x 0.8512070E-09 GRAD(Rho)y 0.2457833E-08 GRAD(Rho)z 0.2487544E-08 Laplacian 0.7443246E+00 (-1/4)Del**2(Rho)) -0.1860811E+00 Diamond 0.2061100E+01 Metallicity 0.6080565E+01 Ellipticity 0.1930204E-02 Gb(Abramov) 0.3126338E+00 Vb(Abramov) -0.4391865E+00 Hb(Abramov) -0.1265527E+00 Ex_ueg -0.8362309E-01 Ec_ueg -0.1139673E-01 Delta_ex -0.8531515E-01 Delta_ec 0.1753455E-01 Delta_et -0.2402233E+00 Pxc 0.7337466E+01 Qxc -0.4865545E+01 3,-1 127 3 -1 0.390214 -0.519245 0.434263 Rho 0.1751413E+00 |GRAD(Rho)| 0.1164172E-13 GRAD(Rho)x -0.6519091E-14 GRAD(Rho)y 0.6623174E-14 GRAD(Rho)z -0.7011752E-14 Laplacian 0.4433215E+00 (-1/4)Del**2(Rho)) -0.1108304E+00 Diamond 0.1107851E+01 Metallicity 0.8522011E+01 Ellipticity 0.3848214E-02 Gb(Abramov) 0.2313032E+00 Vb(Abramov) -0.3517760E+00 Hb(Abramov) -0.1204728E+00 Ex_ueg -0.7237188E-01 Ec_ueg -0.1007190E-01 Delta_ex -0.4968442E-01 Delta_ec 0.1118503E-01 Delta_et -0.1528793E+00 Pxc 0.7185522E+01 Qxc -0.4442047E+01 3,-1 128 3 +3 -0.012232 -0.029732 2.288215 Rho 0.4632997E-02 |GRAD(Rho)| 0.6765849E-14 GRAD(Rho)x -0.4117253E-14 GRAD(Rho)y 0.4164175E-15 GRAD(Rho)z -0.5352713E-14 Laplacian 0.1888391E-01 (-1/4)Del**2(Rho)) -0.4720978E-02 Diamond 0.1475869E-03 Metallicity 0.4698485E+00 Ellipticity -0.2876461E+00 Gb(Abramov) 0.3517009E-02 Vb(Abramov) -0.2313041E-02 Hb(Abramov) 0.1203969E-02 Ex_ueg -0.5704283E-03 Ec_ueg -0.1311535E-03 Delta_ex -0.6683825E-03 Delta_ec 0.1360066E-03 Delta_et -0.9087490E-03 Pxc 0.4349318E+01 Qxc -0.4914339E+01 3,+3 129 3 -1 0.392015 0.419523 -0.525519 Rho 0.1772704E+00 |GRAD(Rho)| 0.1215710E-12 GRAD(Rho)x -0.7207776E-13 GRAD(Rho)y -0.6408415E-13 GRAD(Rho)z 0.7401024E-13 Laplacian 0.4464626E+00 (-1/4)Del**2(Rho)) -0.1116156E+00 Diamond 0.1129529E+01 Metallicity 0.8634193E+01 Ellipticity 0.6338658E-03 Gb(Abramov) 0.2350289E+00 Vb(Abramov) -0.3584422E+00 Hb(Abramov) -0.1234133E+00 Ex_ueg -0.7354728E-01 Ec_ueg -0.1021151E-01 Delta_ex -0.5016769E-01 Delta_ec 0.1119404E-01 Delta_et -0.1531233E+00 Pxc 0.7202392E+01 Qxc -0.4481643E+01 3,-1 130 3 +1 2.022541 -2.070486 2.073547 Rho 0.1176515E-01 |GRAD(Rho)| 0.4034845E-16 GRAD(Rho)x -0.2816689E-16 GRAD(Rho)y 0.2305493E-16 GRAD(Rho)z -0.1740959E-16 Laplacian 0.5398146E-01 (-1/4)Del**2(Rho)) -0.1349536E-01 Diamond 0.1751795E-02 Metallicity 0.7768985E+00 Ellipticity -0.1165503E+01 Gb(Abramov) 0.1074433E-01 Vb(Abramov) -0.7993297E-02 Hb(Abramov) 0.2751033E-02 Ex_ueg -0.1976279E-02 Ec_ueg -0.4487383E-03 Delta_ex -0.2534783E-02 Delta_ec 0.5134672E-03 Delta_et -0.3976928E-02 Pxc 0.4404079E+01 Qxc -0.4936601E+01 3,+1 131 3 -1 0.487260 1.680814 -1.775144 Rho 0.4987938E-01 |GRAD(Rho)| 0.5411864E-16 GRAD(Rho)x 0.2307932E-16 GRAD(Rho)y -0.4835753E-16 GRAD(Rho)z -0.7597462E-17 Laplacian 0.1960064E+00 (-1/4)Del**2(Rho)) -0.4900160E-01 Diamond 0.9854914E-01 Metallicity 0.2376173E+01 Ellipticity 0.3276859E-01 Gb(Abramov) 0.5207378E-01 Vb(Abramov) -0.5514596E-01 Hb(Abramov) -0.3072179E-02 Ex_ueg -0.1356063E-01 Ec_ueg -0.2408208E-02 Delta_ex -0.1610294E-01 Delta_ec 0.5802788E-02 Delta_et -0.6114005E-01 Pxc 0.5631004E+01 Qxc -0.2775036E+01 3,-1 132 3 -1 0.868737 2.036750 -3.014453 Rho 0.1524123E+00 |GRAD(Rho)| 0.3618349E-15 GRAD(Rho)x -0.3152589E-15 GRAD(Rho)y 0.1023351E-15 GRAD(Rho)z 0.1451340E-15 Laplacian 0.6055535E+00 (-1/4)Del**2(Rho)) -0.1513884E+00 Diamond 0.1237588E+01 Metallicity 0.4948732E+01 Ellipticity 0.5149439E-01 Gb(Abramov) 0.2257890E+00 Vb(Abramov) -0.3001897E+00 Hb(Abramov) -0.7440064E-01 Ex_ueg -0.6012823E-01 Ec_ueg -0.8598114E-02 Delta_ex -0.6515677E-01 Delta_ec 0.1507168E-01 Delta_et -0.2005282E+00 Pxc 0.6993188E+01 Qxc -0.4323126E+01 3,-1 133 3 +3 1.887959 -1.946117 1.925429 Rho 0.1161352E-01 |GRAD(Rho)| 0.1440368E-16 GRAD(Rho)x 0.2592380E-17 GRAD(Rho)y -0.8139798E-17 GRAD(Rho)z -0.1159695E-16 Laplacian 0.5275433E-01 (-1/4)Del**2(Rho)) -0.1318858E-01 Diamond 0.1209580E-02 Metallicity 0.7779674E+00 Ellipticity -0.7012427E+00 Gb(Abramov) 0.1050244E-01 Vb(Abramov) -0.7816289E-02 Hb(Abramov) 0.2686146E-02 Ex_ueg -0.1942391E-02 Ec_ueg -0.4417571E-03 Delta_ex -0.2325869E-02 Delta_ec 0.2473764E-03 Delta_et -0.2181955E-02 Pxc 0.4396967E+01 Qxc -0.9402146E+01 3,+3 134 3 +1 1.256256 -1.183640 2.183841 Rho 0.2498244E-01 |GRAD(Rho)| 0.6470121E-16 GRAD(Rho)x 0.2647417E-16 GRAD(Rho)y -0.3606023E-17 GRAD(Rho)z 0.5892675E-16 Laplacian 0.9711855E-01 (-1/4)Del**2(Rho)) -0.2427964E-01 Diamond 0.1307517E-01 Metallicity 0.1514848E+01 Ellipticity -0.4436909E+01 Gb(Abramov) 0.2231642E-01 Vb(Abramov) -0.2035320E-01 Hb(Abramov) 0.1963219E-02 Ex_ueg -0.5393842E-02 Ec_ueg -0.1087830E-02 Delta_ex -0.6081012E-02 Delta_ec 0.1722834E-02 Delta_et -0.1518777E-01 Pxc 0.4958349E+01 Qxc -0.3529657E+01 3,+1 135 3 -1 0.832505 -1.990066 3.059015 Rho 0.1348925E+00 |GRAD(Rho)| 0.2418547E-15 GRAD(Rho)x 0.1538618E-15 GRAD(Rho)y 0.1319610E-15 GRAD(Rho)z 0.1319339E-15 Laplacian 0.5249494E+00 (-1/4)Del**2(Rho)) -0.1312374E+00 Diamond 0.9357884E+00 Metallicity 0.4657384E+01 Ellipticity 0.4026289E-01 Gb(Abramov) 0.1893620E+00 Vb(Abramov) -0.2474867E+00 Hb(Abramov) -0.5812467E-01 Ex_ueg -0.5109387E-01 Ec_ueg -0.7483547E-02 Delta_ex -0.5492516E-01 Delta_ec 0.1365624E-01 Delta_et -0.1789314E+00 Pxc 0.6827493E+01 Qxc -0.4021982E+01 3,-1 136 3 +1 1.378882 -2.257840 1.022530 Rho 0.2451252E-01 |GRAD(Rho)| 0.1570836E-15 GRAD(Rho)x 0.8217366E-16 GRAD(Rho)y -0.7470059E-16 GRAD(Rho)z -0.1110971E-15 Laplacian 0.9245237E-01 (-1/4)Del**2(Rho)) -0.2311309E-01 Diamond 0.1001702E-01 Metallicity 0.1541731E+01 Ellipticity -0.2269832E+01 Gb(Abramov) 0.2134776E-01 Vb(Abramov) -0.1958242E-01 Hb(Abramov) 0.1765337E-02 Ex_ueg -0.5258991E-02 Ec_ueg -0.1064202E-02 Delta_ex -0.5524625E-02 Delta_ec 0.1220212E-02 Delta_et -0.1080486E-01 Pxc 0.4941723E+01 Qxc -0.4527592E+01 3,+1 137 3 +1 2.108703 2.046928 -2.041173 Rho 0.1127303E-01 |GRAD(Rho)| 0.1254737E-14 GRAD(Rho)x -0.7579964E-15 GRAD(Rho)y 0.9939892E-15 GRAD(Rho)z 0.1085851E-15 Laplacian 0.5115953E-01 (-1/4)Del**2(Rho)) -0.1278988E-01 Diamond 0.1641823E-02 Metallicity 0.7634034E+00 Ellipticity -0.1198882E+01 Gb(Abramov) 0.1015390E-01 Vb(Abramov) -0.7517908E-02 Hb(Abramov) 0.2635988E-02 Ex_ueg -0.1866834E-02 Ec_ueg -0.4261142E-03 Delta_ex -0.2398368E-02 Delta_ec 0.5295473E-03 Delta_et -0.4016994E-02 Pxc 0.4381065E+01 Qxc -0.4529091E+01 3,+1 138 3 -1 1.624169 -1.838175 0.440347 Rho 0.4027505E-01 |GRAD(Rho)| 0.3183280E-13 GRAD(Rho)x 0.1940398E-13 GRAD(Rho)y -0.2242225E-13 GRAD(Rho)z -0.1157824E-13 Laplacian 0.1683239E+00 (-1/4)Del**2(Rho)) -0.4208099E-01 Diamond 0.6926772E-01 Metallicity 0.1937288E+01 Ellipticity 0.7803540E-02 Gb(Abramov) 0.4164115E-01 Vb(Abramov) -0.4120132E-01 Hb(Abramov) 0.4398324E-03 Ex_ueg -0.1019608E-01 Ec_ueg -0.1884825E-02 Delta_ex -0.1345298E-01 Delta_ec 0.5606076E-02 Delta_et -0.5588732E-01 Pxc 0.5409564E+01 Qxc -0.2399714E+01 3,-1 139 3 -1 3.040923 0.807661 -2.033871 Rho 0.5996808E-01 |GRAD(Rho)| 0.2600551E-15 GRAD(Rho)x -0.4654870E-16 GRAD(Rho)y -0.2137522E-15 GRAD(Rho)z -0.1406126E-15 Laplacian 0.2524394E+00 (-1/4)Del**2(Rho)) -0.6310984E-01 Diamond 0.1735428E+00 Metallicity 0.2507974E+01 Ellipticity 0.7416387E-02 Gb(Abramov) 0.6845286E-01 Vb(Abramov) -0.7379588E-01 Hb(Abramov) -0.5343022E-02 Ex_ueg -0.1733585E-01 Ec_ueg -0.2972860E-02 Delta_ex -0.2208670E-01 Delta_ec 0.8096875E-02 Delta_et -0.8973371E-01 Pxc 0.5831373E+01 Qxc -0.2727805E+01 3,-1 140 3 -1 1.710347 -0.568030 1.705937 Rho 0.4039846E-01 |GRAD(Rho)| 0.4043236E-16 GRAD(Rho)x -0.2511919E-16 GRAD(Rho)y -0.2887144E-16 GRAD(Rho)z 0.1304770E-16 Laplacian 0.1568658E+00 (-1/4)Del**2(Rho)) -0.3921645E-01 Diamond 0.5809852E-01 Metallicity 0.2089422E+01 Ellipticity 0.7126303E-01 Gb(Abramov) 0.3980092E-01 Vb(Abramov) -0.4038540E-01 Hb(Abramov) -0.5844719E-03 Ex_ueg -0.1023776E-01 Ec_ueg -0.1891451E-02 Delta_ex -0.1216146E-01 Delta_ec 0.4536930E-02 Delta_et -0.4519232E-01 Pxc 0.5412649E+01 Qxc -0.2680548E+01 3,-1 141 3 +3 2.384582 -0.018551 -0.042968 Rho 0.3445397E-02 |GRAD(Rho)| 0.1190374E-17 GRAD(Rho)x 0.6359072E-18 GRAD(Rho)y -0.7726825E-19 GRAD(Rho)z 0.1003315E-17 Laplacian 0.1386477E-01 (-1/4)Del**2(Rho)) -0.3466192E-02 Diamond 0.9421589E-04 Metallicity 0.3906304E+00 Ellipticity -0.1934916E+00 Gb(Abramov) 0.2536462E-02 Vb(Abramov) -0.1606731E-02 Hb(Abramov) 0.9297308E-03 Ex_ueg -0.3843299E-03 Ec_ueg -0.8063788E-04 Delta_ex -0.4874281E-03 Delta_ec 0.1590715E-03 Delta_et -0.8871390E-03 Pxc 0.4766121E+01 Qxc -0.3064208E+01 3,+3 142 3 +1 2.966292 -0.016526 -0.064888 Rho 0.3876612E-02 |GRAD(Rho)| 0.1158210E-16 GRAD(Rho)x -0.1598009E-18 GRAD(Rho)y -0.8734412E-17 GRAD(Rho)z -0.7604582E-17 Laplacian 0.1500534E-01 (-1/4)Del**2(Rho)) -0.3751335E-02 Diamond 0.2561036E-03 Metallicity 0.4393270E+00 Ellipticity -0.3141363E+01 Gb(Abramov) 0.2775567E-02 Vb(Abramov) -0.1799799E-02 Hb(Abramov) 0.9757680E-03 Ex_ueg -0.4497676E-03 Ec_ueg -0.9889386E-04 Delta_ex -0.7207487E-03 Delta_ec 0.4899386E-03 Delta_et -0.2457322E-02 Pxc 0.4547983E+01 Qxc -0.1471100E+01 3,+1 143 3 +1 1.526625 0.873822 -2.221730 Rho 0.2325793E-01 |GRAD(Rho)| 0.3064629E-15 GRAD(Rho)x 0.1994501E-15 GRAD(Rho)y -0.1797914E-15 GRAD(Rho)z -0.1476963E-15 Laplacian 0.8821428E-01 (-1/4)Del**2(Rho)) -0.2205357E-01 Diamond 0.8247320E-02 Metallicity 0.1480332E+01 Ellipticity -0.1911543E+01 Gb(Abramov) 0.2014348E-01 Vb(Abramov) -0.1823339E-01 Hb(Abramov) 0.1910088E-02 Ex_ueg -0.4903201E-02 Ec_ueg -0.1001410E-02 Delta_ex -0.5118968E-02 Delta_ec 0.1027546E-02 Delta_et -0.9042498E-02 Pxc 0.4896299E+01 Qxc -0.4981739E+01 3,+1 144 3 +1 2.197211 0.905712 -1.567667 Rho 0.1906579E-01 |GRAD(Rho)| 0.4587862E-14 GRAD(Rho)x 0.3308557E-15 GRAD(Rho)y -0.3018627E-14 GRAD(Rho)z -0.3439027E-14 Laplacian 0.6932547E-01 (-1/4)Del**2(Rho)) -0.1733137E-01 Diamond 0.4717141E-02 Metallicity 0.1352525E+01 Ellipticity -0.1751083E+01 Gb(Abramov) 0.1546109E-01 Vb(Abramov) -0.1359082E-01 Hb(Abramov) 0.1870273E-02 Ex_ueg -0.3761764E-02 Ec_ueg -0.7948477E-03 Delta_ex -0.3774869E-02 Delta_ec 0.7507060E-03 Delta_et -0.6362864E-02 Pxc 0.4732686E+01 Qxc -0.5028425E+01 3,+1 145 3 +3 1.954902 1.871394 -1.900387 Rho 0.1105095E-01 |GRAD(Rho)| 0.5496819E-14 GRAD(Rho)x -0.3689967E-14 GRAD(Rho)y -0.2829201E-14 GRAD(Rho)z 0.2931685E-14 Laplacian 0.4975352E-01 (-1/4)Del**2(Rho)) -0.1243838E-01 Diamond 0.1075203E-02 Metallicity 0.7593738E+00 Ellipticity -0.6096358E+00 Gb(Abramov) 0.9866484E-02 Vb(Abramov) -0.7294587E-02 Hb(Abramov) 0.2571897E-02 Ex_ueg -0.1817962E-02 Ec_ueg -0.4159369E-03 Delta_ex -0.2165634E-02 Delta_ec 0.2395054E-03 Delta_et -0.2085214E-02 Pxc 0.4370764E+01 Qxc -0.9042108E+01 3,+3 146 3 -1 1.814802 0.525452 2.779859 Rho 0.1492361E+00 |GRAD(Rho)| 0.8158541E-15 GRAD(Rho)x -0.6329843E-15 GRAD(Rho)y 0.5051027E-15 GRAD(Rho)z 0.9909608E-16 Laplacian 0.6163988E+00 (-1/4)Del**2(Rho)) -0.1540997E+00 Diamond 0.1227070E+01 Metallicity 0.4693978E+01 Ellipticity 0.9907658E-02 Gb(Abramov) 0.2232899E+00 Vb(Abramov) -0.2924801E+00 Hb(Abramov) -0.6919021E-01 Ex_ueg -0.5846332E-01 Ec_ueg -0.8394630E-02 Delta_ex -0.6596775E-01 Delta_ec 0.1540099E-01 Delta_et -0.2042802E+00 Pxc 0.6964372E+01 Qxc -0.4283345E+01 3,-1 147 3 -1 2.038986 0.844154 -3.095613 Rho 0.1006730E+00 |GRAD(Rho)| 0.4079190E-14 GRAD(Rho)x 0.3705850E-14 GRAD(Rho)y -0.8485508E-15 GRAD(Rho)z -0.1478655E-14 Laplacian 0.4137761E+00 (-1/4)Del**2(Rho)) -0.1034440E+00 Diamond 0.5373266E+00 Metallicity 0.3628294E+01 Ellipticity 0.1340620E-01 Gb(Abramov) 0.1315169E+00 Vb(Abramov) -0.1595898E+00 Hb(Abramov) -0.2807287E-01 Ex_ueg -0.3458880E-01 Ec_ueg -0.5365835E-02 Delta_ex -0.4070065E-01 Delta_ec 0.1208169E-01 Delta_et -0.1509717E+00 Pxc 0.6446116E+01 Qxc -0.3368789E+01 3,-1 148 3 -1 1.721124 1.718080 -0.581669 Rho 0.3489031E-01 |GRAD(Rho)| 0.4247280E-16 GRAD(Rho)x -0.2321569E-16 GRAD(Rho)y -0.1523050E-16 GRAD(Rho)z -0.3214035E-16 Laplacian 0.1327892E+00 (-1/4)Del**2(Rho)) -0.3319731E-01 Diamond 0.3975299E-01 Metallicity 0.1933266E+01 Ellipticity 0.5345416E-01 Gb(Abramov) 0.3282808E-01 Vb(Abramov) -0.3245885E-01 Hb(Abramov) 0.3692288E-03 Ex_ueg -0.8420247E-02 Ec_ueg -0.1598505E-02 Delta_ex -0.9889706E-02 Delta_ec 0.3777337E-02 Delta_et -0.3616543E-01 Pxc 0.5267575E+01 Qxc -0.2618169E+01 3,-1 149 3 -1 2.015762 3.034579 -0.851982 Rho 0.1531959E+00 |GRAD(Rho)| 0.9264679E-14 GRAD(Rho)x 0.3822721E-14 GRAD(Rho)y 0.4346865E-14 GRAD(Rho)z 0.7233661E-14 Laplacian 0.5924464E+00 (-1/4)Del**2(Rho)) -0.1481116E+00 Diamond 0.1233963E+01 Metallicity 0.5101632E+01 Ellipticity 0.4795575E-01 Gb(Abramov) 0.2246762E+00 Vb(Abramov) -0.3012408E+00 Hb(Abramov) -0.7656461E-01 Ex_ueg -0.6054074E-01 Ec_ueg -0.8648408E-02 Delta_ex -0.6397921E-01 Delta_ec 0.1499764E-01 Delta_et -0.2003330E+00 Pxc 0.7000218E+01 Qxc -0.4265953E+01 3,-1 150 3 -1 1.842070 2.793442 0.551132 Rho 0.1431682E+00 |GRAD(Rho)| 0.6516038E-15 GRAD(Rho)x -0.3109356E-15 GRAD(Rho)y 0.4608130E-15 GRAD(Rho)z -0.3399380E-15 Laplacian 0.6023920E+00 (-1/4)Del**2(Rho)) -0.1505980E+00 Diamond 0.1142703E+01 Metallicity 0.4482066E+01 Ellipticity 0.1106406E-01 Gb(Abramov) 0.2128970E+00 Vb(Abramov) -0.2751960E+00 Hb(Abramov) -0.6229902E-01 Ex_ueg -0.5531554E-01 Ec_ueg -0.8007624E-02 Delta_ex -0.6383379E-01 Delta_ec 0.1524189E-01 Delta_et -0.2010791E+00 Pxc 0.6907858E+01 Qxc -0.4188049E+01 3,-1 151 3 -1 1.988467 -0.855359 3.019937 Rho 0.1282055E+00 |GRAD(Rho)| 0.3210116E-15 GRAD(Rho)x -0.2734968E-15 GRAD(Rho)y -0.1627252E-15 GRAD(Rho)z 0.4205349E-16 Laplacian 0.4995791E+00 (-1/4)Del**2(Rho)) -0.1248948E+00 Diamond 0.8393745E+00 Metallicity 0.4496282E+01 Ellipticity 0.3610516E-01 Gb(Abramov) 0.1768569E+00 Vb(Abramov) -0.2288190E+00 Hb(Abramov) -0.5196211E-01 Ex_ueg -0.4774495E-01 Ec_ueg -0.7063322E-02 Delta_ex -0.5165224E-01 Delta_ec 0.1319041E-01 Delta_et -0.1714883E+00 Pxc 0.6759560E+01 Qxc -0.3915894E+01 3,-1 152 3 -1 2.055228 -0.632214 -3.308561 Rho 0.1991578E+00 |GRAD(Rho)| 0.5464113E-15 GRAD(Rho)x 0.4090695E-15 GRAD(Rho)y 0.3487878E-15 GRAD(Rho)z 0.9784925E-16 Laplacian 0.7714499E+00 (-1/4)Del**2(Rho)) -0.1928625E+00 Diamond 0.2186108E+01 Metallicity 0.6066911E+01 Ellipticity 0.1484666E-02 Gb(Abramov) 0.3235882E+00 Vb(Abramov) -0.4543140E+00 Hb(Abramov) -0.1307258E+00 Ex_ueg -0.8589769E-01 Ec_ueg -0.1166168E-01 Delta_ex -0.8886266E-01 Delta_ec 0.1804489E-01 Delta_et -0.2475329E+00 Pxc 0.7365811E+01 Qxc -0.4924533E+01 3,-1 153 3 -1 2.985486 -0.863107 2.002987 Rho 0.1723171E+00 |GRAD(Rho)| 0.5205267E-15 GRAD(Rho)x -0.2556549E-15 GRAD(Rho)y 0.4175263E-15 GRAD(Rho)z 0.1768063E-15 Laplacian 0.6729705E+00 (-1/4)Del**2(Rho)) -0.1682426E+00 Diamond 0.1592269E+01 Metallicity 0.5463837E+01 Ellipticity 0.4572680E-01 Gb(Abramov) 0.2653701E+00 Vb(Abramov) -0.3624976E+00 Hb(Abramov) -0.9712751E-01 Ex_ueg -0.7082005E-01 Ec_ueg -0.9887121E-02 Delta_ex -0.7464573E-01 Delta_ec 0.1620793E-01 Delta_et -0.2188078E+00 Pxc 0.7162858E+01 Qxc -0.4605506E+01 3,-1 154 3 -1 2.810379 0.569379 1.820404 Rho 0.1464004E+00 |GRAD(Rho)| 0.4423127E-15 GRAD(Rho)x -0.1092266E-15 GRAD(Rho)y -0.4283818E-15 GRAD(Rho)z -0.1410818E-16 Laplacian 0.6067203E+00 (-1/4)Del**2(Rho)) -0.1516801E+00 Diamond 0.1189519E+01 Metallicity 0.4618793E+01 Ellipticity 0.2233135E-01 Gb(Abramov) 0.2178832E+00 Vb(Abramov) -0.2840863E+00 Hb(Abramov) -0.6620311E-01 Ex_ueg -0.5698686E-01 Ec_ueg -0.8213488E-02 Delta_ex -0.6472097E-01 Delta_ec 0.1540137E-01 Delta_et -0.2041306E+00 Pxc 0.6938205E+01 Qxc -0.4202288E+01 3,-1 155 3 -1 2.817535 1.834627 0.574359 Rho 0.1212617E+00 |GRAD(Rho)| 0.3798134E-15 GRAD(Rho)x -0.8579089E-16 GRAD(Rho)y 0.1285593E-15 GRAD(Rho)z -0.3469447E-15 Laplacian 0.4982266E+00 (-1/4)Del**2(Rho)) -0.1245566E+00 Diamond 0.7827568E+00 Metallicity 0.4108902E+01 Ellipticity 0.1029314E-01 Gb(Abramov) 0.1683363E+00 Vb(Abramov) -0.2121159E+00 Hb(Abramov) -0.4377962E-01 Ex_ueg -0.4432853E-01 Ec_ueg -0.6630120E-02 Delta_ex -0.5082761E-01 Delta_ec 0.1332508E-01 Delta_et -0.1716112E+00 Pxc 0.6685932E+01 Qxc -0.3814432E+01 3,-1 156 3 -1 2.772654 -0.701813 -1.965516 Rho 0.1268966E+00 |GRAD(Rho)| 0.3381883E-15 GRAD(Rho)x -0.1761015E-15 GRAD(Rho)y -0.2394054E-15 GRAD(Rho)z 0.1613835E-15 Laplacian 0.5342390E+00 (-1/4)Del**2(Rho)) -0.1335597E+00 Diamond 0.9080633E+00 Metallicity 0.4133273E+01 Ellipticity 0.7812508E-02 Gb(Abramov) 0.1810463E+00 Vb(Abramov) -0.2285329E+00 Hb(Abramov) -0.4748656E-01 Ex_ueg -0.4709610E-01 Ec_ueg -0.6981410E-02 Delta_ex -0.5536683E-01 Delta_ec 0.1461689E-01 Delta_et -0.1905665E+00 Pxc 0.6745929E+01 Qxc -0.3787865E+01 3,-1 157 3 -1 3.047682 2.033767 -0.809759 Rho 0.1858769E+00 |GRAD(Rho)| 0.6044909E-11 GRAD(Rho)x 0.2850570E-11 GRAD(Rho)y -0.3360531E-11 GRAD(Rho)z -0.4137874E-11 Laplacian 0.7244150E+00 (-1/4)Del**2(Rho)) -0.1811038E+00 Diamond 0.1881771E+01 Metallicity 0.5758838E+01 Ellipticity 0.3387998E-01 Gb(Abramov) 0.2945604E+00 Vb(Abramov) -0.4080170E+00 Hb(Abramov) -0.1134566E+00 Ex_ueg -0.7834641E-01 Ec_ueg -0.1077850E-01 Delta_ex -0.8193621E-01 Delta_ec 0.1716086E-01 Delta_et -0.2336441E+00 Pxc 0.7268768E+01 Qxc -0.4774597E+01 3,-1 158 3 +1 1.281399 2.153970 -1.171433 Rho 0.2433402E-01 |GRAD(Rho)| 0.1372758E-13 GRAD(Rho)x 0.7111555E-14 GRAD(Rho)y 0.1174097E-13 GRAD(Rho)z 0.1478813E-15 Laplacian 0.9434048E-01 (-1/4)Del**2(Rho)) -0.2358512E-01 Diamond 0.1247774E-01 Metallicity 0.1492582E+01 Ellipticity -0.4881574E+01 Gb(Abramov) 0.2159053E-01 Vb(Abramov) -0.1959595E-01 Hb(Abramov) 0.1994585E-02 Ex_ueg -0.5207991E-02 Ec_ueg -0.1055242E-02 Delta_ex -0.5891679E-02 Delta_ec 0.1719325E-02 Delta_et -0.1504700E-01 Pxc 0.4935353E+01 Qxc -0.3426739E+01 3,+1 159 3 -1 3.217192 0.046577 3.208959 Rho 0.2213989E+00 |GRAD(Rho)| 0.7555529E-14 GRAD(Rho)x -0.5279522E-15 GRAD(Rho)y 0.5064485E-14 GRAD(Rho)z 0.5581961E-14 Laplacian 0.8128205E+00 (-1/4)Del**2(Rho)) -0.2032051E+00 Diamond 0.2618463E+01 Metallicity 0.6869273E+01 Ellipticity 0.7764477E-02 Gb(Abramov) 0.3681154E+00 Vb(Abramov) -0.5330256E+00 Hb(Abramov) -0.1649102E+00 Ex_ueg -0.9892033E-01 Ec_ueg -0.1316276E-01 Delta_ex -0.9622442E-01 Delta_ec 0.1848486E-01 Delta_et -0.2555351E+00 Pxc 0.7515169E+01 Qxc -0.5205581E+01 3,-1 160 3 -1 3.431044 -0.006264 -3.257534 Rho 0.1874417E+00 |GRAD(Rho)| 0.8960496E-13 GRAD(Rho)x -0.7665667E-13 GRAD(Rho)y -0.2125890E-14 GRAD(Rho)z 0.4634959E-13 Laplacian 0.6969301E+00 (-1/4)Del**2(Rho)) -0.1742325E+00 Diamond 0.1857298E+01 Metallicity 0.6070170E+01 Ellipticity 0.2224667E-01 Gb(Abramov) 0.2924252E+00 Vb(Abramov) -0.4106178E+00 Hb(Abramov) -0.1181927E+00 Ex_ueg -0.7922700E-01 Ec_ueg -0.1088204E-01 Delta_ex -0.7920681E-01 Delta_ec 0.1685058E-01 Delta_et -0.2308076E+00 Pxc 0.7280532E+01 Qxc -0.4700538E+01 3,-1 161 3 -1 -3.272691 3.226540 -0.096271 Rho 0.1916290E+00 |GRAD(Rho)| 0.4794045E-15 GRAD(Rho)x 0.3159907E-15 GRAD(Rho)y -0.2831394E-15 GRAD(Rho)z 0.2231830E-15 Laplacian 0.7328310E+00 (-1/4)Del**2(Rho)) -0.1832078E+00 Diamond 0.1984240E+01 Metallicity 0.5989325E+01 Ellipticity 0.6149968E-02 Gb(Abramov) 0.3050203E+00 Vb(Abramov) -0.4268329E+00 Hb(Abramov) -0.1218126E+00 Ex_ueg -0.8159557E-01 Ec_ueg -0.1115979E-01 Delta_ex -0.8360090E-01 Delta_ec 0.1734175E-01 Delta_et -0.2371691E+00 Pxc 0.7311570E+01 Qxc -0.4820789E+01 3,-1 162 3 +1 -2.247774 1.326994 1.202149 Rho 0.2467775E-01 |GRAD(Rho)| 0.6728680E-14 GRAD(Rho)x -0.6375939E-14 GRAD(Rho)y 0.2081326E-14 GRAD(Rho)z 0.5390861E-15 Laplacian 0.8956032E-01 (-1/4)Del**2(Rho)) -0.2239008E-01 Diamond 0.1160141E-01 Metallicity 0.1609435E+01 Ellipticity -0.6147181E+01 Gb(Abramov) 0.2093262E-01 Vb(Abramov) -0.1947515E-01 Hb(Abramov) 0.1457465E-02 Ex_ueg -0.5306307E-02 Ec_ueg -0.1072503E-02 Delta_ex -0.5561432E-02 Delta_ec 0.1538563E-02 Delta_et -0.1353358E-01 Pxc 0.4947592E+01 Qxc -0.3614692E+01 3,+1 163 3 -1 -2.808677 -0.549607 1.863101 Rho 0.1017616E+00 |GRAD(Rho)| 0.1977956E-13 GRAD(Rho)x 0.3789788E-14 GRAD(Rho)y 0.1228416E-13 GRAD(Rho)z 0.1503223E-13 Laplacian 0.4406369E+00 (-1/4)Del**2(Rho)) -0.1101592E+00 Diamond 0.5825543E+00 Metallicity 0.3468746E+01 Ellipticity 0.1636803E-01 Gb(Abramov) 0.1371252E+00 Vb(Abramov) -0.1640912E+00 Hb(Abramov) -0.2696598E-01 Ex_ueg -0.3508842E-01 Ec_ueg -0.5431889E-02 Delta_ex -0.4349840E-01 Delta_ec 0.1292177E-01 Delta_et -0.1619276E+00 Pxc 0.6459709E+01 Qxc -0.3366287E+01 3,-1 164 3 -1 -2.035434 3.039113 0.874553 Rho 0.1046169E+00 |GRAD(Rho)| 0.7548980E-16 GRAD(Rho)x 0.4379499E-16 GRAD(Rho)y -0.5878409E-16 GRAD(Rho)z 0.1803164E-16 Laplacian 0.4301015E+00 (-1/4)Del**2(Rho)) -0.1075254E+00 Diamond 0.5746893E+00 Metallicity 0.3721449E+01 Ellipticity 0.3848192E-02 Gb(Abramov) 0.1383753E+00 Vb(Abramov) -0.1692252E+00 Hb(Abramov) -0.3084991E-01 Ex_ueg -0.3640723E-01 Ec_ueg -0.5605567E-02 Delta_ex -0.4251722E-01 Delta_ec 0.1215673E-01 Delta_et -0.1527244E+00 Pxc 0.6494834E+01 Qxc -0.3497422E+01 3,-1 165 3 -1 -0.875143 3.072205 2.033456 Rho 0.1374153E+00 |GRAD(Rho)| 0.9125901E-14 GRAD(Rho)x -0.4387875E-14 GRAD(Rho)y -0.7800943E-14 GRAD(Rho)z 0.1781547E-14 Laplacian 0.5472904E+00 (-1/4)Del**2(Rho)) -0.1368226E+00 Diamond 0.1015523E+01 Metallicity 0.4607379E+01 Ellipticity 0.1934153E-01 Gb(Abramov) 0.1962807E+00 Vb(Abramov) -0.2557387E+00 Hb(Abramov) -0.5945806E-01 Ex_ueg -0.5237193E-01 Ec_ueg -0.7642847E-02 Delta_ex -0.5772169E-01 Delta_ec 0.1453249E-01 Delta_et -0.1916877E+00 Pxc 0.6852412E+01 Qxc -0.3971905E+01 3,-1 166 3 -1 -0.717414 -3.541681 -1.180300 Rho 0.2785284E+00 |GRAD(Rho)| 0.7291193E-15 GRAD(Rho)x -0.2441170E-15 GRAD(Rho)y 0.6595062E-15 GRAD(Rho)z 0.1925449E-15 Laplacian -0.1295760E+01 (-1/4)Del**2(Rho)) 0.3239400E+00 Diamond 0.4145172E+01 Metallicity -0.6317391E+01 Ellipticity 0.3331607E-02 Gb(Abramov) 0.1251159E+00 Vb(Abramov) -0.5741718E+00 Hb(Abramov) -0.4490559E+00 Ex_ueg -0.1343417E+00 Ec_ueg -0.1714310E-01 Delta_ex 0.1207924E+00 Delta_ec 0.4768633E-01 Delta_et -0.1060862E+01 Pxc 0.7836489E+01 Qxc 0.2533061E+01 3,-1 167 3 -1 2.687816 -1.957628 -0.690323 Rho 0.1298912E+00 |GRAD(Rho)| 0.2248864E-15 GRAD(Rho)x 0.8510987E-16 GRAD(Rho)y 0.1877025E-15 GRAD(Rho)z -0.8998878E-16 Laplacian 0.5498563E+00 (-1/4)Del**2(Rho)) -0.1374641E+00 Diamond 0.9587539E+00 Metallicity 0.4175065E+01 Ellipticity 0.6887840E-02 Gb(Abramov) 0.1872963E+00 Vb(Abramov) -0.2371285E+00 Hb(Abramov) -0.4983222E-01 Ex_ueg -0.4858377E-01 Ec_ueg -0.7168972E-02 Delta_ex -0.5727442E-01 Delta_ec 0.1491000E-01 Delta_et -0.1950722E+00 Pxc 0.6776950E+01 Qxc -0.3841344E+01 3,-1 168 3 -1 2.908831 -2.074469 0.801360 Rho 0.7064070E-01 |GRAD(Rho)| 0.1161387E-15 GRAD(Rho)x -0.1065042E-15 GRAD(Rho)y 0.2550077E-16 GRAD(Rho)z 0.3866197E-16 Laplacian 0.2933069E+00 (-1/4)Del**2(Rho)) -0.7332673E-01 Diamond 0.2459712E+00 Metallicity 0.2836063E+01 Ellipticity 0.5121572E-02 Gb(Abramov) 0.8354435E-01 Vb(Abramov) -0.9376197E-01 Hb(Abramov) -0.1021762E-01 Ex_ueg -0.2156710E-01 Ec_ueg -0.3584143E-02 Delta_ex -0.2658697E-01 Delta_ec 0.9110073E-02 Delta_et -0.1051082E+00 Pxc 0.6017364E+01 Qxc -0.2918415E+01 3,-1 169 3 -1 3.153015 -3.346290 -0.097294 Rho 0.1897612E+00 |GRAD(Rho)| 0.5305740E-15 GRAD(Rho)x 0.4762900E-15 GRAD(Rho)y -0.2306098E-15 GRAD(Rho)z -0.3841464E-16 Laplacian 0.7183270E+00 (-1/4)Del**2(Rho)) -0.1795817E+00 Diamond 0.1932243E+01 Metallicity 0.6011323E+01 Ellipticity 0.1073887E-01 Gb(Abramov) 0.2996418E+00 Vb(Abramov) -0.4197019E+00 Hb(Abramov) -0.1200601E+00 Ex_ueg -0.8053692E-01 Ec_ueg -0.1103577E-01 Delta_ex -0.8181582E-01 Delta_ec 0.1717376E-01 Delta_et -0.2350828E+00 Pxc 0.7297804E+01 Qxc -0.4764003E+01 3,-1 170 3 -1 3.225413 3.258841 0.073102 Rho 0.2211206E+00 |GRAD(Rho)| 0.1368467E-10 GRAD(Rho)x 0.9201001E-11 GRAD(Rho)y 0.9676483E-11 GRAD(Rho)z 0.2996253E-11 Laplacian 0.8065596E+00 (-1/4)Del**2(Rho)) -0.2016399E+00 Diamond 0.2597423E+01 Metallicity 0.6908099E+01 Ellipticity 0.9599376E-02 Gb(Abramov) 0.3665847E+00 Vb(Abramov) -0.5315294E+00 Hb(Abramov) -0.1649448E+00 Ex_ueg -0.9875457E-01 Ec_ueg -0.1314380E-01 Delta_ex -0.9547034E-01 Delta_ec 0.1838146E-01 Delta_et -0.2542155E+00 Pxc 0.7513394E+01 Qxc -0.5193839E+01 3,-1 171 3 -1 1.697426 -3.125251 -0.583377 Rho 0.1818092E+00 |GRAD(Rho)| 0.1068095E-13 GRAD(Rho)x 0.5945819E-14 GRAD(Rho)y 0.8214160E-14 GRAD(Rho)z -0.3355226E-14 Laplacian 0.7177990E+00 (-1/4)Del**2(Rho)) -0.1794497E+00 Diamond 0.1826204E+01 Metallicity 0.5601489E+01 Ellipticity 0.1823218E-01 Gb(Abramov) 0.2871641E+00 Vb(Abramov) -0.3948785E+00 Hb(Abramov) -0.1077144E+00 Ex_ueg -0.7606875E-01 Ec_ueg -0.1050999E-01 Delta_ex -0.8081581E-01 Delta_ec 0.1724966E-01 Delta_et -0.2347958E+00 Pxc 0.7237754E+01 Qxc -0.4685066E+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 78 121 104 135 58 119 127 53 129 102 131 108 113 132 116 125 109 123 124 110 165 126 138 167 171 168 120 169 148 155 150 157 149 170 111 73 99 74 164 161 54 75 97 72 94 71 56 67 80 59 77 62 86 163 79 69 87 65 140 154 146 153 151 159 107 156 152 139 147 160 63 83 115 117 166 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 17 21 22 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 19 36 24 52 52 2.414177 1.917260 1.908084 1.967335 1.904070 1.773267 1.726356 1.697311 1.721498 1.726211 2.370557 1.877017 1.898319 1.918504 2.052532 1.774737 2.413331 2.031106 1.996781 2.018180 1.958426 1.822063 2.446793 1.967013 1.847210 2.221256 2.094499 1.833379 2.524105 1.998725 1.934879 1.842711 1.916509 1.774604 2.413070 1.896853 2.056161 2.016958 2.065277 1.829160 2.318780 1.888704 2.027281 1.890098 1.950404 1.772914 2.411843 2.129132 2.074463 2.093904 1.830358 1.835021 2.411164 2.061758 2.020208 1.975508 1.967441 1.817462 2.459444 1.923719 1.920444 1.872703 1.987207 1.773979 2.564024 1.976126 1.814288 2.286469 2.074885 1.838971 3.273870 3.513309 3.231244 1.586324 1.038397 2.415820 1.917613 1.908616 1.967835 1.904523 1.773272 1.726372 1.697381 1.721523 1.726216 2.372435 1.877312 1.898690 1.919011 2.052963 1.774743 2.415545 2.031330 1.997057 2.018438 1.958655 1.822072 2.448928 1.967181 1.847305 2.221490 2.094740 1.833385 2.525614 1.999158 1.935292 1.843060 1.916965 1.774611 2.414636 1.897032 2.056328 2.017182 2.065517 1.829164 2.320999 1.889106 2.027642 1.890503 1.951429 1.772928 2.414431 2.129317 2.074641 2.094146 1.830377 1.835032 2.413239 2.061977 2.020511 1.975785 1.967684 1.817472 2.461026 1.924207 1.920846 1.873094 1.987664 1.773981 2.566448 1.976280 1.814323 2.286763 2.075136 1.838985 3.278228 3.513788 3.233979 1.588140 1.038513 31 27 28 27 26 23 25 24 25 22 28 26 27 25 27 23 32 27 26 26 24 27 29 25 22 25 28 23 29 25 26 23 25 24 31 26 27 26 24 23 30 25 26 27 27 24 30 28 27 28 27 27 31 24 30 28 30 24 29 26 25 25 26 22 32 25 23 27 25 22 35 37 35 23 17 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 W As W Ta Ta W Ta W Ta Ta W Ta O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O H 2.3729 2.4147 2.3684 2.1365 2.0313 2.3404 2.0930 2.3859 2.0186 2.1319 2.3632 1.9843 -1.1040 -1.0179 -1.0829 -1.1078 -0.9763 -1.0517 -1.0085 -0.9857 -0.9728 -0.9898 -0.9855 -0.9893 -0.9850 -0.9790 -0.9976 -0.9821 -0.9917 -1.0196 -0.9667 -1.0596 -1.0143 -1.0283 -1.0568 -0.9957 -0.8671 -1.0625 -1.0154 -1.0106 -0.9049 -1.0387 -0.9076 -1.0071 -1.0289 -0.9104 -1.0197 -0.8955 -1.0281 -0.9967 -0.9077 0.3085 2.1149 0.8639 2.1232 2.1234 2.1541 2.1262 2.1352 2.1355 2.1576 2.1277 2.1206 2.1652 1.9372 1.9476 1.9409 1.9323 1.9280 1.9195 1.9240 1.9253 1.9320 1.9254 1.9277 1.9254 1.9268 1.9261 1.9241 1.9305 1.9362 1.9328 1.9391 1.9248 1.9309 1.9303 1.9250 1.9272 1.8712 1.9246 1.9313 1.9315 1.9472 1.9269 1.9474 1.9305 1.9285 1.9465 1.9291 1.9473 1.9264 1.9322 1.9469 0.5212 6.1071 1.1808 6.1118 6.0855 6.1064 6.1137 6.0939 6.1085 6.1041 6.0892 6.1083 6.1100 5.1318 5.0348 5.1075 5.1415 5.0214 5.1092 5.0611 5.0324 5.0163 5.0387 5.0306 5.0378 5.0316 5.0243 5.0477 5.0272 5.0296 5.0587 5.0002 5.1103 5.0550 5.0714 5.1069 5.0463 4.9690 5.1146 5.0569 5.0505 4.9278 5.0903 4.9306 5.0537 5.0785 4.9342 5.0684 4.9185 5.0798 5.0411 4.9310 0.1703 3.3750 10.5407 3.3667 2.6196 2.6748 3.3901 2.6430 3.3405 2.6862 2.6164 3.3782 2.7082 0.0351 0.0356 0.0345 0.0340 0.0269 0.0230 0.0233 0.0281 0.0245 0.0257 0.0272 0.0262 0.0266 0.0286 0.0258 0.0244 0.0260 0.0280 0.0274 0.0245 0.0285 0.0265 0.0248 0.0222 0.0270 0.0233 0.0273 0.0286 0.0298 0.0216 0.0296 0.0230 0.0219 0.0297 0.0222 0.0297 0.0218 0.0234 0.0297 0.0000 14.0301 0.0000 14.0298 14.0351 14.0334 14.0297 14.0349 14.0296 14.0336 14.0349 14.0298 14.0324 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 W As W Ta Ta W Ta W Ta Ta W Ta O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O H 2.490560 2.305123 2.489541 2.352844 2.320060 2.481090 2.337743 2.512160 2.339547 2.353323 2.485385 2.302824 -1.087013 -1.039789 -1.079706 -1.099746 -1.020136 -1.093654 -1.082040 -1.018557 -1.084850 -1.038861 -1.023803 -1.034691 -1.033474 -1.008476 -1.043017 -0.966357 -1.035837 -1.029826 -1.022817 -1.099942 -1.030503 -1.049633 -1.094589 -1.102341 -0.721272 -1.108929 -1.045117 -1.028190 -0.969808 -1.162893 -0.972633 -1.122053 -1.152569 -0.976821 -1.142699 -0.959084 -1.149989 -1.106068 -0.973975 0.041556 1.915362 1.757339 1.929164 1.825634 1.819277 1.917702 1.813342 1.964159 1.856599 1.831913 1.917670 1.844644 -0.681285 -0.672820 -0.683043 -0.695594 -0.775292 -0.812545 -0.831232 -0.768009 -1.029595 -0.786862 -0.780806 -0.787092 -0.786011 -0.745522 -0.780057 -0.912460 -0.897237 -0.867469 -0.880039 -0.953415 -0.864106 -0.880027 -0.947943 -1.054871 -0.916554 -0.967758 -0.889204 -0.872121 -0.908571 -1.143486 -0.911787 -1.087490 -1.122489 -0.914951 -1.109026 -0.884446 -1.123019 -1.066770 -0.913373 0.311574 2.034155 1.686473 2.050200 1.956040 1.930824 2.033057 1.943123 2.068119 1.972580 1.960499 2.038783 1.955130 -0.770989 -0.757211 -0.781078 -0.779052 -0.866864 -0.920616 -0.913433 -0.859991 -1.031880 -0.872560 -0.872731 -0.867077 -0.862181 -0.860682 -0.874096 -0.978027 -0.919389 -0.895564 -0.889322 -0.997344 -0.897298 -0.928362 -0.981734 -1.041717 -0.891225 -1.006618 -0.921828 -0.897188 -0.866702 -1.124046 -0.872450 -1.059528 -1.096237 -0.882432 -1.080839 -0.856348 -1.112746 -1.037047 -0.876606 0.372056 2.46464870 -3.94234088 7.40343292 8.74227453 -33.47781919 42.34929190 17.72810127 39.63204515 -8.20849201 -6.15422596 -350.6838 413.0852 76.0867 -442.1781 -170.7850 -474.4751 Jun20-2024 09:03:57 Nodes: 1 Procs: 1 Jun20-2024 09:03:59 Nodes: 1 Procs: 1 0 Jun20-2024 09:04:01 Nodes: 1 Procs: 1 Jun20-2024 09:04:03 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 09:04:05 Nodes: 1 Procs: 1 Jun20-2024 09:04:07 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 09:04:11 Nodes: 1 Procs: 1 Jun20-2024 09:04:12 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun20-2024 09:04:14 Nodes: 1 Procs: 1 Jun20-2024 09:04:16 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Jun20-2024 09:04:21 Nodes: 1 Procs: 5 *** (NO TITLE) *** -12 -16.96117452 -17.24756164 -17.30591205 -17.26183005 -17.33483229 -17.37745715 -17.39321228 -17.40822882 -17.42046420 -17.42732474 -17.42940599 -17.43219415 -17.43331096 -17.43395193 -17.43462427 -17.43529797 -17.43588986 -17.43608574 -17.43630405 -17.43635255 -17.43641851 -17.43651640 -17.43660592 -17.43662650 -17.43664085 GEOMETRY CONVERGED