ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:34:27 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.76 0.05 1.69 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 06:34:27 Nodes: 1 Procs: 1 Jun20-2024 06:34:29 Nodes: 1 Procs: 1 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:34:32 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.48 0.07 2.45 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 06:34:27 Nodes: 1 Procs: 1 Jun20-2024 06:34:29 Nodes: 1 Procs: 1 0 Jun20-2024 06:34:32 Nodes: 1 Procs: 1 Jun20-2024 06:34:35 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:34:38 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.70 0.08 3.81 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 06:34:27 Nodes: 1 Procs: 1 Jun20-2024 06:34:29 Nodes: 1 Procs: 1 0 Jun20-2024 06:34:32 Nodes: 1 Procs: 1 Jun20-2024 06:34:35 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 06:34:38 Nodes: 1 Procs: 1 Jun20-2024 06:34:41 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:34:46 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.00 0.05 1.70 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 06:34:27 Nodes: 1 Procs: 1 Jun20-2024 06:34:29 Nodes: 1 Procs: 1 0 Jun20-2024 06:34:32 Nodes: 1 Procs: 1 Jun20-2024 06:34:35 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 06:34:38 Nodes: 1 Procs: 1 Jun20-2024 06:34:41 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 06:34:46 Nodes: 1 Procs: 1 Jun20-2024 06:34:48 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:34:50 Hydrogen (TZP) c5-16 c5-16 c5-16 c5-16 c5-16 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 2.68 0.08 3.23 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 06:34:27 Nodes: 1 Procs: 1 Jun20-2024 06:34:29 Nodes: 1 Procs: 1 0 Jun20-2024 06:34:32 Nodes: 1 Procs: 1 Jun20-2024 06:34:35 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 06:34:38 Nodes: 1 Procs: 1 Jun20-2024 06:34:41 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 06:34:46 Nodes: 1 Procs: 1 Jun20-2024 06:34:48 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun20-2024 06:34:50 Nodes: 1 Procs: 1 Jun20-2024 06:34:53 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 304 2020-05-08 x86_64_linux_intel / intelmpi Jun20-2024 06:34:58 Hydrogen (TZP) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP TZP 2706.6777000000056 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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 06:34:53 1 1 Tungsten TZP 4d t21.As ADF 2019.304 Jun20-2024 06:34:35 1 1 Arsenic TZP 3p t21.Ta ADF 2019.304 Jun20-2024 06:34:41 1 1 Tantalum TZP 4d t21.O ADF 2019.304 Jun20-2024 06:34:48 1 1 Oxygen TZP 1s t21.H ADF 2019.304 Jun20-2024 06:34:29 1 1 Hydrogen TZP 1 1 -17.00916544 0.22593560 0.00100000 F 0.08965645 0.00066667 F 0.22593560 0.08965645 0.29830332 0.01000000 F 0.06815246 0.00666667 F Cartesian 2706.6777000000056 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3.821204 0.247113 -3.772240 3.900889 -0.195510 -3.885822 -3.821817 0.167002 -3.869090 0.331697 -3.735615 -3.794408 -0.184523 3.935393 3.738028 0.250264 3.790583 -1.542012 -2.263651 -2.916902 -0.519666 -3.341882 -1.366457 1.221519 -2.027293 -2.516320 1 3 -3 0.068686 -2.572283 2.572848 Rho 0.4361415E+07 3,-3 2 3 -3 0.089512 2.454485 -2.568385 Rho 0.4361414E+07 3,-3 3 3 -3 -0.124976 2.556681 2.590666 Rho 0.4361415E+07 3,-3 4 3 -3 2.527879 2.547925 -0.113863 Rho 0.4361415E+07 3,-3 5 3 -3 -2.685479 -0.097299 -2.512129 Rho 0.4361415E+07 3,-3 6 3 -3 2.564289 -0.155917 2.548624 Rho 0.4361415E+07 3,-3 7 3 -3 -0.080120 -0.021310 -0.006266 Rho 0.4276085E+05 3,-3 8 3 -3 2.497499 -2.667665 -0.010434 Rho 0.3882647E+07 3,-3 9 3 -3 -2.591232 2.596536 0.174214 Rho 0.3882646E+07 3,-3 10 3 -3 -2.625637 -2.565367 -0.089133 Rho 0.3882646E+07 3,-3 11 3 -3 -2.618057 0.114235 2.606210 Rho 0.3882647E+07 3,-3 12 3 -3 2.689871 0.027897 -2.585967 Rho 0.3882647E+07 3,-3 13 3 -3 0.929956 -1.015002 0.959235 Rho 0.3190290E+03 3,-3 14 3 -3 -1.139444 -0.935990 -0.951161 Rho 0.3190375E+03 3,-3 15 3 -3 0.961929 0.922492 -0.988656 Rho 0.3190232E+03 3,-3 16 3 -3 -1.001262 1.001544 1.024978 Rho 0.3189790E+03 3,-3 17 3 -3 -3.130012 -1.210452 1.259078 Rho 0.3188203E+03 3,-3 18 3 -3 3.192381 -1.197024 -1.162966 Rho 0.3188061E+03 3,-3 19 3 -3 -3.113165 1.175439 -1.175352 Rho 0.3188702E+03 3,-3 20 3 -3 3.001120 1.186315 1.170360 Rho 0.3188468E+03 3,-3 21 3 -3 1.441883 -1.349448 -3.233339 Rho 0.3186615E+03 3,-3 22 3 -3 1.138714 1.168929 2.981983 Rho 0.3188693E+03 3,-3 23 3 -3 -1.198633 1.079688 -3.028627 Rho 0.3188524E+03 3,-3 24 3 -3 -1.122823 -1.158974 3.067931 Rho 0.3188528E+03 3,-3 25 3 -3 -1.133231 2.949273 -1.188494 Rho 0.3188629E+03 3,-3 26 3 -3 -1.191443 -3.090945 1.262417 Rho 0.3188511E+03 3,-3 27 3 -3 1.109293 3.001956 1.122039 Rho 0.3188683E+03 3,-3 28 3 -3 1.203403 -3.168538 -1.246104 Rho 0.3189989E+03 3,-3 29 3 -3 3.442899 -1.462613 1.588666 Rho 0.3190063E+03 3,-3 30 3 -3 -3.571130 -1.490337 -1.536828 Rho 0.3188954E+03 3,-3 31 3 -3 3.457165 1.596216 -1.457988 Rho 0.3189304E+03 3,-3 32 3 -3 -3.514174 1.584736 1.593594 Rho 0.3188584E+03 3,-3 33 3 -3 1.503896 -1.461796 3.468260 Rho 0.3189151E+03 3,-3 34 3 -3 1.490758 1.479164 -3.435730 Rho 0.3189112E+03 3,-3 35 3 -3 -1.483863 1.605914 3.507993 Rho 0.3189216E+03 3,-3 36 3 -3 -1.833217 -1.549856 -3.548152 Rho 0.3187025E+03 3,-3 37 3 -3 -1.505492 -3.529904 -1.486043 Rho 0.3186559E+03 3,-3 38 3 -3 -1.472487 3.509971 1.580965 Rho 0.3188967E+03 3,-3 39 3 -3 1.490569 -3.427997 1.627903 Rho 0.3189031E+03 3,-3 40 3 -3 1.483702 3.399284 -1.533800 Rho 0.3189122E+03 3,-3 41 3 -3 -0.207741 -3.735423 3.862673 Rho 0.3192138E+03 3,-3 42 3 -3 4.014708 -0.075564 -3.800104 Rho 0.3190837E+03 3,-3 43 3 -3 -0.241424 3.674878 -3.788174 Rho 0.3192266E+03 3,-3 44 3 -3 0.311363 3.777006 3.778888 Rho 0.3192169E+03 3,-3 45 3 -3 3.792973 -3.926745 -0.158817 Rho 0.3190528E+03 3,-3 46 3 -3 3.680486 3.821204 0.247113 Rho 0.3192311E+03 3,-3 47 3 -3 -3.772240 3.900889 -0.195510 Rho 0.3190993E+03 3,-3 48 3 -3 -3.885822 -3.821817 0.167002 Rho 0.3190989E+03 3,-3 49 3 -3 -3.869090 0.331697 -3.735615 Rho 0.3192300E+03 3,-3 50 3 -3 -3.794408 -0.184523 3.935393 Rho 0.3190892E+03 3,-3 51 3 -3 3.738028 0.250264 3.790583 Rho 0.3192251E+03 3,-3 52 3 -3 -1.542012 -2.263651 -2.916902 Rho 0.4448618E+00 3,-3 53 3 -3 -0.519666 -3.341882 -1.366457 Rho 0.4270692E+00 3,-3 54 3 -3 1.221519 -2.027293 -2.516320 Rho 0.4264654E+00 3,-3 55 3 +1 -3.019538 0.073442 0.117596 Rho 0.4572254E-02 |GRAD(Rho)| 0.1067985E-12 GRAD(Rho)x -0.5593574E-13 GRAD(Rho)y -0.5536828E-13 GRAD(Rho)z 0.7219044E-13 Laplacian 0.1753329E-01 (-1/4)Del**2(Rho)) -0.4383324E-02 Diamond 0.3627187E-03 Metallicity 0.4950324E+00 Ellipticity -0.4369265E+01 Gb(Abramov) 0.3283864E-02 Vb(Abramov) -0.2184404E-02 Hb(Abramov) 0.1099460E-02 Ex_ueg -0.5604784E-03 Ec_ueg -0.1285518E-03 Delta_ex -0.8570781E-03 Delta_ec 0.5523796E-03 Delta_et -0.2920206E-02 Pxc 0.4359940E+01 Qxc -0.1551611E+01 3,+1 56 3 +1 -0.661334 -1.695440 0.561166 Rho 0.7879432E-02 |GRAD(Rho)| 0.4890446E-12 GRAD(Rho)x -0.2884894E-12 GRAD(Rho)y 0.5327575E-13 GRAD(Rho)z -0.3912802E-12 Laplacian 0.2926685E-01 (-1/4)Del**2(Rho)) -0.7316713E-02 Diamond 0.6928967E-03 Metallicity 0.7346188E+00 Ellipticity -0.1461543E+01 Gb(Abramov) 0.5773641E-02 Vb(Abramov) -0.4230569E-02 Hb(Abramov) 0.1543072E-02 Ex_ueg -0.1158008E-02 Ec_ueg -0.2728562E-03 Delta_ex -0.1306672E-02 Delta_ec 0.4097335E-03 Delta_et -0.2739774E-02 Pxc 0.4244024E+01 Qxc -0.3189079E+01 3,+1 57 3 -1 -1.874073 -0.501887 -1.692375 Rho 0.5141728E-01 |GRAD(Rho)| 0.7032312E-14 GRAD(Rho)x -0.4027644E-14 GRAD(Rho)y -0.4748038E-14 GRAD(Rho)z 0.3269196E-14 Laplacian 0.2064202E+00 (-1/4)Del**2(Rho)) -0.5160505E-01 Diamond 0.1091043E+00 Metallicity 0.2373428E+01 Ellipticity 0.2287060E-01 Gb(Abramov) 0.5481685E-01 Vb(Abramov) -0.5802864E-01 Hb(Abramov) -0.3211798E-02 Ex_ueg -0.1412095E-01 Ec_ueg -0.2493364E-02 Delta_ex -0.1712817E-01 Delta_ec 0.6179722E-02 Delta_et -0.6564960E-01 Pxc 0.5663411E+01 Qxc -0.2771673E+01 3,-1 58 3 +1 -0.590024 0.535565 -1.656078 Rho 0.8873776E-02 |GRAD(Rho)| 0.1573211E-14 GRAD(Rho)x 0.1075222E-14 GRAD(Rho)y -0.1014186E-16 GRAD(Rho)z 0.1148385E-14 Laplacian 0.3467274E-01 (-1/4)Del**2(Rho)) -0.8668186E-02 Diamond 0.9764266E-03 Metallicity 0.7559140E+00 Ellipticity -0.1466264E+01 Gb(Abramov) 0.6870858E-02 Vb(Abramov) -0.5073530E-02 Hb(Abramov) 0.1797328E-02 Ex_ueg -0.1356843E-02 Ec_ueg -0.3172462E-03 Delta_ex -0.1600095E-02 Delta_ec 0.4941065E-03 Delta_et -0.3399500E-02 Pxc 0.4276941E+01 Qxc -0.3238361E+01 3,+1 59 3 +1 -1.771611 -0.506138 0.646737 Rho 0.8282514E-02 |GRAD(Rho)| 0.3693723E-13 GRAD(Rho)x 0.2038347E-13 GRAD(Rho)y -0.2899334E-13 GRAD(Rho)z 0.1040476E-13 Laplacian 0.3031675E-01 (-1/4)Del**2(Rho)) -0.7579187E-02 Diamond 0.7392477E-03 Metallicity 0.7706682E+00 Ellipticity -0.1455321E+01 Gb(Abramov) 0.6026298E-02 Vb(Abramov) -0.4473409E-02 Hb(Abramov) 0.1552889E-02 Ex_ueg -0.1237660E-02 Ec_ueg -0.2907974E-03 Delta_ex -0.1356945E-02 Delta_ec 0.3999331E-03 Delta_et -0.2729096E-02 Pxc 0.4256090E+01 Qxc -0.3392929E+01 3,+1 60 3 +1 0.299593 -1.421749 -1.802931 Rho 0.4130392E-02 |GRAD(Rho)| 0.1132354E-13 GRAD(Rho)x -0.8080274E-14 GRAD(Rho)y 0.3784734E-14 GRAD(Rho)z -0.6971916E-14 Laplacian 0.1594296E-01 (-1/4)Del**2(Rho)) -0.3985740E-02 Diamond 0.2838685E-03 Metallicity 0.4595820E+00 Ellipticity -0.2929184E+01 Gb(Abramov) 0.2962456E-02 Vb(Abramov) -0.1939171E-02 Hb(Abramov) 0.1023284E-02 Ex_ueg -0.4894482E-03 Ec_ueg -0.1096841E-03 Delta_ex -0.7598974E-03 Delta_ec 0.4940075E-03 Delta_et -0.2536278E-02 Pxc 0.4462343E+01 Qxc -0.1538231E+01 3,+1 61 3 +1 -1.771573 0.632544 -0.456505 Rho 0.8555563E-02 |GRAD(Rho)| 0.1558529E-14 GRAD(Rho)x 0.1081810E-14 GRAD(Rho)y -0.1023661E-14 GRAD(Rho)z 0.4591474E-15 Laplacian 0.3273344E-01 (-1/4)Del**2(Rho)) -0.8183361E-02 Diamond 0.8551783E-03 Metallicity 0.7534176E+00 Ellipticity -0.1445740E+01 Gb(Abramov) 0.6483155E-02 Vb(Abramov) -0.4782950E-02 Hb(Abramov) 0.1700206E-02 Ex_ueg -0.1292359E-02 Ec_ueg -0.3029923E-03 Delta_ex -0.1486786E-02 Delta_ec 0.4487472E-03 Delta_et -0.3072740E-02 Pxc 0.4265319E+01 Qxc -0.3313193E+01 3,+1 62 3 -1 -1.760031 1.757798 0.585163 Rho 0.4472572E-01 |GRAD(Rho)| 0.2502833E-14 GRAD(Rho)x -0.1402752E-14 GRAD(Rho)y -0.1368723E-14 GRAD(Rho)z 0.1556617E-14 Laplacian 0.1906395E+00 (-1/4)Del**2(Rho)) -0.4765987E-01 Diamond 0.8863222E-01 Metallicity 0.2037023E+01 Ellipticity 0.2031024E-01 Gb(Abramov) 0.4795395E-01 Vb(Abramov) -0.4824804E-01 Hb(Abramov) -0.2940838E-03 Ex_ueg -0.1172541E-01 Ec_ueg -0.2125475E-02 Delta_ex -0.1553855E-01 Delta_ec 0.6183280E-02 Delta_et -0.6341213E-01 Pxc 0.5516609E+01 Qxc -0.2512995E+01 3,-1 63 3 +1 -1.808580 1.711573 -1.768148 Rho 0.1184142E-01 |GRAD(Rho)| 0.2238722E-14 GRAD(Rho)x 0.2957381E-15 GRAD(Rho)y 0.1711162E-14 GRAD(Rho)z 0.1412918E-14 Laplacian 0.5789068E-01 (-1/4)Del**2(Rho)) -0.1447267E-01 Diamond 0.2229834E-02 Metallicity 0.7322810E+00 Ellipticity -0.1254415E+01 Gb(Abramov) 0.1141479E-01 Vb(Abramov) -0.8356910E-02 Hb(Abramov) 0.3057880E-02 Ex_ueg -0.1993381E-02 Ec_ueg -0.4522535E-03 Delta_ex -0.2821523E-02 Delta_ec 0.7262521E-03 Delta_et -0.5447456E-02 Pxc 0.4407662E+01 Qxc -0.3885046E+01 3,+1 64 3 -1 -3.249825 -0.045269 3.320177 Rho 0.2071610E+00 |GRAD(Rho)| 0.2685295E-15 GRAD(Rho)x -0.2104436E-15 GRAD(Rho)y 0.7306167E-16 GRAD(Rho)z -0.1499452E-15 Laplacian 0.7803999E+00 (-1/4)Del**2(Rho)) -0.1951000E+00 Diamond 0.2312962E+01 Metallicity 0.6404362E+01 Ellipticity 0.2277386E-02 Gb(Abramov) 0.3383151E+00 Vb(Abramov) -0.4815303E+00 Hb(Abramov) -0.1432151E+00 Ex_ueg -0.9053065E-01 Ec_ueg -0.1219866E-01 Delta_ex -0.9076721E-01 Delta_ec 0.1799056E-01 Delta_et -0.2472946E+00 Pxc 0.7421360E+01 Qxc -0.5045269E+01 3,-1 65 3 -1 -3.323974 0.133072 -3.172680 Rho 0.2321872E+00 |GRAD(Rho)| 0.2085815E-14 GRAD(Rho)x 0.1546723E-14 GRAD(Rho)y -0.5971243E-15 GRAD(Rho)z 0.1265589E-14 Laplacian 0.8650555E+00 (-1/4)Del**2(Rho)) -0.2162639E+00 Diamond 0.2931199E+01 Metallicity 0.6987146E+01 Ellipticity 0.4776399E-02 Gb(Abramov) 0.3960204E+00 Vb(Abramov) -0.5757770E+00 Hb(Abramov) -0.1797566E+00 Ex_ueg -0.1053989E+00 Ec_ueg -0.1390071E-01 Delta_ex -0.1035695E+00 Delta_ec 0.1920939E-01 Delta_et -0.2653752E+00 Pxc 0.7582268E+01 Qxc -0.5391610E+01 3,-1 66 3 +1 -0.189335 -0.481450 -3.141981 Rho 0.2721712E-02 |GRAD(Rho)| 0.1967961E-17 GRAD(Rho)x 0.1368965E-17 GRAD(Rho)y -0.1413771E-17 GRAD(Rho)z -0.7469205E-20 Laplacian 0.1003453E-01 (-1/4)Del**2(Rho)) -0.2508632E-02 Diamond 0.8668130E-04 Metallicity 0.3643510E+00 Ellipticity -0.1513579E+01 Gb(Abramov) 0.1824759E-02 Vb(Abramov) -0.1140885E-02 Hb(Abramov) 0.6838736E-03 Ex_ueg -0.2806562E-03 Ec_ueg -0.5022618E-04 Delta_ex -0.4110366E-03 Delta_ec 0.2533816E-03 Delta_et -0.1170991E-02 Pxc 0.5587848E+01 Qxc -0.1622204E+01 3,+1 67 3 -1 -3.225486 3.297213 -0.023335 Rho 0.2081223E+00 |GRAD(Rho)| 0.6278815E-12 GRAD(Rho)x 0.4119667E-12 GRAD(Rho)y -0.4557784E-12 GRAD(Rho)z 0.1295554E-12 Laplacian 0.7878193E+00 (-1/4)Del**2(Rho)) -0.1969548E+00 Diamond 0.2344563E+01 Metallicity 0.6393188E+01 Ellipticity 0.3033945E-02 Gb(Abramov) 0.3411648E+00 Vb(Abramov) -0.4853747E+00 Hb(Abramov) -0.1442099E+00 Ex_ueg -0.9109121E-01 Ec_ueg -0.1226340E-01 Delta_ex -0.9171710E-01 Delta_ec 0.1809889E-01 Delta_et -0.2487207E+00 Pxc 0.7427892E+01 Qxc -0.5067555E+01 3,-1 68 3 +3 -1.213597 1.090204 -1.109734 Rho 0.5319616E-02 |GRAD(Rho)| 0.1127842E-12 GRAD(Rho)x 0.8108634E-13 GRAD(Rho)y 0.3308319E-14 GRAD(Rho)z 0.7832195E-13 Laplacian 0.2048361E-01 (-1/4)Del**2(Rho)) -0.5120904E-02 Diamond 0.1551207E-03 Metallicity 0.5453479E+00 Ellipticity -0.2909747E+00 Gb(Abramov) 0.3879381E-02 Vb(Abramov) -0.2637859E-02 Hb(Abramov) 0.1241522E-02 Ex_ueg -0.6858441E-03 Ec_ueg -0.1606930E-03 Delta_ex -0.7194839E-03 Delta_ec 0.8931067E-04 Delta_et -0.7171620E-03 Pxc 0.4268040E+01 Qxc -0.8055968E+01 3,+3 69 3 -1 -2.857833 1.841160 -0.538476 Rho 0.1105643E+00 |GRAD(Rho)| 0.1700210E-11 GRAD(Rho)x -0.4009034E-12 GRAD(Rho)y -0.1476690E-11 GRAD(Rho)z 0.7411991E-12 Laplacian 0.4771463E+00 (-1/4)Del**2(Rho)) -0.1192866E+00 Diamond 0.6965450E+00 Metallicity 0.3678351E+01 Ellipticity 0.2284303E-01 Gb(Abramov) 0.1526541E+00 Vb(Abramov) -0.1860215E+00 Hb(Abramov) -0.3336747E-01 Ex_ueg -0.3919269E-01 Ec_ueg -0.5969328E-02 Delta_ex -0.4800705E-01 Delta_ec 0.1372377E-01 Delta_et -0.1748309E+00 Pxc 0.6565678E+01 Qxc -0.3498096E+01 3,-1 70 3 -1 -2.900314 0.581678 -1.794763 Rho 0.1580352E+00 |GRAD(Rho)| 0.1580339E-14 GRAD(Rho)x 0.3448169E-15 GRAD(Rho)y -0.7870766E-15 GRAD(Rho)z -0.1326305E-14 Laplacian 0.6662817E+00 (-1/4)Del**2(Rho)) -0.1665704E+00 Diamond 0.1426463E+01 Metallicity 0.4777619E+01 Ellipticity 0.1122598E-01 Gb(Abramov) 0.2436820E+00 Vb(Abramov) -0.3207935E+00 Hb(Abramov) -0.7711155E-01 Ex_ueg -0.6310398E-01 Ec_ueg -0.8959850E-02 Delta_ex -0.7237631E-01 Delta_ec 0.1650178E-01 Delta_et -0.2207617E+00 Pxc 0.7042973E+01 Qxc -0.4385970E+01 3,-1 71 3 -1 -3.081012 0.893411 2.062104 Rho 0.1235990E+00 |GRAD(Rho)| 0.1976136E-15 GRAD(Rho)x 0.4546873E-16 GRAD(Rho)y -0.1018201E-15 GRAD(Rho)z 0.1631453E-15 Laplacian 0.4992949E+00 (-1/4)Del**2(Rho)) -0.1248237E+00 Diamond 0.8204131E+00 Metallicity 0.4232670E+01 Ellipticity 0.5319406E-02 Gb(Abramov) 0.1712721E+00 Vb(Abramov) -0.2177204E+00 Hb(Abramov) -0.4644836E-01 Ex_ueg -0.4547141E-01 Ec_ueg -0.6775570E-02 Delta_ex -0.5139868E-01 Delta_ec 0.1370296E-01 Delta_et -0.1777610E+00 Pxc 0.6711083E+01 Qxc -0.3750919E+01 3,-1 72 3 +3 -2.506229 0.075835 0.120515 Rho 0.4184125E-02 |GRAD(Rho)| 0.3182345E-16 GRAD(Rho)x 0.1547101E-16 GRAD(Rho)y 0.2144623E-16 GRAD(Rho)z 0.1770422E-16 Laplacian 0.1653802E-01 (-1/4)Del**2(Rho)) -0.4134505E-02 Diamond 0.1367687E-03 Metallicity 0.4526933E+00 Ellipticity -0.9424976E-01 Gb(Abramov) 0.3068280E-02 Vb(Abramov) -0.2002056E-02 Hb(Abramov) 0.1066224E-02 Ex_ueg -0.4979563E-03 Ec_ueg -0.1119731E-03 Delta_ex -0.5984254E-03 Delta_ec 0.1700782E-03 Delta_et -0.1019486E-02 Pxc 0.4447106E+01 Qxc -0.3518531E+01 3,+3 73 3 -1 -2.880178 -0.588919 1.886811 Rho 0.1340165E+00 |GRAD(Rho)| 0.6557024E-16 GRAD(Rho)x -0.6160301E-16 GRAD(Rho)y -0.4743385E-17 GRAD(Rho)z 0.2195509E-16 Laplacian 0.5628709E+00 (-1/4)Del**2(Rho)) -0.1407177E+00 Diamond 0.1021945E+01 Metallicity 0.4296696E+01 Ellipticity 0.1996787E-01 Gb(Abramov) 0.1945821E+00 Vb(Abramov) -0.2484464E+00 Hb(Abramov) -0.5386432E-01 Ex_ueg -0.5065193E-01 Ec_ueg -0.7428329E-02 Delta_ex -0.5910536E-01 Delta_ec 0.1521099E-01 Delta_et -0.2001642E+00 Pxc 0.6818751E+01 Qxc -0.3885702E+01 3,-1 74 3 -1 -3.141392 -0.841270 -1.983135 Rho 0.1540207E+00 |GRAD(Rho)| 0.1510559E-15 GRAD(Rho)x -0.1219050E-15 GRAD(Rho)y -0.6597370E-16 GRAD(Rho)z 0.6003770E-16 Laplacian 0.5868957E+00 (-1/4)Del**2(Rho)) -0.1467239E+00 Diamond 0.1234028E+01 Metallicity 0.5196180E+01 Ellipticity 0.2407410E-01 Gb(Abramov) 0.2248833E+00 Vb(Abramov) -0.3030426E+00 Hb(Abramov) -0.7815934E-01 Ex_ueg -0.6097577E-01 Ec_ueg -0.8701393E-02 Delta_ex -0.6349945E-01 Delta_ec 0.1490101E-01 Delta_et -0.1993399E+00 Pxc 0.7007587E+01 Qxc -0.4261420E+01 3,-1 75 3 -1 -2.225325 -0.874668 -3.038105 Rho 0.1348429E+00 |GRAD(Rho)| 0.8095806E-15 GRAD(Rho)x -0.4222087E-15 GRAD(Rho)y 0.4865764E-15 GRAD(Rho)z 0.4903101E-15 Laplacian 0.5065482E+00 (-1/4)Del**2(Rho)) -0.1266370E+00 Diamond 0.9183768E+00 Metallicity 0.4823612E+01 Ellipticity 0.1091799E+00 Gb(Abramov) 0.1862327E+00 Vb(Abramov) -0.2458283E+00 Hb(Abramov) -0.5959564E-01 Ex_ueg -0.5106880E-01 Ec_ueg -0.7480418E-02 Delta_ex -0.5317642E-01 Delta_ec 0.1350240E-01 Delta_et -0.1775438E+00 Pxc 0.6826999E+01 Qxc -0.3938294E+01 3,-1 76 3 -1 -0.596970 1.720405 -2.796663 Rho 0.1406109E+00 |GRAD(Rho)| 0.1447373E-15 GRAD(Rho)x -0.1244935E-15 GRAD(Rho)y 0.1517883E-16 GRAD(Rho)z -0.7224852E-16 Laplacian 0.5824660E+00 (-1/4)Del**2(Rho)) -0.1456165E+00 Diamond 0.1089170E+01 Metallicity 0.4498225E+01 Ellipticity 0.1701586E-01 Gb(Abramov) 0.2062470E+00 Vb(Abramov) -0.2668774E+00 Hb(Abramov) -0.6063045E-01 Ex_ueg -0.5400209E-01 Ec_ueg -0.7845215E-02 Delta_ex -0.6153676E-01 Delta_ec 0.1495697E-01 Delta_et -0.1971320E+00 Pxc 0.6883443E+01 Qxc -0.4114253E+01 3,-1 77 3 -1 -1.839965 -1.708181 -0.500393 Rho 0.4862760E-01 |GRAD(Rho)| 0.4512375E-14 GRAD(Rho)x 0.9308198E-15 GRAD(Rho)y -0.2832354E-14 GRAD(Rho)z 0.3387164E-14 Laplacian 0.2072912E+00 (-1/4)Del**2(Rho)) -0.5182281E-01 Diamond 0.1084440E+00 Metallicity 0.2153626E+01 Ellipticity 0.1960669E-01 Gb(Abramov) 0.5314969E-01 Vb(Abramov) -0.5447658E-01 Hb(Abramov) -0.1326886E-02 Ex_ueg -0.1310878E-01 Ec_ueg -0.2339154E-02 Delta_ex -0.1726854E-01 Delta_ec 0.6757848E-02 Delta_et -0.7089451E-01 Pxc 0.5604067E+01 Qxc -0.2555331E+01 3,-1 78 3 +1 1.649963 0.506877 0.551520 Rho 0.7875318E-02 |GRAD(Rho)| 0.1082783E-16 GRAD(Rho)x -0.6725825E-17 GRAD(Rho)y -0.7736436E-17 GRAD(Rho)z -0.3486071E-17 Laplacian 0.3070798E-01 (-1/4)Del**2(Rho)) -0.7676996E-02 Diamond 0.7293235E-03 Metallicity 0.6995339E+00 Ellipticity -0.1410789E+01 Gb(Abramov) 0.6013050E-02 Vb(Abramov) -0.4349105E-02 Hb(Abramov) 0.1663946E-02 Ex_ueg -0.1157202E-02 Ec_ueg -0.2726734E-03 Delta_ex -0.1372266E-02 Delta_ec 0.4324645E-03 Delta_et -0.2889240E-02 Pxc 0.4243912E+01 Qxc -0.3173129E+01 3,+1 79 3 -1 -2.017257 -3.062599 -0.817250 Rho 0.1158102E+00 |GRAD(Rho)| 0.2307862E-16 GRAD(Rho)x -0.3699840E-17 GRAD(Rho)y 0.1463673E-16 GRAD(Rho)z -0.1745565E-16 Laplacian 0.4496283E+00 (-1/4)Del**2(Rho)) -0.1124071E+00 Diamond 0.6932488E+00 Metallicity 0.4217003E+01 Ellipticity 0.8054992E-01 Gb(Abramov) 0.1539415E+00 Vb(Abramov) -0.1954760E+00 Hb(Abramov) -0.4153447E-01 Ex_ueg -0.4169147E-01 Ec_ueg -0.6292349E-02 Delta_ex -0.4571996E-01 Delta_ec 0.1277889E-01 Delta_et -0.1642178E+00 Pxc 0.6625740E+01 Qxc -0.3577773E+01 3,-1 80 3 +1 0.058619 -3.063162 0.087960 Rho 0.4471642E-02 |GRAD(Rho)| 0.1542094E-17 GRAD(Rho)x 0.1667935E-18 GRAD(Rho)y -0.4617672E-18 GRAD(Rho)z -0.1461850E-17 Laplacian 0.1685582E-01 (-1/4)Del**2(Rho)) -0.4213954E-02 Diamond 0.3146074E-03 Metallicity 0.4961829E+00 Ellipticity -0.2474812E+01 Gb(Abramov) 0.3157785E-02 Vb(Abramov) -0.2101615E-02 Hb(Abramov) 0.1056169E-02 Ex_ueg -0.5440947E-03 Ec_ueg -0.1242468E-03 Delta_ex -0.7948090E-03 Delta_ec 0.4851914E-03 Delta_et -0.2566616E-02 Pxc 0.4379146E+01 Qxc -0.1638135E+01 3,+1 81 3 +3 0.869443 -1.173254 -1.353235 Rho 0.3588005E-02 |GRAD(Rho)| 0.1704818E-12 GRAD(Rho)x -0.2550800E-13 GRAD(Rho)y 0.1682426E-12 GRAD(Rho)z -0.1038258E-13 Laplacian 0.1326538E-01 (-1/4)Del**2(Rho)) -0.3316346E-02 Diamond 0.9155222E-04 Metallicity 0.4368326E+00 Ellipticity -0.6514474E+00 Gb(Abramov) 0.2452345E-02 Vb(Abramov) -0.1588345E-02 Hb(Abramov) 0.8640007E-03 Ex_ueg -0.4056851E-03 Ec_ueg -0.8666432E-04 Delta_ex -0.4656295E-03 Delta_ec 0.1427367E-03 Delta_et -0.8152111E-03 Pxc 0.4681109E+01 Qxc -0.3262157E+01 3,+3 82 3 +3 -0.097578 -2.384512 -0.110400 Rho 0.3608156E-02 |GRAD(Rho)| 0.7417153E-11 GRAD(Rho)x 0.4264806E-11 GRAD(Rho)y 0.4341274E-11 GRAD(Rho)z 0.4240158E-11 Laplacian 0.1399768E-01 (-1/4)Del**2(Rho)) -0.3499419E-02 Diamond 0.7855304E-04 Metallicity 0.4178619E+00 Ellipticity -0.2032973E+00 Gb(Abramov) 0.2576658E-02 Vb(Abramov) -0.1653898E-02 Hb(Abramov) 0.9227607E-03 Ex_ueg -0.4087259E-03 Ec_ueg -0.8751677E-04 Delta_ex -0.4650535E-03 Delta_ec 0.1024966E-03 Delta_et -0.6444928E-03 Pxc 0.4670258E+01 Qxc -0.4537258E+01 3,+3 83 3 +1 -2.230054 1.154049 1.399578 Rho 0.2561915E-01 |GRAD(Rho)| 0.1784987E-14 GRAD(Rho)x -0.8506765E-15 GRAD(Rho)y -0.9042730E-15 GRAD(Rho)z 0.1282505E-14 Laplacian 0.9464110E-01 (-1/4)Del**2(Rho)) -0.2366028E-01 Diamond 0.1286380E-01 Metallicity 0.1621093E+01 Ellipticity -0.5624827E+01 Gb(Abramov) 0.2216610E-01 Vb(Abramov) -0.2067193E-01 Hb(Abramov) 0.1494175E-02 Ex_ueg -0.5577908E-02 Ec_ueg -0.1119938E-02 Delta_ex -0.5931277E-02 Delta_ec 0.1617583E-02 Delta_et -0.1436175E-01 Pxc 0.4980552E+01 Qxc -0.3666754E+01 3,+1 84 3 +1 -1.807508 -1.788618 1.824806 Rho 0.1147205E-01 |GRAD(Rho)| 0.1608056E-16 GRAD(Rho)x 0.1771132E-17 GRAD(Rho)y -0.1597982E-16 GRAD(Rho)z -0.3043282E-18 Laplacian 0.5400275E-01 (-1/4)Del**2(Rho)) -0.1350069E-01 Diamond 0.1939914E-02 Metallicity 0.7446159E+00 Ellipticity -0.1252795E+01 Gb(Abramov) 0.1067593E-01 Vb(Abramov) -0.7851171E-02 Hb(Abramov) 0.2824758E-02 Ex_ueg -0.1910908E-02 Ec_ueg -0.4352521E-03 Delta_ex -0.2594200E-02 Delta_ec 0.6491600E-03 Delta_et -0.4854964E-02 Pxc 0.4390347E+01 Qxc -0.3996242E+01 3,+1 85 3 -1 0.013360 2.910864 -0.052352 Rho 0.6012207E-02 |GRAD(Rho)| 0.5388366E-17 GRAD(Rho)x -0.4001492E-17 GRAD(Rho)y -0.5943714E-18 GRAD(Rho)z -0.3559392E-17 Laplacian 0.2380484E-01 (-1/4)Del**2(Rho)) -0.5951210E-02 Diamond 0.8104306E-03 Metallicity 0.5754458E+00 Ellipticity 0.1939412E+01 Gb(Abramov) 0.4538240E-02 Vb(Abramov) -0.3125270E-02 Hb(Abramov) 0.1412970E-02 Ex_ueg -0.8074153E-03 Ec_ueg -0.1907289E-03 Delta_ex -0.1298960E-02 Delta_ec 0.8780483E-03 Delta_et -0.4988812E-02 Pxc 0.4233313E+01 Qxc -0.1479372E+01 3,-1 86 3 -1 -1.865658 -2.831158 0.626525 Rho 0.1072277E+00 |GRAD(Rho)| 0.9467300E-14 GRAD(Rho)x -0.8304745E-14 GRAD(Rho)y -0.3500042E-14 GRAD(Rho)z -0.2900119E-14 Laplacian 0.4629869E+00 (-1/4)Del**2(Rho)) -0.1157467E+00 Diamond 0.6511647E+00 Metallicity 0.3602102E+01 Ellipticity 0.2182590E-01 Gb(Abramov) 0.1466531E+00 Vb(Abramov) -0.1775594E+00 Hb(Abramov) -0.3090635E-01 Ex_ueg -0.3762366E-01 Ec_ueg -0.5764922E-02 Delta_ex -0.4624839E-01 Delta_ec 0.1340104E-01 Delta_et -0.1696867E+00 Pxc 0.6526308E+01 Qxc -0.3451104E+01 3,-1 87 3 -1 -1.559082 -2.689089 -2.412815 Rho 0.2974849E-01 |GRAD(Rho)| 0.7529826E-16 GRAD(Rho)x 0.2285332E-16 GRAD(Rho)y 0.5327405E-16 GRAD(Rho)z -0.4805653E-16 Laplacian 0.8721543E-01 (-1/4)Del**2(Rho)) -0.2180386E-01 Diamond 0.3132723E-01 Metallicity 0.2256635E+01 Ellipticity 0.2726035E-01 Gb(Abramov) 0.2273646E-01 Vb(Abramov) -0.2366907E-01 Hb(Abramov) -0.9326059E-03 Ex_ueg -0.6807771E-02 Ec_ueg -0.1330641E-02 Delta_ex -0.7133474E-02 Delta_ec 0.4068456E-02 Delta_et -0.3719954E-01 Pxc 0.5116158E+01 Qxc -0.1753362E+01 3,-1 88 3 +1 -2.212097 -2.163192 -2.039893 Rho 0.1119394E-01 |GRAD(Rho)| 0.8964320E-17 GRAD(Rho)x 0.2503839E-17 GRAD(Rho)y 0.1002972E-18 GRAD(Rho)z 0.8606960E-17 Laplacian 0.4595776E-01 (-1/4)Del**2(Rho)) -0.1148944E-01 Diamond 0.1397638E-02 Metallicity 0.8398974E+00 Ellipticity -0.1258441E+01 Gb(Abramov) 0.9267952E-02 Vb(Abramov) -0.7046464E-02 Hb(Abramov) 0.2221488E-02 Ex_ueg -0.1849393E-02 Ec_ueg -0.4224877E-03 Delta_ex -0.2130421E-02 Delta_ec 0.4400211E-03 Delta_et -0.3368157E-02 Pxc 0.4377390E+01 Qxc -0.4841635E+01 3,+1 89 3 +3 -1.187827 -1.147025 1.146223 Rho 0.4994706E-02 |GRAD(Rho)| 0.8166093E-14 GRAD(Rho)x -0.7632998E-14 GRAD(Rho)y -0.2079751E-14 GRAD(Rho)z 0.2024119E-14 Laplacian 0.1839426E-01 (-1/4)Del**2(Rho)) -0.4598564E-02 Diamond 0.1234426E-03 Metallicity 0.5467400E+00 Ellipticity -0.1821074E+00 Gb(Abramov) 0.3484746E-02 Vb(Abramov) -0.2370928E-02 Hb(Abramov) 0.1113818E-02 Ex_ueg -0.6305676E-03 Ec_ueg -0.1466850E-03 Delta_ex -0.6308358E-03 Delta_ec 0.7301893E-04 Delta_et -0.6011100E-03 Pxc 0.4298787E+01 Qxc -0.8639346E+01 3,+3 90 3 +1 -2.325591 -1.382726 -1.039304 Rho 0.2775103E-01 |GRAD(Rho)| 0.7382239E-16 GRAD(Rho)x 0.3395275E-16 GRAD(Rho)y -0.2996822E-16 GRAD(Rho)z 0.5829976E-16 Laplacian 0.1087743E+00 (-1/4)Del**2(Rho)) -0.2719357E-01 Diamond 0.1489980E-01 Metallicity 0.1611457E+01 Ellipticity -0.2747674E+01 Gb(Abramov) 0.2543259E-01 Vb(Abramov) -0.2367161E-01 Hb(Abramov) 0.1760978E-02 Ex_ueg -0.6205219E-02 Ec_ueg -0.1228197E-02 Delta_ex -0.6812877E-02 Delta_ec 0.1588293E-02 Delta_et -0.1441921E-01 Pxc 0.5052299E+01 Qxc -0.4289433E+01 3,+1 91 3 +1 -0.577139 1.615954 -0.524613 Rho 0.9228500E-02 |GRAD(Rho)| 0.4298595E-17 GRAD(Rho)x -0.1632848E-17 GRAD(Rho)y 0.2730755E-17 GRAD(Rho)z 0.2890450E-17 Laplacian 0.3497888E-01 (-1/4)Del**2(Rho)) -0.8744720E-02 Diamond 0.1035791E-02 Metallicity 0.7998817E+00 Ellipticity -0.1517993E+01 Gb(Abramov) 0.6995604E-02 Vb(Abramov) -0.5246487E-02 Hb(Abramov) 0.1749116E-02 Ex_ueg -0.1429640E-02 Ec_ueg -0.3331879E-03 Delta_ex -0.1628990E-02 Delta_ec 0.4960245E-03 Delta_et -0.3449177E-02 Pxc 0.4290791E+01 Qxc -0.3284092E+01 3,+1 92 3 +3 -1.929520 -1.943397 -1.887209 Rho 0.1054237E-01 |GRAD(Rho)| 0.1491567E-13 GRAD(Rho)x 0.5690635E-14 GRAD(Rho)y 0.9870928E-14 GRAD(Rho)z 0.9625930E-14 Laplacian 0.4483871E-01 (-1/4)Del**2(Rho)) -0.1120968E-01 Diamond 0.7747217E-03 Metallicity 0.7789756E+00 Ellipticity -0.5951204E+00 Gb(Abramov) 0.8928462E-02 Vb(Abramov) -0.6647247E-02 Hb(Abramov) 0.2281215E-02 Ex_ueg -0.1707272E-02 Ec_ueg -0.3927049E-03 Delta_ex -0.1879706E-02 Delta_ec 0.1344597E-03 Delta_et -0.1342532E-02 Pxc 0.4347469E+01 Qxc -0.1397970E+02 3,+3 93 3 -1 -1.817247 2.772933 -0.546448 Rho 0.1110930E+00 |GRAD(Rho)| 0.1409118E-12 GRAD(Rho)x -0.1090572E-12 GRAD(Rho)y -0.9811186E-14 GRAD(Rho)z 0.8869274E-13 Laplacian 0.4815270E+00 (-1/4)Del**2(Rho)) -0.1203818E+00 Diamond 0.7027848E+00 Metallicity 0.3673980E+01 Ellipticity 0.1576538E-01 Gb(Abramov) 0.1539679E+00 Vb(Abramov) -0.1875540E+00 Hb(Abramov) -0.3358611E-01 Ex_ueg -0.3944275E-01 Ec_ueg -0.6001790E-02 Delta_ex -0.4843918E-01 Delta_ec 0.1372348E-01 Delta_et -0.1748354E+00 Pxc 0.6571831E+01 Qxc -0.3529657E+01 3,-1 94 3 -1 -1.991270 3.067238 0.917836 Rho 0.1172711E+00 |GRAD(Rho)| 0.6022793E-15 GRAD(Rho)x 0.2466153E-15 GRAD(Rho)y 0.2830445E-15 GRAD(Rho)z 0.4709639E-15 Laplacian 0.4798651E+00 (-1/4)Del**2(Rho)) -0.1199663E+00 Diamond 0.7451566E+00 Metallicity 0.4034709E+01 Ellipticity 0.2046996E-01 Gb(Abramov) 0.1606490E+00 Vb(Abramov) -0.2013318E+00 Hb(Abramov) -0.4068275E-01 Ex_ueg -0.4239419E-01 Ec_ueg -0.6382662E-02 Delta_ex -0.4885598E-01 Delta_ec 0.1345258E-01 Delta_et -0.1730607E+00 Pxc 0.6642087E+01 Qxc -0.3631719E+01 3,-1 95 3 +1 0.500802 1.653261 0.505787 Rho 0.8620915E-02 |GRAD(Rho)| 0.1257355E-12 GRAD(Rho)x 0.8571436E-13 GRAD(Rho)y 0.8907442E-13 GRAD(Rho)z 0.2298263E-13 Laplacian 0.3386521E-01 (-1/4)Del**2(Rho)) -0.8466302E-02 Diamond 0.9120579E-03 Metallicity 0.7375334E+00 Ellipticity -0.1442587E+01 Gb(Abramov) 0.6684898E-02 Vb(Abramov) -0.4903494E-02 Hb(Abramov) 0.1781404E-02 Ex_ueg -0.1305538E-02 Ec_ueg -0.3059160E-03 Delta_ex -0.1549293E-02 Delta_ec 0.4787646E-03 Delta_et -0.3272573E-02 Pxc 0.4267636E+01 Qxc -0.3236023E+01 3,+1 96 3 -1 -1.892685 0.528499 -2.770952 Rho 0.1317761E+00 |GRAD(Rho)| 0.4791198E-13 GRAD(Rho)x -0.3786785E-13 GRAD(Rho)y -0.2825625E-13 GRAD(Rho)z 0.7947842E-14 Laplacian 0.5474557E+00 (-1/4)Del**2(Rho)) -0.1368639E+00 Diamond 0.9506711E+00 Metallicity 0.4295285E+01 Ellipticity 0.5958229E-02 Gb(Abramov) 0.1892209E+00 Vb(Abramov) -0.2415778E+00 Hb(Abramov) -0.5235695E-01 Ex_ueg -0.4952608E-01 Ec_ueg -0.7287340E-02 Delta_ex -0.5697809E-01 Delta_ec 0.1435981E-01 Delta_et -0.1875275E+00 Pxc 0.6796181E+01 Qxc -0.3967886E+01 3,-1 97 3 -1 -1.773924 0.543608 1.775364 Rho 0.4238087E-01 |GRAD(Rho)| 0.3190774E-16 GRAD(Rho)x -0.2301643E-16 GRAD(Rho)y -0.8252430E-17 GRAD(Rho)z 0.2049989E-16 Laplacian 0.1796579E+00 (-1/4)Del**2(Rho)) -0.4491447E-01 Diamond 0.7779708E-01 Metallicity 0.1975984E+01 Ellipticity 0.1990487E-01 Gb(Abramov) 0.4473469E-01 Vb(Abramov) -0.4455491E-01 Hb(Abramov) 0.1797780E-03 Ex_ueg -0.1091302E-01 Ec_ueg -0.1998261E-02 Delta_ex -0.1446036E-01 Delta_ec 0.5844490E-02 Delta_et -0.5906828E-01 Pxc 0.5461259E+01 Qxc -0.2474186E+01 3,-1 98 3 +1 -0.222223 0.227391 2.958321 Rho 0.5610534E-02 |GRAD(Rho)| 0.1798640E-16 GRAD(Rho)x -0.1068935E-16 GRAD(Rho)y -0.1434649E-16 GRAD(Rho)z 0.1851182E-17 Laplacian 0.2283675E-01 (-1/4)Del**2(Rho)) -0.5709188E-02 Diamond 0.5404933E-03 Metallicity 0.5345470E+00 Ellipticity -0.2068764E+01 Gb(Abramov) 0.4314763E-02 Vb(Abramov) -0.2920339E-02 Hb(Abramov) 0.1394424E-02 Ex_ueg -0.7363043E-03 Ec_ueg -0.1732805E-03 Delta_ex -0.1096418E-02 Delta_ec 0.6035125E-03 Delta_et -0.3438886E-02 Pxc 0.4249206E+01 Qxc -0.1816728E+01 3,+1 99 3 -1 -2.012548 0.899271 3.069641 Rho 0.9975566E-01 |GRAD(Rho)| 0.1764028E-15 GRAD(Rho)x 0.2865004E-16 GRAD(Rho)y 0.1424032E-15 GRAD(Rho)z 0.1000922E-15 Laplacian 0.4136127E+00 (-1/4)Del**2(Rho)) -0.1034032E+00 Diamond 0.5301536E+00 Metallicity 0.3574773E+01 Ellipticity 0.3760535E-02 Gb(Abramov) 0.1305426E+00 Vb(Abramov) -0.1576820E+00 Hb(Abramov) -0.2713943E-01 Ex_ueg -0.3416922E-01 Ec_ueg -0.5310253E-02 Delta_ex -0.4058073E-01 Delta_ec 0.1206829E-01 Delta_et -0.1504831E+00 Pxc 0.6434575E+01 Qxc -0.3362590E+01 3,-1 100 3 +1 -1.495581 -1.962658 -1.927970 Rho 0.1136585E-01 |GRAD(Rho)| 0.2585140E-16 GRAD(Rho)x 0.1543929E-17 GRAD(Rho)y 0.2338216E-16 GRAD(Rho)z -0.1091723E-16 Laplacian 0.4912471E-01 (-1/4)Del**2(Rho)) -0.1228118E-01 Diamond 0.1773732E-02 Metallicity 0.8059651E+00 Ellipticity -0.1352654E+01 Gb(Abramov) 0.9837152E-02 Vb(Abramov) -0.7393126E-02 Hb(Abramov) 0.2444026E-02 Ex_ueg -0.1887357E-02 Ec_ueg -0.4303740E-03 Delta_ex -0.2363807E-02 Delta_ec 0.6079537E-03 Delta_et -0.4521801E-02 Pxc 0.4385389E+01 Qxc -0.3888137E+01 3,+1 101 3 +1 -1.457683 1.060404 2.243473 Rho 0.2557000E-01 |GRAD(Rho)| 0.4933525E-16 GRAD(Rho)x 0.3923562E-17 GRAD(Rho)y 0.1322516E-16 GRAD(Rho)z 0.4736737E-16 Laplacian 0.9696246E-01 (-1/4)Del**2(Rho)) -0.2424061E-01 Diamond 0.1106142E-01 Metallicity 0.1577226E+01 Ellipticity -0.2292370E+01 Gb(Abramov) 0.2253257E-01 Vb(Abramov) -0.2082452E-01 Hb(Abramov) 0.1708049E-02 Ex_ueg -0.5563643E-02 Ec_ueg -0.1117455E-02 Delta_ex -0.5854104E-02 Delta_ec 0.1265294E-02 Delta_et -0.1131266E-01 Pxc 0.4978851E+01 Qxc -0.4626675E+01 3,+1 102 3 -1 -0.191529 -1.449760 -3.372401 Rho 0.4922108E-02 |GRAD(Rho)| 0.2627852E-17 GRAD(Rho)x -0.2276540E-17 GRAD(Rho)y 0.1311385E-17 GRAD(Rho)z 0.5690693E-19 Laplacian 0.1754827E-01 (-1/4)Del**2(Rho)) -0.4387067E-02 Diamond 0.5677925E-03 Metallicity 0.5592819E+00 Ellipticity 0.1498809E+00 Gb(Abramov) 0.3333646E-02 Vb(Abramov) -0.2280225E-02 Hb(Abramov) 0.1053421E-02 Ex_ueg -0.6183768E-03 Ec_ueg -0.1435623E-03 Delta_ex -0.1028304E-02 Delta_ec 0.8354923E-03 Delta_et -0.4401501E-02 Pxc 0.4307376E+01 Qxc -0.1230776E+01 3,-1 103 3 +1 -1.394091 2.227135 1.124745 Rho 0.2636787E-01 |GRAD(Rho)| 0.2828587E-16 GRAD(Rho)x -0.6795355E-18 GRAD(Rho)y -0.2735993E-16 GRAD(Rho)z 0.7145825E-17 Laplacian 0.1003692E+00 (-1/4)Del**2(Rho)) -0.2509231E-01 Diamond 0.1295662E-01 Metallicity 0.1603753E+01 Ellipticity -0.2939612E+01 Gb(Abramov) 0.2343519E-01 Vb(Abramov) -0.2177806E-01 Hb(Abramov) 0.1657124E-02 Ex_ueg -0.5796312E-02 Ec_ueg -0.1157828E-02 Delta_ex -0.6213713E-02 Delta_ec 0.1491942E-02 Delta_et -0.1338243E-01 Pxc 0.5006195E+01 Qxc -0.4164849E+01 3,+1 104 3 +1 0.346597 -1.799829 -0.733691 Rho 0.5905513E-02 |GRAD(Rho)| 0.6314481E-17 GRAD(Rho)x 0.5491030E-17 GRAD(Rho)y -0.2807473E-17 GRAD(Rho)z -0.1356231E-17 Laplacian 0.2145420E-01 (-1/4)Del**2(Rho)) -0.5363549E-02 Diamond 0.4649899E-03 Metallicity 0.6197221E+00 Ellipticity -0.1886926E+01 Gb(Abramov) 0.4129684E-02 Vb(Abramov) -0.2895820E-02 Hb(Abramov) 0.1233865E-02 Ex_ueg -0.7883673E-03 Ec_ueg -0.1860865E-03 Delta_ex -0.9822964E-03 Delta_ec 0.4619689E-03 Delta_et -0.2721712E-02 Pxc 0.4236564E+01 Qxc -0.2126326E+01 3,+1 105 3 +1 1.736148 1.770924 1.742243 Rho 0.1250511E-01 |GRAD(Rho)| 0.7506367E-17 GRAD(Rho)x 0.1103277E-17 GRAD(Rho)y 0.2107630E-17 GRAD(Rho)z -0.7119426E-17 Laplacian 0.6259935E-01 (-1/4)Del**2(Rho)) -0.1564984E-01 Diamond 0.2605290E-02 Metallicity 0.7416329E+00 Ellipticity -0.1248809E+01 Gb(Abramov) 0.1236763E-01 Vb(Abramov) -0.9085425E-02 Hb(Abramov) 0.3282207E-02 Ex_ueg -0.2143721E-02 Ec_ueg -0.4829364E-03 Delta_ex -0.3097322E-02 Delta_ec 0.7885890E-03 Delta_et -0.5990905E-02 Pxc 0.4438930E+01 Qxc -0.3927676E+01 3,+1 106 3 +1 -0.259769 2.922750 0.218047 Rho 0.5828828E-02 |GRAD(Rho)| 0.1153564E-13 GRAD(Rho)x -0.8069277E-14 GRAD(Rho)y 0.1648464E-14 GRAD(Rho)z 0.8077145E-14 Laplacian 0.2367177E-01 (-1/4)Del**2(Rho)) -0.5917942E-02 Diamond 0.5530630E-03 Metallicity 0.5495634E+00 Ellipticity -0.1838606E+01 Gb(Abramov) 0.4487342E-02 Vb(Abramov) -0.3056742E-02 Hb(Abramov) 0.1430600E-02 Ex_ueg -0.7747472E-03 Ec_ueg -0.1827532E-03 Delta_ex -0.1117766E-02 Delta_ec 0.5759088E-03 Delta_et -0.3342021E-02 Pxc 0.4239309E+01 Qxc -0.1940873E+01 3,+1 107 3 +1 0.520918 0.497463 1.663823 Rho 0.8538096E-02 |GRAD(Rho)| 0.8876732E-17 GRAD(Rho)x -0.4791811E-17 GRAD(Rho)y -0.4306628E-17 GRAD(Rho)z -0.6106380E-17 Laplacian 0.3354280E-01 (-1/4)Del**2(Rho)) -0.8385700E-02 Diamond 0.8970903E-03 Metallicity 0.7327383E+00 Ellipticity -0.1445096E+01 Gb(Abramov) 0.6614554E-02 Vb(Abramov) -0.4843408E-02 Hb(Abramov) 0.1771146E-02 Ex_ueg -0.1288842E-02 Ec_ueg -0.3022112E-03 Delta_ex -0.1533314E-02 Delta_ec 0.4786914E-03 Delta_et -0.3260315E-02 Pxc 0.4264707E+01 Qxc -0.3203136E+01 3,+1 108 3 +1 -0.572037 -0.527084 1.690807 Rho 0.8637009E-02 |GRAD(Rho)| 0.1740094E-16 GRAD(Rho)x -0.1548935E-16 GRAD(Rho)y 0.2170221E-17 GRAD(Rho)z 0.7626460E-17 Laplacian 0.3301247E-01 (-1/4)Del**2(Rho)) -0.8253117E-02 Diamond 0.8788780E-03 Metallicity 0.7589400E+00 Ellipticity -0.1457316E+01 Gb(Abramov) 0.6546015E-02 Vb(Abramov) -0.4838913E-02 Hb(Abramov) 0.1707102E-02 Ex_ueg -0.1308789E-02 Ec_ueg -0.3066363E-03 Delta_ex -0.1505405E-02 Delta_ec 0.4567294E-03 Delta_et -0.3131510E-02 Pxc 0.4268212E+01 Qxc -0.3296054E+01 3,+1 109 3 +1 1.728291 -0.587295 -0.547728 Rho 0.6992438E-02 |GRAD(Rho)| 0.9702023E-17 GRAD(Rho)x 0.7464991E-17 GRAD(Rho)y 0.3883323E-17 GRAD(Rho)z -0.4829386E-17 Laplacian 0.2604854E-01 (-1/4)Del**2(Rho)) -0.6512136E-02 Diamond 0.5112347E-03 Metallicity 0.6764111E+00 Ellipticity -0.1384649E+01 Gb(Abramov) 0.5075571E-02 Vb(Abramov) -0.3639006E-02 Hb(Abramov) 0.1436565E-02 Ex_ueg -0.9875442E-03 Ec_ueg -0.2336381E-03 Delta_ex -0.1121064E-02 Delta_ec 0.3508915E-03 Delta_et -0.2286667E-02 Pxc 0.4226812E+01 Qxc -0.3194902E+01 3,+1 110 3 +1 2.193919 0.961877 -1.467738 Rho 0.2311965E-01 |GRAD(Rho)| 0.1478869E-11 GRAD(Rho)x -0.4664104E-12 GRAD(Rho)y 0.9035453E-12 GRAD(Rho)z 0.1073834E-11 Laplacian 0.8667525E-01 (-1/4)Del**2(Rho)) -0.2166881E-01 Diamond 0.8435604E-02 Metallicity 0.1491718E+01 Ellipticity -0.2107851E+01 Gb(Abramov) 0.1983317E-01 Vb(Abramov) -0.1799753E-01 Hb(Abramov) 0.1835643E-02 Ex_ueg -0.4864372E-02 Ec_ueg -0.9945155E-03 Delta_ex -0.5069372E-02 Delta_ec 0.1095471E-02 Delta_et -0.9592554E-02 Pxc 0.4891198E+01 Qxc -0.4627572E+01 3,+1 111 3 +3 -0.013327 2.257127 -0.007969 Rho 0.4930732E-02 |GRAD(Rho)| 0.3288518E-17 GRAD(Rho)x 0.1001599E-17 GRAD(Rho)y 0.1005047E-17 GRAD(Rho)z 0.2966653E-17 Laplacian 0.2017630E-01 (-1/4)Del**2(Rho)) -0.5044076E-02 Diamond 0.1813697E-03 Metallicity 0.4878548E+00 Ellipticity -0.3264297E+00 Gb(Abramov) 0.3772847E-02 Vb(Abramov) -0.2501617E-02 Hb(Abramov) 0.1271229E-02 Ex_ueg -0.6198219E-03 Ec_ueg -0.1439331E-03 Delta_ex -0.7351928E-03 Delta_ec 0.1617391E-03 Delta_et -0.1066472E-02 Pxc 0.4306318E+01 Qxc -0.4545548E+01 3,+3 112 3 -1 -0.521024 0.472530 0.490543 Rho 0.1769299E+00 |GRAD(Rho)| 0.4891985E-14 GRAD(Rho)x -0.2619432E-14 GRAD(Rho)y 0.2955969E-14 GRAD(Rho)z 0.2886580E-14 Laplacian 0.4642437E+00 (-1/4)Del**2(Rho)) -0.1160609E+00 Diamond 0.1166910E+01 Metallicity 0.8276932E+01 Ellipticity 0.8519600E-02 Gb(Abramov) 0.2374787E+00 Vb(Abramov) -0.3588964E+00 Hb(Abramov) -0.1214178E+00 Ex_ueg -0.7335902E-01 Ec_ueg -0.1018917E-01 Delta_ex -0.5210154E-01 Delta_ec 0.1157576E-01 Delta_et -0.1581116E+00 Pxc 0.7199707E+01 Qxc -0.4500919E+01 3,-1 113 3 -1 0.024804 -0.010293 2.963201 Rho 0.5722868E-02 |GRAD(Rho)| 0.5522169E-15 GRAD(Rho)x 0.4236397E-15 GRAD(Rho)y -0.3539330E-15 GRAD(Rho)z -0.1429569E-16 Laplacian 0.2267831E-01 (-1/4)Del**2(Rho)) -0.5669579E-02 Diamond 0.7203533E-03 Metallicity 0.5563635E+00 Ellipticity 0.2591373E+01 Gb(Abramov) 0.4305443E-02 Vb(Abramov) -0.2941308E-02 Hb(Abramov) 0.1364135E-02 Ex_ueg -0.7560260E-03 Ec_ueg -0.1781522E-03 Delta_ex -0.1224448E-02 Delta_ec 0.8334539E-03 Delta_et -0.4666000E-02 Pxc 0.4243709E+01 Qxc -0.1469125E+01 3,-1 114 3 +3 0.002829 -0.011748 2.309380 Rho 0.4715880E-02 |GRAD(Rho)| 0.8286177E-17 GRAD(Rho)x -0.5152678E-17 GRAD(Rho)y 0.5814921E-17 GRAD(Rho)z -0.2880509E-17 Laplacian 0.1929471E-01 (-1/4)Del**2(Rho)) -0.4823679E-02 Diamond 0.1666580E-03 Metallicity 0.4736375E+00 Ellipticity -0.3045789E+00 Gb(Abramov) 0.3596565E-02 Vb(Abramov) -0.2369451E-02 Hb(Abramov) 0.1227114E-02 Ex_ueg -0.5840752E-03 Ec_ueg -0.1347065E-03 Delta_ex -0.6983526E-03 Delta_ec 0.1607897E-03 Delta_et -0.1039730E-02 Pxc 0.4335908E+01 Qxc -0.4343266E+01 3,+3 115 3 +1 0.160616 -0.142036 2.969502 Rho 0.5699008E-02 |GRAD(Rho)| 0.8366726E-17 GRAD(Rho)x 0.5370395E-17 GRAD(Rho)y 0.6093244E-17 GRAD(Rho)z 0.2008319E-17 Laplacian 0.2327101E-01 (-1/4)Del**2(Rho)) -0.5817753E-02 Diamond 0.6224344E-03 Metallicity 0.5384310E+00 Ellipticity -0.3068545E+01 Gb(Abramov) 0.4400578E-02 Vb(Abramov) -0.2983404E-02 Hb(Abramov) 0.1417175E-02 Ex_ueg -0.7518261E-03 Ec_ueg -0.1771169E-03 Delta_ex -0.1167651E-02 Delta_ec 0.6984387E-03 Delta_et -0.3958580E-02 Pxc 0.4244802E+01 Qxc -0.1671802E+01 3,+1 116 3 -1 -0.553544 1.744205 1.771084 Rho 0.4902804E-01 |GRAD(Rho)| 0.1138284E-13 GRAD(Rho)x 0.3761586E-14 GRAD(Rho)y 0.7613675E-14 GRAD(Rho)z 0.7579674E-14 Laplacian 0.1982612E+00 (-1/4)Del**2(Rho)) -0.4956529E-01 Diamond 0.9719673E-01 Metallicity 0.2282705E+01 Ellipticity 0.1526298E-01 Gb(Abramov) 0.5190068E-01 Vb(Abramov) -0.5423607E-01 Hb(Abramov) -0.2335393E-02 Ex_ueg -0.1325291E-01 Ec_ueg -0.2361219E-02 Delta_ex -0.1620973E-01 Delta_ec 0.5856080E-02 Delta_et -0.6142102E-01 Pxc 0.5612740E+01 Qxc -0.2768018E+01 3,-1 117 3 -1 -0.604991 -2.834918 1.869846 Rho 0.1602558E+00 |GRAD(Rho)| 0.7404479E-15 GRAD(Rho)x 0.4325425E-15 GRAD(Rho)y -0.7071709E-16 GRAD(Rho)z 0.5967991E-15 Laplacian 0.6544321E+00 (-1/4)Del**2(Rho)) -0.1636080E+00 Diamond 0.1428503E+01 Metallicity 0.4978571E+01 Ellipticity 0.1355627E-01 Gb(Abramov) 0.2448277E+00 Vb(Abramov) -0.3260474E+00 Hb(Abramov) -0.8121970E-01 Ex_ueg -0.6428900E-01 Ec_ueg -0.9103232E-02 Delta_ex -0.7136986E-01 Delta_ec 0.1621167E-01 Delta_et -0.2174172E+00 Pxc 0.7062217E+01 Qxc -0.4402376E+01 3,-1 118 3 +1 0.437269 -0.917788 -1.827318 Rho 0.4048903E-02 |GRAD(Rho)| 0.3204545E-15 GRAD(Rho)x 0.1127750E-15 GRAD(Rho)y 0.2327442E-15 GRAD(Rho)z 0.1892169E-15 Laplacian 0.1544438E-01 (-1/4)Del**2(Rho)) -0.3861095E-02 Diamond 0.2411897E-03 Metallicity 0.4589214E+00 Ellipticity -0.1956492E+01 Gb(Abramov) 0.2869386E-02 Vb(Abramov) -0.1877678E-02 Hb(Abramov) 0.9917084E-03 Ex_ueg -0.4766155E-03 Ec_ueg -0.1062156E-03 Delta_ex -0.7007271E-03 Delta_ec 0.4202613E-03 Delta_et -0.2169132E-02 Pxc 0.4487244E+01 Qxc -0.1667361E+01 3,+1 119 3 -1 -0.851364 2.039294 3.065682 Rho 0.1622516E+00 |GRAD(Rho)| 0.2796823E-15 GRAD(Rho)x -0.1313240E-15 GRAD(Rho)y -0.7535205E-17 GRAD(Rho)z 0.2468186E-15 Laplacian 0.6292509E+00 (-1/4)Del**2(Rho)) -0.1573127E+00 Diamond 0.1397870E+01 Metallicity 0.5285724E+01 Ellipticity 0.3975091E-01 Gb(Abramov) 0.2434604E+00 Vb(Abramov) -0.3296081E+00 Hb(Abramov) -0.8614771E-01 Ex_ueg -0.6535877E-01 Ec_ueg -0.9232354E-02 Delta_ex -0.6886886E-01 Delta_ec 0.1559907E-01 Delta_et -0.2096804E+00 Pxc 0.7079318E+01 Qxc -0.4414933E+01 3,-1 120 3 -1 -0.561286 2.705043 -1.827554 Rho 0.1529667E+00 |GRAD(Rho)| 0.9931722E-15 GRAD(Rho)x -0.4088797E-15 GRAD(Rho)y 0.2693023E-15 GRAD(Rho)z 0.8641091E-15 Laplacian 0.6363441E+00 (-1/4)Del**2(Rho)) -0.1590860E+00 Diamond 0.1307801E+01 Metallicity 0.4737867E+01 Ellipticity 0.7154106E-02 Gb(Abramov) 0.2316787E+00 Vb(Abramov) -0.3042714E+00 Hb(Abramov) -0.7259271E-01 Ex_ueg -0.6042005E-01 Ec_ueg -0.8633697E-02 Delta_ex -0.6854681E-01 Delta_ec 0.1585132E-01 Delta_et -0.2110694E+00 Pxc 0.6998166E+01 Qxc -0.4324360E+01 3,-1 121 3 -1 -0.841687 3.048967 2.041672 Rho 0.1468402E+00 |GRAD(Rho)| 0.3098787E-15 GRAD(Rho)x 0.2592192E-15 GRAD(Rho)y -0.2865004E-16 GRAD(Rho)z 0.1673602E-15 Laplacian 0.5699751E+00 (-1/4)Del**2(Rho)) -0.1424938E+00 Diamond 0.1124312E+01 Metallicity 0.4941197E+01 Ellipticity 0.2621189E-01 Gb(Abramov) 0.2123442E+00 Vb(Abramov) -0.2821946E+00 Hb(Abramov) -0.6985039E-01 Ex_ueg -0.5721524E-01 Ec_ueg -0.8241549E-02 Delta_ex -0.6087471E-01 Delta_ec 0.1450912E-01 Delta_et -0.1925016E+00 Pxc 0.6942291E+01 Qxc -0.4195618E+01 3,-1 122 3 -1 -0.565106 -1.813907 2.823558 Rho 0.1512167E+00 |GRAD(Rho)| 0.1706511E-15 GRAD(Rho)x -0.3697129E-16 GRAD(Rho)y -0.1313782E-15 GRAD(Rho)z -0.1024436E-15 Laplacian 0.6260923E+00 (-1/4)Del**2(Rho)) -0.1565231E+00 Diamond 0.1270056E+01 Metallicity 0.4723975E+01 Ellipticity 0.8197075E-02 Gb(Abramov) 0.2275839E+00 Vb(Abramov) -0.2986447E+00 Hb(Abramov) -0.7106081E-01 Ex_ueg -0.5950013E-01 Ec_ueg -0.8521443E-02 Delta_ex -0.6726083E-01 Delta_ec 0.1565839E-01 Delta_et -0.2082218E+00 Pxc 0.6982400E+01 Qxc -0.4295515E+01 3,-1 123 3 +1 -0.231795 -1.312356 -2.515991 Rho 0.3157059E-02 |GRAD(Rho)| 0.5640808E-17 GRAD(Rho)x -0.3866375E-17 GRAD(Rho)y 0.8995724E-18 GRAD(Rho)z 0.4007571E-17 Laplacian 0.1210116E-01 (-1/4)Del**2(Rho)) -0.3025290E-02 Diamond 0.1071371E-03 Metallicity 0.3868929E+00 Ellipticity -0.1313175E+01 Gb(Abramov) 0.2211937E-02 Vb(Abramov) -0.1398584E-02 Hb(Abramov) 0.8133528E-03 Ex_ueg -0.3420545E-03 Ec_ueg -0.6848661E-04 Delta_ex -0.4750123E-03 Delta_ec 0.2430611E-03 Delta_et -0.1206283E-02 Pxc 0.4994473E+01 Qxc -0.1954292E+01 3,+1 124 3 +3 1.097689 1.079976 1.088997 Rho 0.4909298E-02 |GRAD(Rho)| 0.1048349E-11 GRAD(Rho)x 0.1046378E-11 GRAD(Rho)y 0.4983934E-13 GRAD(Rho)z 0.4054988E-13 Laplacian 0.1938457E-01 (-1/4)Del**2(Rho)) -0.4846144E-02 Diamond 0.1369444E-03 Metallicity 0.5041068E+00 Ellipticity -0.1166444E+00 Gb(Abramov) 0.3637925E-02 Vb(Abramov) -0.2429706E-02 Hb(Abramov) 0.1208219E-02 Ex_ueg -0.6162320E-03 Ec_ueg -0.1430116E-03 Delta_ex -0.6710189E-03 Delta_ec 0.9376169E-04 Delta_et -0.7157048E-03 Pxc 0.4308965E+01 Qxc -0.7156642E+01 3,+3 125 3 -1 0.273807 -1.235158 -1.905750 Rho 0.4151691E-02 |GRAD(Rho)| 0.3074245E-16 GRAD(Rho)x 0.2569180E-16 GRAD(Rho)y -0.1580718E-16 GRAD(Rho)z 0.5929808E-17 Laplacian 0.1601651E-01 (-1/4)Del**2(Rho)) -0.4004128E-02 Diamond 0.3335304E-03 Metallicity 0.4614100E+00 Ellipticity 0.1238040E+01 Gb(Abramov) 0.2977343E-02 Vb(Abramov) -0.1950557E-02 Hb(Abramov) 0.1026785E-02 Ex_ueg -0.4928164E-03 Ec_ueg -0.1105913E-03 Delta_ex -0.8193212E-03 Delta_ec 0.5948013E-03 Delta_et -0.3017357E-02 Pxc 0.4456195E+01 Qxc -0.1377470E+01 3,-1 126 3 +1 1.524613 0.885236 -2.167544 Rho 0.2471535E-01 |GRAD(Rho)| 0.1576889E-16 GRAD(Rho)x 0.1021081E-16 GRAD(Rho)y -0.1179892E-16 GRAD(Rho)z -0.2276573E-17 Laplacian 0.9447063E-01 (-1/4)Del**2(Rho)) -0.2361766E-01 Diamond 0.9755030E-02 Metallicity 0.1529658E+01 Ellipticity -0.2002336E+01 Gb(Abramov) 0.2176626E-01 Vb(Abramov) -0.1991486E-01 Hb(Abramov) 0.1851397E-02 Ex_ueg -0.5317090E-02 Ec_ueg -0.1074393E-02 Delta_ex -0.5592141E-02 Delta_ec 0.1129098E-02 Delta_et -0.1005260E-01 Pxc 0.4948925E+01 Qxc -0.4952752E+01 3,+1 127 3 -1 0.513530 1.653876 -1.742062 Rho 0.5041017E-01 |GRAD(Rho)| 0.8210328E-16 GRAD(Rho)x 0.1605742E-16 GRAD(Rho)y -0.2810879E-16 GRAD(Rho)z 0.7545200E-16 Laplacian 0.2011739E+00 (-1/4)Del**2(Rho)) -0.5029348E-01 Diamond 0.1022463E+00 Metallicity 0.2356342E+01 Ellipticity 0.2750581E-01 Gb(Abramov) 0.5328043E-01 Vb(Abramov) -0.5626738E-01 Hb(Abramov) -0.2986950E-02 Ex_ueg -0.1375337E-01 Ec_ueg -0.2437559E-02 Delta_ex -0.1655601E-01 Delta_ec 0.5927352E-02 Delta_et -0.6261675E-01 Pxc 0.5642273E+01 Qxc -0.2793154E+01 3,-1 128 3 -1 1.787825 0.459243 -1.753782 Rho 0.3403357E-01 |GRAD(Rho)| 0.8146690E-09 GRAD(Rho)x -0.5642588E-09 GRAD(Rho)y 0.2724442E-09 GRAD(Rho)z 0.5206454E-09 Laplacian 0.1419763E+00 (-1/4)Del**2(Rho)) -0.3549409E-01 Diamond 0.4565521E-01 Metallicity 0.1734775E+01 Ellipticity 0.3173527E-01 Gb(Abramov) 0.3392510E-01 Vb(Abramov) -0.3235611E-01 Hb(Abramov) 0.1568987E-02 Ex_ueg -0.8145701E-02 Ec_ueg -0.1553479E-02 Delta_ex -0.1083773E-01 Delta_ec 0.4626047E-02 Delta_et -0.4400285E-01 Pxc 0.5243521E+01 Qxc -0.2342763E+01 3,-1 129 3 +1 3.032894 -0.132337 0.137375 Rho 0.4936675E-02 |GRAD(Rho)| 0.1689505E-14 GRAD(Rho)x 0.1035567E-15 GRAD(Rho)y -0.1055255E-14 GRAD(Rho)z 0.1315348E-14 Laplacian 0.1940612E-01 (-1/4)Del**2(Rho)) -0.4851530E-02 Diamond 0.4419270E-03 Metallicity 0.5082359E+00 Ellipticity -0.3393023E+01 Gb(Abramov) 0.3645307E-02 Vb(Abramov) -0.2439084E-02 Hb(Abramov) 0.1206223E-02 Ex_ueg -0.6208182E-03 Ec_ueg -0.1441887E-03 Delta_ex -0.9597112E-03 Delta_ec 0.6061306E-03 Delta_et -0.3281226E-02 Pxc 0.4305596E+01 Qxc -0.1583341E+01 3,+1 130 3 +1 1.443020 -2.209921 0.970001 Rho 0.2530186E-01 |GRAD(Rho)| 0.7968167E-16 GRAD(Rho)x 0.5568475E-16 GRAD(Rho)y -0.1232692E-16 GRAD(Rho)z -0.5564553E-16 Laplacian 0.9721408E-01 (-1/4)Del**2(Rho)) -0.2430352E-01 Diamond 0.1065642E-01 Metallicity 0.1545746E+01 Ellipticity -0.2108582E+01 Gb(Abramov) 0.2246352E-01 Vb(Abramov) -0.2062353E-01 Hb(Abramov) 0.1839997E-02 Ex_ueg -0.5485989E-02 Ec_ueg -0.1103924E-02 Delta_ex -0.5822997E-02 Delta_ec 0.1216485E-02 Delta_et -0.1086645E-01 Pxc 0.4969534E+01 Qxc -0.4786738E+01 3,+1 131 3 -1 0.487987 -1.758853 1.731892 Rho 0.4614227E-01 |GRAD(Rho)| 0.5922718E-16 GRAD(Rho)x -0.6682243E-17 GRAD(Rho)y 0.5882136E-16 GRAD(Rho)z 0.1804180E-17 Laplacian 0.1835571E+00 (-1/4)Del**2(Rho)) -0.4588929E-01 Diamond 0.8257235E-01 Metallicity 0.2228470E+01 Ellipticity 0.3837709E-01 Gb(Abramov) 0.4763668E-01 Vb(Abramov) -0.4938407E-01 Hb(Abramov) -0.1747390E-02 Ex_ueg -0.1222317E-01 Ec_ueg -0.2202769E-02 Delta_ex -0.1476649E-01 Delta_ec 0.5399244E-02 Delta_et -0.5572944E-01 Pxc 0.5549000E+01 Qxc -0.2734918E+01 3,-1 132 3 -1 0.530026 2.777882 1.807538 Rho 0.1307162E+00 |GRAD(Rho)| 0.6406085E-14 GRAD(Rho)x -0.3818641E-14 GRAD(Rho)y 0.1694411E-14 GRAD(Rho)z 0.4856426E-14 Laplacian 0.5423255E+00 (-1/4)Del**2(Rho)) -0.1355814E+00 Diamond 0.9339707E+00 Metallicity 0.4277946E+01 Ellipticity 0.1115520E-01 Gb(Abramov) 0.1870559E+00 Vb(Abramov) -0.2385304E+00 Hb(Abramov) -0.5147451E-01 Ex_ueg -0.4899564E-01 Ec_ueg -0.7220751E-02 Delta_ex -0.5634984E-01 Delta_ec 0.1428059E-01 Delta_et -0.1863026E+00 Pxc 0.6785395E+01 Qxc -0.3945903E+01 3,-1 133 3 -1 0.109647 3.215162 3.231680 Rho 0.2306824E+00 |GRAD(Rho)| 0.1483496E-15 GRAD(Rho)x -0.1252254E-15 GRAD(Rho)y -0.4792174E-16 GRAD(Rho)z -0.6348004E-16 Laplacian 0.8536287E+00 (-1/4)Del**2(Rho)) -0.2134072E+00 Diamond 0.2872649E+01 Metallicity 0.7004356E+01 Ellipticity 0.9872041E-03 Gb(Abramov) 0.3914014E+00 Vb(Abramov) -0.5693957E+00 Hb(Abramov) -0.1779942E+00 Ex_ueg -0.1044891E+00 Ec_ueg -0.1379739E-01 Delta_ex -0.1020438E+00 Delta_ec 0.1901887E-01 Delta_et -0.2627867E+00 Pxc 0.7573105E+01 Qxc -0.5365399E+01 3,-1 134 3 -1 0.404766 -0.499392 0.460298 Rho 0.1796381E+00 |GRAD(Rho)| 0.1702859E-15 GRAD(Rho)x 0.1630640E-15 GRAD(Rho)y -0.6938894E-17 GRAD(Rho)z 0.4857226E-16 Laplacian 0.4674882E+00 (-1/4)Del**2(Rho)) -0.1168720E+00 Diamond 0.1202198E+01 Metallicity 0.8430239E+01 Ellipticity 0.2894879E-02 Gb(Abramov) 0.2421246E+00 Vb(Abramov) -0.3673771E+00 Hb(Abramov) -0.1252525E+00 Ex_ueg -0.7485996E-01 Ec_ueg -0.1036707E-01 Delta_ex -0.5270852E-01 Delta_ec 0.1168775E-01 Delta_et -0.1601422E+00 Pxc 0.7220940E+01 Qxc -0.4509724E+01 3,-1 135 3 -1 0.420225 0.435438 -0.478137 Rho 0.1792662E+00 |GRAD(Rho)| 0.2864973E-15 GRAD(Rho)x 0.1283695E-15 GRAD(Rho)y 0.1214306E-15 GRAD(Rho)z -0.2255141E-15 Laplacian 0.4686172E+00 (-1/4)Del**2(Rho)) -0.1171543E+00 Diamond 0.1201670E+01 Metallicity 0.8380927E+01 Ellipticity 0.5530690E-02 Gb(Abramov) 0.2417465E+00 Vb(Abramov) -0.3663387E+00 Hb(Abramov) -0.1245922E+00 Ex_ueg -0.7465338E-01 Ec_ueg -0.1034261E-01 Delta_ex -0.5280502E-01 Delta_ec 0.1171616E-01 Delta_et -0.1604756E+00 Pxc 0.7218041E+01 Qxc -0.4507026E+01 3,-1 136 3 -1 -0.595345 -0.460105 -0.461910 Rho 0.1896367E+00 |GRAD(Rho)| 0.2747005E-15 GRAD(Rho)x 0.1283695E-15 GRAD(Rho)y 0.1457168E-15 GRAD(Rho)z 0.1942890E-15 Laplacian 0.5186669E+00 (-1/4)Del**2(Rho)) -0.1296667E+00 Diamond 0.1401938E+01 Metallicity 0.8316267E+01 Ellipticity 0.1982177E-01 Gb(Abramov) 0.2661683E+00 Vb(Abramov) -0.4026699E+00 Hb(Abramov) -0.1365016E+00 Ex_ueg -0.8046643E-01 Ec_ueg -0.1102751E-01 Delta_ex -0.5912247E-01 Delta_ec 0.1250479E-01 Delta_et -0.1714886E+00 Pxc 0.7296882E+01 Qxc -0.4727985E+01 3,-1 137 3 -1 0.053784 -3.287315 -1.328389 Rho 0.4169965E-01 |GRAD(Rho)| 0.9207807E-16 GRAD(Rho)x -0.8971871E-16 GRAD(Rho)y -0.2026304E-16 GRAD(Rho)z 0.4281772E-17 Laplacian 0.1142812E+00 (-1/4)Del**2(Rho)) -0.2857031E-01 Diamond 0.6998084E-01 Metallicity 0.3023608E+01 Ellipticity 0.3031291E-02 Gb(Abramov) 0.3344444E-01 Vb(Abramov) -0.3831858E-01 Hb(Abramov) -0.4874134E-02 Ex_ueg -0.1067976E-01 Ec_ueg -0.1961479E-02 Delta_ex -0.1034631E-01 Delta_ec 0.5832540E-02 Delta_et -0.5896502E-01 Pxc 0.5444750E+01 Qxc -0.1773895E+01 3,-1 138 3 -1 0.828132 -3.012240 2.058450 Rho 0.1562604E+00 |GRAD(Rho)| 0.5798286E-16 GRAD(Rho)x 0.4128100E-16 GRAD(Rho)y 0.3648340E-16 GRAD(Rho)z -0.1807907E-16 Laplacian 0.6146288E+00 (-1/4)Del**2(Rho)) -0.1536572E+00 Diamond 0.1299863E+01 Metallicity 0.5082550E+01 Ellipticity 0.4127837E-01 Gb(Abramov) 0.2325998E+00 Vb(Abramov) -0.3115425E+00 Hb(Abramov) -0.7894265E-01 Ex_ueg -0.6216083E-01 Ec_ueg -0.8845464E-02 Delta_ex -0.6659491E-01 Delta_ec 0.1529494E-01 Delta_et -0.2043924E+00 Pxc 0.7027424E+01 Qxc -0.4354047E+01 3,-1 139 3 -1 1.234644 -2.398706 -2.090657 Rho 0.4601638E-01 |GRAD(Rho)| 0.2593021E-16 GRAD(Rho)x -0.6023534E-17 GRAD(Rho)y -0.1545322E-16 GRAD(Rho)z 0.1993215E-16 Laplacian 0.1202740E+00 (-1/4)Del**2(Rho)) -0.3006851E-01 Diamond 0.8194382E-01 Metallicity 0.3385546E+01 Ellipticity 0.1305197E-01 Gb(Abramov) 0.3701206E-01 Vb(Abramov) -0.4395561E-01 Hb(Abramov) -0.6943549E-02 Ex_ueg -0.1217872E-01 Ec_ueg -0.2195887E-02 Delta_ex -0.1101895E-01 Delta_ec 0.5948150E-02 Delta_et -0.6187989E-01 Pxc 0.5546151E+01 Qxc -0.1852501E+01 3,-1 140 3 -1 2.984269 -2.032244 0.827704 Rho 0.7118113E-01 |GRAD(Rho)| 0.1217785E-15 GRAD(Rho)x 0.9723938E-18 GRAD(Rho)y 0.9343451E-16 GRAD(Rho)z 0.7809644E-16 Laplacian 0.2987518E+00 (-1/4)Del**2(Rho)) -0.7468794E-01 Diamond 0.2536714E+00 Metallicity 0.2819968E+01 Ellipticity 0.2010138E-01 Gb(Abramov) 0.8489489E-01 Vb(Abramov) -0.9510184E-01 Hb(Abramov) -0.1020695E-01 Ex_ueg -0.2178737E-01 Ec_ueg -0.3615440E-02 Delta_ex -0.2714756E-01 Delta_ec 0.9303935E-02 Delta_et -0.1075646E+00 Pxc 0.6026203E+01 Qxc -0.2917858E+01 3,-1 141 3 +3 1.943046 -1.943332 1.939261 Rho 0.1159176E-01 |GRAD(Rho)| 0.2066836E-14 GRAD(Rho)x -0.1245337E-14 GRAD(Rho)y 0.1193005E-14 GRAD(Rho)z -0.1139160E-14 Laplacian 0.5219016E-01 (-1/4)Del**2(Rho)) -0.1304754E-01 Diamond 0.1291381E-02 Metallicity 0.7839231E+00 Ellipticity -0.8356574E+00 Gb(Abramov) 0.1040307E-01 Vb(Abramov) -0.7758603E-02 Hb(Abramov) 0.2644469E-02 Ex_ueg -0.1937541E-02 Ec_ueg -0.4407561E-03 Delta_ex -0.2329358E-02 Delta_ec 0.2976080E-03 Delta_et -0.2509876E-02 Pxc 0.4395948E+01 Qxc -0.7826931E+01 3,+3 142 3 -1 0.549311 1.814098 2.782488 Rho 0.1488978E+00 |GRAD(Rho)| 0.3487453E-15 GRAD(Rho)x -0.3152995E-15 GRAD(Rho)y 0.4130810E-16 GRAD(Rho)z -0.1431892E-15 Laplacian 0.6212439E+00 (-1/4)Del**2(Rho)) -0.1553110E+00 Diamond 0.1244684E+01 Metallicity 0.4639787E+01 Ellipticity 0.1546304E-01 Gb(Abramov) 0.2236423E+00 Vb(Abramov) -0.2919736E+00 Hb(Abramov) -0.6833133E-01 Ex_ueg -0.5828669E-01 Ec_ueg -0.8372994E-02 Delta_ex -0.6656313E-01 Delta_ec 0.1573444E-01 Delta_et -0.2091110E+00 Pxc 0.6961272E+01 Qxc -0.4230411E+01 3,-1 143 3 -1 0.837176 1.924149 -3.014755 Rho 0.1540727E+00 |GRAD(Rho)| 0.3851123E-13 GRAD(Rho)x -0.2782597E-13 GRAD(Rho)y 0.2292658E-13 GRAD(Rho)z 0.1353522E-13 Laplacian 0.6090924E+00 (-1/4)Del**2(Rho)) -0.1522731E+00 Diamond 0.1264471E+01 Metallicity 0.5009637E+01 Ellipticity 0.4262734E-01 Gb(Abramov) 0.2286542E+00 Vb(Abramov) -0.3050354E+00 Hb(Abramov) -0.7638114E-01 Ex_ueg -0.6100322E-01 Ec_ueg -0.8704735E-02 Delta_ex -0.6574553E-01 Delta_ec 0.1517585E-01 Delta_et -0.2023418E+00 Pxc 0.7008050E+01 Qxc -0.4332247E+01 3,-1 144 3 -1 1.708402 1.701981 -0.539344 Rho 0.4422013E-01 |GRAD(Rho)| 0.1539704E-15 GRAD(Rho)x 0.7506533E-16 GRAD(Rho)y 0.1161223E-15 GRAD(Rho)z 0.6773257E-16 Laplacian 0.1749202E+00 (-1/4)Del**2(Rho)) -0.4373005E-01 Diamond 0.7403884E-01 Metallicity 0.2178411E+01 Ellipticity 0.1591460E-01 Gb(Abramov) 0.4503037E-01 Vb(Abramov) -0.4633069E-01 Hb(Abramov) -0.1300321E-02 Ex_ueg -0.1154902E-01 Ec_ueg -0.2097967E-02 Delta_ex -0.1391101E-01 Delta_ec 0.5126406E-02 Delta_et -0.5231792E-01 Pxc 0.5504862E+01 Qxc -0.2713599E+01 3,-1 145 3 +1 1.257387 2.138218 -1.185884 Rho 0.2762335E-01 |GRAD(Rho)| 0.1147076E-14 GRAD(Rho)x 0.7281146E-15 GRAD(Rho)y 0.8532544E-15 GRAD(Rho)z 0.2399771E-15 Laplacian 0.1100920E+00 (-1/4)Del**2(Rho)) -0.2752299E-01 Diamond 0.1725674E-01 Metallicity 0.1579979E+01 Ellipticity -0.5497698E+01 Gb(Abramov) 0.2559629E-01 Vb(Abramov) -0.2366959E-01 Hb(Abramov) 0.1926704E-02 Ex_ueg -0.6167184E-02 Ec_ueg -0.1221682E-02 Delta_ex -0.7102722E-02 Delta_ec 0.1993248E-02 Delta_et -0.1800615E-01 Pxc 0.5048110E+01 Qxc -0.3563392E+01 3,+1 146 3 -1 0.829167 2.939013 -2.009035 Rho 0.1318073E+00 |GRAD(Rho)| 0.5002303E-13 GRAD(Rho)x 0.2149806E-13 GRAD(Rho)y -0.2131338E-13 GRAD(Rho)z 0.3982307E-13 Laplacian 0.5116195E+00 (-1/4)Del**2(Rho)) -0.1279049E+00 Diamond 0.8905309E+00 Metallicity 0.4597957E+01 Ellipticity 0.3783811E-01 Gb(Abramov) 0.1832868E+00 Vb(Abramov) -0.2386687E+00 Hb(Abramov) -0.5538190E-01 Ex_ueg -0.4954169E-01 Ec_ueg -0.7289298E-02 Delta_ex -0.5327312E-01 Delta_ec 0.1345790E-01 Delta_et -0.1758297E+00 Pxc 0.6796497E+01 Qxc -0.3958501E+01 3,-1 147 3 +1 1.997966 1.933644 -1.999336 Rho 0.1167781E-01 |GRAD(Rho)| 0.1128100E-16 GRAD(Rho)x -0.3290060E-17 GRAD(Rho)y -0.8805396E-17 GRAD(Rho)z -0.6237110E-17 Laplacian 0.5279448E-01 (-1/4)Del**2(Rho)) -0.1319862E-01 Diamond 0.1458281E-02 Metallicity 0.7845612E+00 Ellipticity -0.1027093E+01 Gb(Abramov) 0.1052493E-01 Vb(Abramov) -0.7851248E-02 Hb(Abramov) 0.2673686E-02 Ex_ueg -0.1956742E-02 Ec_ueg -0.4447160E-03 Delta_ex -0.2402823E-02 Delta_ec 0.3751196E-03 Delta_et -0.3035830E-02 Pxc 0.4399980E+01 Qxc -0.6405485E+01 3,+1 148 3 +1 0.169269 2.907337 -0.205583 Rho 0.5970579E-02 |GRAD(Rho)| 0.6879205E-14 GRAD(Rho)x 0.4862090E-14 GRAD(Rho)y 0.6210553E-15 GRAD(Rho)z -0.4826783E-14 Laplacian 0.2464599E-01 (-1/4)Del**2(Rho)) -0.6161498E-02 Diamond 0.6759411E-03 Metallicity 0.5494072E+00 Ellipticity -0.2622551E+01 Gb(Abramov) 0.4671860E-02 Vb(Abramov) -0.3182223E-02 Hb(Abramov) 0.1489637E-02 Ex_ueg -0.7999700E-03 Ec_ueg -0.1889170E-03 Delta_ex -0.1229263E-02 Delta_ec 0.7058091E-03 Delta_et -0.4070237E-02 Pxc 0.4234506E+01 Qxc -0.1741637E+01 3,+1 149 3 -1 1.271455 -1.874018 -2.676809 Rho 0.3033621E+00 |GRAD(Rho)| 0.1041904E-14 GRAD(Rho)x -0.1497666E-15 GRAD(Rho)y -0.1019451E-14 GRAD(Rho)z -0.1544497E-15 Laplacian -0.1471613E+01 (-1/4)Del**2(Rho)) 0.3679031E+00 Diamond 0.4945130E+01 Metallicity -0.6413403E+01 Ellipticity 0.1719747E-02 Gb(Abramov) 0.1479831E+00 Vb(Abramov) -0.6638693E+00 Hb(Abramov) -0.5158862E+00 Ex_ueg -0.1505452E+00 Ec_ueg -0.1892921E-01 Delta_ex 0.1430275E+00 Delta_ec 0.5219681E-01 Delta_et -0.1209120E+01 Pxc 0.7953060E+01 Qxc 0.2740158E+01 3,-1 150 3 -1 1.677755 -1.803476 0.457906 Rho 0.3756389E-01 |GRAD(Rho)| 0.1055821E-15 GRAD(Rho)x 0.4332574E-16 GRAD(Rho)y -0.7756238E-16 GRAD(Rho)z -0.5704852E-16 Laplacian 0.1581008E+00 (-1/4)Del**2(Rho)) -0.3952519E-01 Diamond 0.5891554E-01 Metallicity 0.1836384E+01 Ellipticity 0.1213335E-01 Gb(Abramov) 0.3844736E-01 Vb(Abramov) -0.3736954E-01 Hb(Abramov) 0.1077826E-02 Ex_ueg -0.9291357E-02 Ec_ueg -0.1739969E-02 Delta_ex -0.1240819E-01 Delta_ec 0.5236986E-02 Delta_et -0.5120719E-01 Pxc 0.5339957E+01 Qxc -0.2369337E+01 3,-1 151 3 -1 0.827983 -1.975789 3.028376 Rho 0.1169313E+00 |GRAD(Rho)| 0.5614687E-14 GRAD(Rho)x -0.4351080E-14 GRAD(Rho)y -0.2830323E-14 GRAD(Rho)z -0.2140581E-14 Laplacian 0.4572127E+00 (-1/4)Del**2(Rho)) -0.1143032E+00 Diamond 0.6876900E+00 Metallicity 0.4214179E+01 Ellipticity 0.2470549E-01 Gb(Abramov) 0.1564845E+00 Vb(Abramov) -0.1986657E+00 Hb(Abramov) -0.4218129E-01 Ex_ueg -0.4223050E-01 Ec_ueg -0.6361644E-02 Delta_ex -0.4624274E-01 Delta_ec 0.1233475E-01 Delta_et -0.1578500E+00 Pxc 0.6638299E+01 Qxc -0.3748982E+01 3,-1 152 3 +1 1.153990 -1.272868 2.189436 Rho 0.2631262E-01 |GRAD(Rho)| 0.3519415E-13 GRAD(Rho)x 0.2706966E-13 GRAD(Rho)y 0.2118266E-13 GRAD(Rho)z 0.7560187E-14 Laplacian 0.1044396E+00 (-1/4)Del**2(Rho)) -0.2610991E-01 Diamond 0.1542783E-01 Metallicity 0.1535871E+01 Ellipticity -0.5285807E+01 Gb(Abramov) 0.2409018E-01 Vb(Abramov) -0.2207045E-01 Hb(Abramov) 0.2019729E-02 Ex_ueg -0.5780125E-02 Ec_ueg -0.1155027E-02 Delta_ex -0.6663342E-02 Delta_ec 0.1911919E-02 Delta_et -0.1706135E-01 Pxc 0.5004320E+01 Qxc -0.3485159E+01 3,+1 153 3 -1 1.804930 0.546754 2.762504 Rho 0.1225330E+00 |GRAD(Rho)| 0.3810473E-13 GRAD(Rho)x 0.1367951E-14 GRAD(Rho)y 0.3655270E-13 GRAD(Rho)z -0.1067706E-13 Laplacian 0.5171622E+00 (-1/4)Del**2(Rho)) -0.1292906E+00 Diamond 0.8209508E+00 Metallicity 0.4027863E+01 Ellipticity 0.8568342E-02 Gb(Abramov) 0.1729878E+00 Vb(Abramov) -0.2166851E+00 Hb(Abramov) -0.4369726E-01 Ex_ueg -0.4494925E-01 Ec_ueg -0.6709184E-02 Delta_ex -0.5286741E-01 Delta_ec 0.1375565E-01 Delta_et -0.1774034E+00 Pxc 0.6699659E+01 Qxc -0.3843324E+01 3,-1 154 3 -1 1.801779 -2.931777 -0.669288 Rho 0.1776355E+00 |GRAD(Rho)| 0.1887714E-15 GRAD(Rho)x -0.1218643E-15 GRAD(Rho)y -0.1497554E-16 GRAD(Rho)z 0.1433857E-15 Laplacian 0.6950775E+00 (-1/4)Del**2(Rho)) -0.1737694E+00 Diamond 0.1722382E+01 Metallicity 0.5564971E+01 Ellipticity 0.6983347E-02 Gb(Abramov) 0.2770165E+00 Vb(Abramov) -0.3802637E+00 Hb(Abramov) -0.1032471E+00 Ex_ueg -0.7374934E-01 Ec_ueg -0.1023548E-01 Delta_ex -0.7782212E-01 Delta_ec 0.1684360E-01 Delta_et -0.2288260E+00 Pxc 0.7205267E+01 Qxc -0.4620279E+01 3,-1 155 3 -1 1.961448 -3.055761 0.853558 Rho 0.1026159E+00 |GRAD(Rho)| 0.2141402E-15 GRAD(Rho)x -0.5046961E-16 GRAD(Rho)y -0.1230095E-15 GRAD(Rho)z 0.1678616E-15 Laplacian 0.4230614E+00 (-1/4)Del**2(Rho)) -0.1057654E+00 Diamond 0.5633638E+00 Metallicity 0.3663541E+01 Ellipticity 0.9368850E-02 Gb(Abramov) 0.1350895E+00 Vb(Abramov) -0.1644137E+00 Hb(Abramov) -0.2932417E-01 Ex_ueg -0.3548173E-01 Ec_ueg -0.5483787E-02 Delta_ex -0.4181710E-01 Delta_ec 0.1233603E-01 Delta_et -0.1547939E+00 Pxc 0.6470297E+01 Qxc -0.3389834E+01 3,-1 156 3 +1 1.975792 -1.867070 -1.796965 Rho 0.1348352E-01 |GRAD(Rho)| 0.2533415E-16 GRAD(Rho)x -0.1616199E-16 GRAD(Rho)y 0.4715340E-17 GRAD(Rho)z -0.1893079E-16 Laplacian 0.5639967E-01 (-1/4)Del**2(Rho)) -0.1409992E-01 Diamond 0.2450776E-02 Metallicity 0.9332725E+00 Ellipticity -0.1407063E+01 Gb(Abramov) 0.1159312E-01 Vb(Abramov) -0.9086328E-02 Hb(Abramov) 0.2506795E-02 Ex_ueg -0.2370223E-02 Ec_ueg -0.5284792E-03 Delta_ex -0.2809458E-02 Delta_ec 0.6431667E-03 Delta_et -0.5025104E-02 Pxc 0.4484989E+01 Qxc -0.4368164E+01 3,+1 157 3 +1 2.019885 -2.016124 2.026636 Rho 0.1162255E-01 |GRAD(Rho)| 0.2892485E-12 GRAD(Rho)x 0.8653305E-13 GRAD(Rho)y 0.2648854E-12 GRAD(Rho)z 0.7753988E-13 Laplacian 0.5266455E-01 (-1/4)Del**2(Rho)) -0.1316614E-01 Diamond 0.1606259E-02 Metallicity 0.7803042E+00 Ellipticity -0.1116410E+01 Gb(Abramov) 0.1048969E-01 Vb(Abramov) -0.7813244E-02 Hb(Abramov) 0.2676447E-02 Ex_ueg -0.1944407E-02 Ec_ueg -0.4421729E-03 Delta_ex -0.2442283E-02 Delta_ec 0.4609307E-03 Delta_et -0.3603223E-02 Pxc 0.4397390E+01 Qxc -0.5298590E+01 3,+1 158 3 +3 1.981176 1.914265 -1.981551 Rho 0.1167744E-01 |GRAD(Rho)| 0.2217528E-16 GRAD(Rho)x -0.1664272E-16 GRAD(Rho)y 0.7632332E-17 GRAD(Rho)z -0.1251041E-16 Laplacian 0.5270574E-01 (-1/4)Del**2(Rho)) -0.1317644E-01 Diamond 0.1387190E-02 Metallicity 0.7858412E+00 Ellipticity -0.9707017E+00 Gb(Abramov) 0.1051005E-01 Vb(Abramov) -0.7843673E-02 Hb(Abramov) 0.2666381E-02 Ex_ueg -0.1956660E-02 Ec_ueg -0.4446991E-03 Delta_ex -0.2378212E-02 Delta_ec 0.3377979E-03 Delta_et -0.2786016E-02 Pxc 0.4399963E+01 Qxc -0.7040340E+01 3,+3 159 3 -1 1.769556 2.772474 0.545758 Rho 0.1420013E+00 |GRAD(Rho)| 0.4553218E-14 GRAD(Rho)x 0.3365336E-14 GRAD(Rho)y -0.5086060E-15 GRAD(Rho)z -0.3024504E-14 Laplacian 0.6001254E+00 (-1/4)Del**2(Rho)) -0.1500314E+00 Diamond 0.1131874E+01 Metallicity 0.4438047E+01 Ellipticity 0.1246217E-01 Gb(Abramov) 0.2109953E+00 Vb(Abramov) -0.2719592E+00 Hb(Abramov) -0.6096390E-01 Ex_ueg -0.5471524E-01 Ec_ueg -0.7933467E-02 Delta_ex -0.6351566E-01 Delta_ec 0.1530335E-01 Delta_et -0.2018420E+00 Pxc 0.6896763E+01 Qxc -0.4150442E+01 3,-1 160 3 -1 1.961878 2.983048 -0.867289 Rho 0.1382048E+00 |GRAD(Rho)| 0.1933770E-15 GRAD(Rho)x -0.1274751E-15 GRAD(Rho)y -0.9384447E-16 GRAD(Rho)z -0.1110765E-15 Laplacian 0.5389140E+00 (-1/4)Del**2(Rho)) -0.1347285E+00 Diamond 0.9906977E+00 Metallicity 0.4723883E+01 Ellipticity 0.4289546E-01 Gb(Abramov) 0.1958926E+00 Vb(Abramov) -0.2570567E+00 Hb(Abramov) -0.6116412E-01 Ex_ueg -0.5277352E-01 Ec_ueg -0.7692784E-02 Delta_ex -0.5673717E-01 Delta_ec 0.1396928E-01 Delta_et -0.1837853E+00 Pxc 0.6860133E+01 Qxc -0.4061566E+01 3,-1 161 3 +3 2.338515 -0.057096 0.006431 Rho 0.4008333E-02 |GRAD(Rho)| 0.5321386E-17 GRAD(Rho)x 0.9591133E-18 GRAD(Rho)y 0.4167115E-17 GRAD(Rho)z 0.3167396E-17 Laplacian 0.1598741E-01 (-1/4)Del**2(Rho)) -0.3996852E-02 Diamond 0.1101950E-03 Metallicity 0.4359548E+00 Ellipticity -0.2595273E+00 Gb(Abramov) 0.2954976E-02 Vb(Abramov) -0.1913100E-02 Hb(Abramov) 0.1041876E-02 Ex_ueg -0.4702587E-03 Ec_ueg -0.1044902E-03 Delta_ex -0.5542088E-03 Delta_ec 0.1320130E-03 Delta_et -0.8237273E-03 Pxc 0.4500506E+01 Qxc -0.4198138E+01 3,+3 162 3 +1 2.174019 -1.517293 0.967150 Rho 0.2222183E-01 |GRAD(Rho)| 0.7210307E-14 GRAD(Rho)x 0.7237122E-15 GRAD(Rho)y -0.5293501E-14 GRAD(Rho)z -0.4841861E-14 Laplacian 0.8221077E-01 (-1/4)Del**2(Rho)) -0.2055269E-01 Diamond 0.7134433E-02 Metallicity 0.1472258E+01 Ellipticity -0.1904287E+01 Gb(Abramov) 0.1874494E-01 Vb(Abramov) -0.1693719E-01 Hb(Abramov) 0.1807753E-02 Ex_ueg -0.4614146E-02 Ec_ueg -0.9498810E-03 Delta_ex -0.4700012E-02 Delta_ec 0.9392560E-03 Delta_et -0.8194698E-02 Pxc 0.4857604E+01 Qxc -0.5003973E+01 3,+1 163 3 -1 1.987849 -0.850991 3.022930 Rho 0.1528863E+00 |GRAD(Rho)| 0.7572011E-16 GRAD(Rho)x 0.3488420E-16 GRAD(Rho)y -0.3680866E-16 GRAD(Rho)z -0.5622944E-16 Laplacian 0.5944353E+00 (-1/4)Del**2(Rho)) -0.1486088E+00 Diamond 0.1234213E+01 Metallicity 0.5067449E+01 Ellipticity 0.4846622E-01 Gb(Abramov) 0.2245838E+00 Vb(Abramov) -0.3005588E+00 Hb(Abramov) -0.7597499E-01 Ex_ueg -0.6037767E-01 Ec_ueg -0.8628532E-02 Delta_ex -0.6415339E-01 Delta_ec 0.1504019E-01 Delta_et -0.2008096E+00 Pxc 0.6997444E+01 Qxc -0.4265465E+01 3,-1 164 3 -1 2.027963 -0.708406 -2.910339 Rho 0.1355654E+00 |GRAD(Rho)| 0.1398092E-11 GRAD(Rho)x 0.8859514E-12 GRAD(Rho)y 0.9930999E-12 GRAD(Rho)z 0.4283725E-12 Laplacian 0.5278988E+00 (-1/4)Del**2(Rho)) -0.1319747E+00 Diamond 0.9850881E+00 Metallicity 0.4669930E+01 Ellipticity 0.1108279E+00 Gb(Abramov) 0.1907019E+00 Vb(Abramov) -0.2494291E+00 Hb(Abramov) -0.5872721E-01 Ex_ueg -0.5143397E-01 Ec_ueg -0.7525995E-02 Delta_ex -0.5573819E-01 Delta_ec 0.1449806E-01 Delta_et -0.1916625E+00 Pxc 0.6834176E+01 Qxc -0.3844529E+01 3,-1 165 3 -1 1.710954 -0.571896 1.719945 Rho 0.4255503E-01 |GRAD(Rho)| 0.9105091E-16 GRAD(Rho)x 0.6496637E-16 GRAD(Rho)y 0.2586447E-16 GRAD(Rho)z 0.5831525E-16 Laplacian 0.1679860E+00 (-1/4)Del**2(Rho)) -0.4199650E-01 Diamond 0.6736795E-01 Metallicity 0.2127771E+01 Ellipticity 0.2436069E-01 Gb(Abramov) 0.4289082E-01 Vb(Abramov) -0.4378515E-01 Hb(Abramov) -0.8943253E-03 Ex_ueg -0.1097285E-01 Ec_ueg -0.2007677E-02 Delta_ex -0.1322553E-01 Delta_ec 0.4913101E-02 Delta_et -0.4963084E-01 Pxc 0.5465448E+01 Qxc -0.2691890E+01 3,-1 166 3 -1 2.778652 0.557732 1.814673 Rho 0.1289468E+00 |GRAD(Rho)| 0.7999923E-16 GRAD(Rho)x -0.3320369E-18 GRAD(Rho)y -0.4264980E-16 GRAD(Rho)z 0.6768132E-16 Laplacian 0.5371219E+00 (-1/4)Del**2(Rho)) -0.1342805E+00 Diamond 0.9082037E+00 Metallicity 0.4222384E+01 Ellipticity 0.1165374E-01 Gb(Abramov) 0.1840176E+00 Vb(Abramov) -0.2337547E+00 Hb(Abramov) -0.4973713E-01 Ex_ueg -0.4811336E-01 Ec_ueg -0.7109757E-02 Delta_ex -0.5560457E-01 Delta_ec 0.1415085E-01 Delta_et -0.1841285E+00 Pxc 0.6767230E+01 Qxc -0.3929416E+01 3,-1 167 3 -1 3.192411 -3.343936 -0.089778 Rho 0.2004811E+00 |GRAD(Rho)| 0.1397763E-14 GRAD(Rho)x -0.1043545E-14 GRAD(Rho)y 0.9211924E-15 GRAD(Rho)z 0.1271227E-15 Laplacian 0.7533101E+00 (-1/4)Del**2(Rho)) -0.1883275E+00 Diamond 0.2154349E+01 Metallicity 0.6281956E+01 Ellipticity 0.8201217E-02 Gb(Abramov) 0.3227292E+00 Vb(Abramov) -0.4571310E+00 Hb(Abramov) -0.1344017E+00 Ex_ueg -0.8665950E-01 Ec_ueg -0.1175021E-01 Delta_ex -0.8693753E-01 Delta_ec 0.1761991E-01 Delta_et -0.2419410E+00 Pxc 0.7375142E+01 Qxc -0.4934052E+01 3,-1 168 3 -1 2.857244 -1.885250 -0.621096 Rho 0.1218664E+00 |GRAD(Rho)| 0.1895234E-15 GRAD(Rho)x 0.9859464E-16 GRAD(Rho)y -0.1618578E-15 GRAD(Rho)z 0.5014435E-18 Laplacian 0.5129870E+00 (-1/4)Del**2(Rho)) -0.1282467E+00 Diamond 0.8328212E+00 Metallicity 0.4023895E+01 Ellipticity 0.1968692E-01 Gb(Abramov) 0.1715064E+00 Vb(Abramov) -0.2147660E+00 Hb(Abramov) -0.4325965E-01 Ex_ueg -0.4462349E-01 Ec_ueg -0.6667711E-02 Delta_ex -0.5268523E-01 Delta_ec 0.1422094E-01 Delta_et -0.1841769E+00 Pxc 0.6692475E+01 Qxc -0.3704764E+01 3,-1 169 3 -1 3.009843 2.028766 -0.832007 Rho 0.1636124E+00 |GRAD(Rho)| 0.5361802E-15 GRAD(Rho)x -0.3054469E-15 GRAD(Rho)y -0.4168757E-16 GRAD(Rho)z 0.4386953E-15 Laplacian 0.6438553E+00 (-1/4)Del**2(Rho)) -0.1609638E+00 Diamond 0.1440958E+01 Metallicity 0.5238238E+01 Ellipticity 0.3602950E-01 Gb(Abramov) 0.2478370E+00 Vb(Abramov) -0.3347103E+00 Hb(Abramov) -0.8687321E-01 Ex_ueg -0.6609065E-01 Ec_ueg -0.9320524E-02 Delta_ex -0.7058027E-01 Delta_ec 0.1586736E-01 Delta_et -0.2133499E+00 Pxc 0.7090873E+01 Qxc -0.4448142E+01 3,-1 170 3 -1 2.763119 1.819567 0.570470 Rho 0.1437413E+00 |GRAD(Rho)| 0.6174303E-14 GRAD(Rho)x 0.1449883E-14 GRAD(Rho)y 0.5023610E-14 GRAD(Rho)z -0.3283777E-14 Laplacian 0.5973392E+00 (-1/4)Del**2(Rho)) -0.1493348E+00 Diamond 0.1147363E+01 Metallicity 0.4550177E+01 Ellipticity 0.1398415E-01 Gb(Abramov) 0.2128065E+00 Vb(Abramov) -0.2762782E+00 Hb(Abramov) -0.6347170E-01 Ex_ueg -0.5561099E-01 Ec_ueg -0.8044081E-02 Delta_ex -0.6345309E-01 Delta_ec 0.1526468E-01 Delta_et -0.2018590E+00 Pxc 0.6913281E+01 Qxc -0.4156856E+01 3,-1 171 3 -1 3.150071 3.235295 0.080156 Rho 0.2327291E+00 |GRAD(Rho)| 0.1219220E-14 GRAD(Rho)x -0.7238134E-15 GRAD(Rho)y -0.9638557E-15 GRAD(Rho)z -0.1832302E-15 Laplacian 0.8545068E+00 (-1/4)Del**2(Rho)) -0.2136267E+00 Diamond 0.2912604E+01 Metallicity 0.7100935E+01 Ellipticity 0.4815061E-02 Gb(Abramov) 0.3952427E+00 Vb(Abramov) -0.5768587E+00 Hb(Abramov) -0.1816160E+00 Ex_ueg -0.1057270E+00 Ec_ueg -0.1393795E-01 Delta_ex -0.1024187E+00 Delta_ec 0.1905146E-01 Delta_et -0.2635992E+00 Pxc 0.7585553E+01 Qxc -0.5375896E+01 3,-1 172 3 -1 3.401655 -0.027511 -3.238247 Rho 0.2072706E+00 |GRAD(Rho)| 0.3249514E-15 GRAD(Rho)x -0.3069376E-15 GRAD(Rho)y 0.1795710E-16 GRAD(Rho)z 0.1051676E-15 Laplacian 0.7712658E+00 (-1/4)Del**2(Rho)) -0.1928165E+00 Diamond 0.2294024E+01 Metallicity 0.6485923E+01 Ellipticity 0.4196182E-02 Gb(Abramov) 0.3369764E+00 Vb(Abramov) -0.4811364E+00 Hb(Abramov) -0.1441600E+00 Ex_ueg -0.9059451E-01 Ec_ueg -0.1220604E-01 Delta_ex -0.8976024E-01 Delta_ec 0.1785456E-01 Delta_et -0.2457163E+00 Pxc 0.7422107E+01 Qxc -0.5027299E+01 3,-1 173 3 -1 -3.302713 -3.240203 0.046825 Rho 0.2081241E+00 |GRAD(Rho)| 0.2395673E-14 GRAD(Rho)x -0.1610474E-14 GRAD(Rho)y 0.1773429E-14 GRAD(Rho)z 0.2390666E-16 Laplacian 0.7916272E+00 (-1/4)Del**2(Rho)) -0.1979068E+00 Diamond 0.2356266E+01 Metallicity 0.6362528E+01 Ellipticity 0.4027312E-02 Gb(Abramov) 0.3418025E+00 Vb(Abramov) -0.4856981E+00 Hb(Abramov) -0.1438957E+00 Ex_ueg -0.9109227E-01 Ec_ueg -0.1226352E-01 Delta_ex -0.9216285E-01 Delta_ec 0.1819030E-01 Delta_et -0.2499916E+00 Pxc 0.7427905E+01 Qxc -0.5066594E+01 3,-1 174 3 -1 -3.111764 -1.990472 -0.855009 Rho 0.1112369E+00 |GRAD(Rho)| 0.1776928E-12 GRAD(Rho)x 0.7025047E-13 GRAD(Rho)y -0.9726480E-13 GRAD(Rho)z 0.1310693E-12 Laplacian 0.4561680E+00 (-1/4)Del**2(Rho)) -0.1140420E+00 Diamond 0.6675072E+00 Metallicity 0.3886600E+01 Ellipticity 0.2431023E-01 Gb(Abramov) 0.1499006E+00 Vb(Abramov) -0.1857592E+00 Hb(Abramov) -0.3585861E-01 Ex_ueg -0.3951090E-01 Ec_ueg -0.6010632E-02 Delta_ex -0.4591239E-01 Delta_ec 0.1301540E-01 Delta_et -0.1658816E+00 Pxc 0.6573502E+01 Qxc -0.3527542E+01 3,-1 175 3 -1 -2.883855 -1.843154 0.626724 Rho 0.1272865E+00 |GRAD(Rho)| 0.6649166E-13 GRAD(Rho)x 0.1217485E-13 GRAD(Rho)y -0.4727078E-13 GRAD(Rho)z -0.4514851E-13 Laplacian 0.5412590E+00 (-1/4)Del**2(Rho)) -0.1353148E+00 Diamond 0.9223591E+00 Metallicity 0.4100581E+01 Ellipticity 0.1284326E-01 Gb(Abramov) 0.1826880E+00 Vb(Abramov) -0.2300613E+00 Hb(Abramov) -0.4737328E-01 Ex_ueg -0.4728917E-01 Ec_ueg -0.7005801E-02 Delta_ex -0.5612258E-01 Delta_ec 0.1477543E-01 Delta_et -0.1926956E+00 Pxc 0.6750002E+01 Qxc -0.3798372E+01 3,-1 176 3 -1 -1.823852 -0.560289 2.839753 Rho 0.1138603E+00 |GRAD(Rho)| 0.1804327E-15 GRAD(Rho)x 0.1247781E-15 GRAD(Rho)y -0.1294402E-15 GRAD(Rho)z 0.1521949E-16 Laplacian 0.4902918E+00 (-1/4)Del**2(Rho)) -0.1225729E+00 Diamond 0.7369317E+00 Metallicity 0.3759349E+01 Ellipticity 0.1843061E-01 Gb(Abramov) 0.1585144E+00 Vb(Abramov) -0.1944558E+00 Hb(Abramov) -0.3594143E-01 Ex_ueg -0.4075820E-01 Ec_ueg -0.6172053E-02 Delta_ex -0.4960334E-01 Delta_ec 0.1389232E-01 Delta_et -0.1778148E+00 Pxc 0.6603670E+01 Qxc -0.3570558E+01 3,-1 177 3 -1 -0.740597 -3.382285 -1.392192 Rho 0.3055038E+00 |GRAD(Rho)| 0.5982641E-15 GRAD(Rho)x -0.2555795E-15 GRAD(Rho)y 0.1975292E-15 GRAD(Rho)z 0.5035685E-15 Laplacian -0.1513611E+01 (-1/4)Del**2(Rho)) 0.3784028E+00 Diamond 0.5055670E+01 Metallicity -0.6308992E+01 Ellipticity 0.9683910E-03 Gb(Abramov) 0.1456215E+00 Vb(Abramov) -0.6696457E+00 Hb(Abramov) -0.5240242E+00 Ex_ueg -0.1519640E+00 Ec_ueg -0.1908485E-01 Delta_ex 0.1478043E+00 Delta_ec 0.5317554E-01 Delta_et -0.1237120E+01 Pxc 0.7962544E+01 Qxc 0.2779554E+01 3,-1 178 3 -1 -0.079410 -3.199804 3.269001 Rho 0.2304887E+00 |GRAD(Rho)| 0.3876744E-13 GRAD(Rho)x 0.6135636E-14 GRAD(Rho)y 0.2542633E-13 GRAD(Rho)z -0.2861416E-13 Laplacian 0.8486912E+00 (-1/4)Del**2(Rho)) -0.2121728E+00 Diamond 0.2857108E+01 Metallicity 0.7035249E+01 Ellipticity 0.4882068E-02 Gb(Abramov) 0.3902299E+00 Vb(Abramov) -0.5682871E+00 Hb(Abramov) -0.1780571E+00 Ex_ueg -0.1043721E+00 Ec_ueg -0.1378410E-01 Delta_ex -0.1014537E+00 Delta_ec 0.1895322E-01 Delta_et -0.2620370E+00 Pxc 0.7571921E+01 Qxc -0.5352848E+01 3,-1 179 3 -1 2.945234 -0.626841 -1.827659 Rho 0.1391038E+00 |GRAD(Rho)| 0.9645026E-12 GRAD(Rho)x 0.2392321E-12 GRAD(Rho)y -0.6098714E-12 GRAD(Rho)z 0.7078772E-12 Laplacian 0.5790519E+00 (-1/4)Del**2(Rho)) -0.1447630E+00 Diamond 0.1095233E+01 Metallicity 0.4444203E+01 Ellipticity 0.2387210E-01 Gb(Abramov) 0.2037347E+00 Vb(Abramov) -0.2627063E+00 Hb(Abramov) -0.5897168E-01 Ex_ueg -0.5323170E-01 Ec_ueg -0.7749690E-02 Delta_ex -0.6130612E-01 Delta_ec 0.1542713E-01 Delta_et -0.2040753E+00 Pxc 0.6868880E+01 Qxc -0.3973916E+01 3,-1 180 3 -1 2.050966 0.792807 -3.022413 Rho 0.1036297E+00 |GRAD(Rho)| 0.3030621E-15 GRAD(Rho)x 0.1776669E-15 GRAD(Rho)y -0.1992493E-15 GRAD(Rho)z 0.1434603E-15 Laplacian 0.4270947E+00 (-1/4)Del**2(Rho)) -0.1067737E+00 Diamond 0.5737209E+00 Metallicity 0.3688892E+01 Ellipticity 0.8814030E-02 Gb(Abramov) 0.1368286E+00 Vb(Abramov) -0.1668834E+00 Hb(Abramov) -0.3005487E-01 Ex_ueg -0.3594987E-01 Ec_ueg -0.5545446E-02 Delta_ex -0.4228243E-01 Delta_ec 0.1237472E-01 Delta_et -0.1555245E+00 Pxc 0.6482774E+01 Qxc -0.3416838E+01 3,-1 181 3 -1 3.083048 0.854584 -1.984885 Rho 0.9956996E-01 |GRAD(Rho)| 0.8767191E-10 GRAD(Rho)x 0.3139153E-10 GRAD(Rho)y 0.6616872E-10 GRAD(Rho)z 0.4819372E-10 Laplacian 0.4195843E+00 (-1/4)Del**2(Rho)) -0.1048961E+00 Diamond 0.5380196E+00 Metallicity 0.3512970E+01 Ellipticity 0.4297312E-02 Gb(Abramov) 0.1313469E+00 Vb(Abramov) -0.1577976E+00 Hb(Abramov) -0.2645077E-01 Ex_ueg -0.3408444E-01 Ec_ueg -0.5299009E-02 Delta_ex -0.4117339E-01 Delta_ec 0.1229106E-01 Delta_et -0.1532526E+00 Pxc 0.6432229E+01 Qxc -0.3349865E+01 3,-1 182 3 -1 3.022900 -0.856491 2.024752 Rho 0.1846274E+00 |GRAD(Rho)| 0.5824938E-13 GRAD(Rho)x 0.4007976E-13 GRAD(Rho)y 0.1446239E-13 GRAD(Rho)z -0.3971704E-13 Laplacian 0.7186645E+00 (-1/4)Del**2(Rho)) -0.1796661E+00 Diamond 0.1852853E+01 Metallicity 0.5740025E+01 Ellipticity 0.4889462E-01 Gb(Abramov) 0.2916588E+00 Vb(Abramov) -0.4036514E+00 Hb(Abramov) -0.1119926E+00 Ex_ueg -0.7764495E-01 Ec_ueg -0.1069592E-01 Delta_ex -0.8115526E-01 Delta_ec 0.1707001E-01 Delta_et -0.2323041E+00 Pxc 0.7259307E+01 Qxc -0.4754259E+01 3,-1 183 3 -1 3.197862 0.062540 3.219037 Rho 0.2318346E+00 |GRAD(Rho)| 0.3800271E-15 GRAD(Rho)x -0.3125755E-15 GRAD(Rho)y -0.1093689E-15 GRAD(Rho)z -0.1864286E-15 Laplacian 0.8507930E+00 (-1/4)Del**2(Rho)) -0.2126982E+00 Diamond 0.2888138E+01 Metallicity 0.7086301E+01 Ellipticity 0.5672802E-02 Gb(Abramov) 0.3930061E+00 Vb(Abramov) -0.5733140E+00 Hb(Abramov) -0.1803079E+00 Ex_ueg -0.1051855E+00 Ec_ueg -0.1387649E-01 Delta_ex -0.1018803E+00 Delta_ec 0.1900594E-01 Delta_et -0.2629933E+00 Pxc 0.7580126E+01 Qxc -0.5360449E+01 3,-1 184 3 -1 -3.070138 2.050715 0.926688 Rho 0.1318908E+00 |GRAD(Rho)| 0.8821984E-14 GRAD(Rho)x -0.6269440E-14 GRAD(Rho)y -0.5818181E-14 GRAD(Rho)z -0.2161086E-14 Laplacian 0.5315130E+00 (-1/4)Del**2(Rho)) -0.1328783E+00 Diamond 0.9411737E+00 Metallicity 0.4430542E+01 Ellipticity 0.1423164E-01 Gb(Abramov) 0.1867060E+00 Vb(Abramov) -0.2405337E+00 Hb(Abramov) -0.5382771E-01 Ex_ueg -0.4958358E-01 Ec_ueg -0.7294551E-02 Delta_ex -0.5553409E-01 Delta_ec 0.1430234E-01 Delta_et -0.1874946E+00 Pxc 0.6797344E+01 Qxc -0.3882867E+01 3,-1 185 3 -1 -1.607706 -2.101697 -3.058436 Rho 0.3195017E+00 |GRAD(Rho)| 0.6941071E-15 GRAD(Rho)x -0.5568183E-17 GRAD(Rho)y -0.5029716E-15 GRAD(Rho)z 0.4783026E-15 Laplacian -0.1600944E+01 (-1/4)Del**2(Rho)) 0.4002359E+00 Diamond 0.5575783E+01 Metallicity -0.6427257E+01 Ellipticity 0.2642494E-02 Gb(Abramov) 0.1619125E+00 Vb(Abramov) -0.7240610E+00 Hb(Abramov) -0.5621485E+00 Ex_ueg -0.1613179E+00 Ec_ueg -0.2010836E-01 Delta_ex 0.1593610E+00 Delta_ec 0.5579840E-01 Delta_et -0.1323894E+01 Pxc 0.8022430E+01 Qxc 0.2856014E+01 3,-1 186 3 -1 -0.087876 3.113193 -3.226528 Rho 0.2315065E+00 |GRAD(Rho)| 0.1592114E-15 GRAD(Rho)x 0.4559070E-16 GRAD(Rho)y -0.7990570E-16 GRAD(Rho)z -0.1299416E-15 Laplacian 0.8581897E+00 (-1/4)Del**2(Rho)) -0.2145474E+00 Diamond 0.2899879E+01 Metallicity 0.7008664E+01 Ellipticity 0.6653996E-02 Gb(Abramov) 0.3936467E+00 Vb(Abramov) -0.5727461E+00 Hb(Abramov) -0.1790993E+00 Ex_ueg -0.1049871E+00 Ec_ueg -0.1385396E-01 Delta_ex -0.1026813E+00 Delta_ec 0.1909523E-01 Delta_et -0.2638592E+00 Pxc 0.7578131E+01 Qxc -0.5377325E+01 3,-1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 131 122 117 151 138 178 134 136 135 112 127 76 120 143 146 186 116 142 132 119 121 133 150 168 154 140 155 167 144 170 159 169 160 171 62 69 93 184 94 67 77 175 86 174 79 173 57 70 96 74 75 65 97 73 176 71 99 64 165 166 153 182 163 183 128 179 164 181 180 172 125 102 149 113 85 137 139 185 87 177 1 1 1 1 1 1 2 2 2 2 3 3 3 3 3 3 4 4 4 4 4 4 5 5 5 5 5 5 6 6 6 6 6 6 7 7 7 7 7 7 8 8 8 8 8 8 9 9 9 9 9 9 10 10 10 10 10 10 11 11 11 11 11 11 12 12 12 12 12 12 14 21 21 22 25 28 28 36 37 37 13 24 26 33 39 41 13 14 15 16 15 23 25 34 40 43 16 22 27 35 38 44 13 18 28 29 39 45 15 20 27 31 40 46 16 19 25 32 38 47 14 17 26 30 37 48 14 19 23 30 36 49 16 17 24 32 35 50 13 20 22 29 33 51 15 18 21 31 34 42 21 36 54 24 27 53 54 52 52 53 2.402219 1.913699 1.890546 2.023555 1.909691 1.758681 1.714605 1.688678 1.715144 1.719940 2.367204 1.939383 1.908930 1.914948 1.976557 1.756919 2.374386 1.917263 1.969404 1.895263 1.934953 1.758253 2.475630 1.993483 1.858073 2.214283 2.067887 1.812610 2.420640 1.930588 1.935455 1.891030 1.957380 1.755006 2.407448 2.028117 2.026614 1.972359 2.016161 1.798003 2.367854 1.976831 2.039566 2.036042 2.033817 1.797871 2.351648 1.894663 1.965396 1.917328 1.977275 1.755531 2.429329 1.957463 2.017418 1.997696 2.079594 1.799940 2.436233 1.972820 1.993810 1.844161 1.917155 1.756447 2.517437 1.943676 1.968158 2.078630 2.065465 1.800007 3.470234 3.296294 1.011015 3.246701 3.220288 1.735944 1.707694 0.996384 1.911044 1.010695 2.404022 1.914046 1.890850 2.024047 1.910222 1.758689 1.714621 1.688730 1.715165 1.719954 2.368870 1.939805 1.909271 1.915461 1.977076 1.756928 2.376098 1.917710 1.969777 1.895682 1.935462 1.758264 2.477699 1.993644 1.858122 2.214618 2.068152 1.812639 2.422324 1.931037 1.935940 1.891465 1.957955 1.755016 2.409511 2.028299 2.026827 1.972659 2.016518 1.798011 2.370426 1.977020 2.039772 2.036330 2.034500 1.797883 2.353672 1.894967 1.965792 1.917807 1.978219 1.755544 2.431183 1.957658 2.017699 1.998005 2.079879 1.799947 2.438033 1.973263 1.994240 1.844475 1.917686 1.756464 2.519507 1.943935 1.968831 2.078901 2.065740 1.800016 3.541306 3.297831 1.011076 3.250067 3.224388 1.736815 1.710496 0.996451 1.916876 1.010790 28 27 27 25 25 21 23 24 23 22 28 28 27 27 26 22 32 25 27 27 28 22 29 25 24 27 25 23 28 25 26 26 26 22 30 27 29 24 29 24 30 25 27 24 28 23 30 27 27 28 28 23 30 26 25 26 29 25 28 26 27 23 25 24 29 25 25 25 25 23 39 37 20 38 35 24 23 17 27 17 1 2 3 4 5 6 7 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1.9391 1.9557 1.9387 1.9554 0.5771 0.5220 0.5468 6.1028 1.1396 6.0987 6.0904 6.0998 6.0957 6.0776 6.0928 6.0958 6.0823 6.0963 6.0895 5.1324 5.0591 5.1382 5.1522 5.0695 5.0844 5.0196 5.0178 4.9731 5.0151 5.0177 5.0330 5.0258 5.0316 5.0138 5.0471 4.9888 5.0516 5.0316 5.0874 5.0273 5.0472 5.0347 4.9369 5.0217 5.0493 5.0519 5.0259 4.8757 4.9987 4.8649 4.8728 5.0264 4.8605 4.9871 4.9867 4.8608 4.9956 4.8653 0.1404 0.1518 0.1621 3.3362 10.5456 3.3301 3.3355 2.6310 3.3378 2.5720 2.5575 3.3054 2.5737 3.3469 2.5754 0.0362 0.0365 0.0365 0.0358 0.0244 0.0251 0.0273 0.0287 0.0277 0.0283 0.0284 0.0266 0.0266 0.0277 0.0286 0.0265 0.0290 0.0288 0.0284 0.0254 0.0301 0.0266 0.0284 0.0293 0.0266 0.0281 0.0275 0.0301 0.0320 0.0255 0.0323 0.0320 0.0243 0.0326 0.0259 0.0257 0.0323 0.0256 0.0325 0.0000 0.0000 0.0000 14.0297 0.0000 14.0297 14.0299 14.0330 14.0297 14.0345 14.0342 14.0297 14.0344 14.0295 14.0338 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 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-0.970731 -0.789695 0.429735 0.288607 0.316936 2.35171268 4.33879071 -2.54044739 5.55063333 -39.68540286 22.38063861 36.85003498 12.58772274 15.41826380 27.09768011 -368.2404 421.6015 -1.5707 -431.3731 -95.8552 -475.4380 Jun20-2024 06:34:27 Nodes: 1 Procs: 1 Jun20-2024 06:34:29 Nodes: 1 Procs: 1 0 Jun20-2024 06:34:32 Nodes: 1 Procs: 1 Jun20-2024 06:34:35 Nodes: 1 Procs: 1 Arsenic (TZP, 3p frozen) 0 Jun20-2024 06:34:38 Nodes: 1 Procs: 1 Jun20-2024 06:34:41 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Jun20-2024 06:34:46 Nodes: 1 Procs: 1 Jun20-2024 06:34:48 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Jun20-2024 06:34:50 Nodes: 1 Procs: 1 Jun20-2024 06:34:53 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Jun20-2024 06:34:58 Nodes: 1 Procs: 5 *** (NO TITLE) *** -9 -17.00916544 -17.29976475 -17.33293700 -17.36127690 -17.41717679 -17.43727302 -17.44507594 -17.45185626 -17.45772747 -17.46247711 -17.46625831 -17.46708651 -17.46988389 -17.47084203 -17.47123942 -17.47163253 -17.47175152 -17.47189654 -17.47195081 -17.47199794 -17.47201459 -17.47202543 GEOMETRY CONVERGED