ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Mar16-2024 15:12:04 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.35 0.02 0.41 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 Mar16-2024 15:12:04 Nodes: 1 Procs: 1 Mar16-2024 15:12:04 Nodes: 1 Procs: 1 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Mar16-2024 15:12:05 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.60 0.02 0.66 1 2 3 4 5 1 2 3 4 5 1 2.000 2.000 0.000 0.000 0.000 6.000 3.000 0.000 0.000 0.000 0.000 -173.942 -13.975 3.091 35.970 283.822 -124.292 -5.506 2.188 19.487 259.576 10.422 S S S S S P P P P P D S P S P P S D P S P S 1 1 2 2 3 3 1 4 4 5 5 2.00 6.00 2.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -173.9416 -124.2916 -13.9750 -5.5063 2.1878 3.0913 10.4217 19.4867 35.9696 259.5761 283.8222 1 P -0.0000 4.0000 9.0000 0.0000 0.0000 Mar16-2024 15:12:04 Nodes: 1 Procs: 1 Mar16-2024 15:12:04 Nodes: 1 Procs: 1 0 Mar16-2024 15:12:05 Nodes: 1 Procs: 1 Mar16-2024 15:12:05 Nodes: 1 Procs: 1 Phosphorus (TZP, 1s frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Mar16-2024 15:12:06 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.46 0.02 0.50 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 Mar16-2024 15:12:04 Nodes: 1 Procs: 1 Mar16-2024 15:12:04 Nodes: 1 Procs: 1 0 Mar16-2024 15:12:05 Nodes: 1 Procs: 1 Mar16-2024 15:12:05 Nodes: 1 Procs: 1 Phosphorus (TZP, 1s frozen) 0 Mar16-2024 15:12:06 Nodes: 1 Procs: 1 Mar16-2024 15:12:06 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Mar16-2024 15:12:07 Hydrogen (TZP) kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 kimik2198 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.32 0.04 1.41 1 2 3 4 5 6 1 2 3 4 1 2 3 1 2 3 2.000 2.000 0.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 4.000 0.000 0.000 14.000 0.000 0.000 -78.652 -5.688 1.231 15.256 90.545 82874.614 -43.195 -0.500 20.662 126.921 -4.498 4.055 33.318 -33.668 62.370 473.510 S S S S S S P P P P D D D F F F S P F S D P S D S P D F S P F S 1 1 1 2 1 2 3 2 4 3 3 2 5 4 3 6 2.00 6.00 14.00 2.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -78.6522 -43.1946 -33.6680 -5.6882 -4.4976 -0.5002 1.2309 4.0549 15.2562 20.6620 33.3183 62.3697 90.5446 126.9207 473.5096 82874.6143 1 W -0.0000 4.0000 6.0000 4.0000 14.0000 Mar16-2024 15:12:04 Nodes: 1 Procs: 1 Mar16-2024 15:12:04 Nodes: 1 Procs: 1 0 Mar16-2024 15:12:05 Nodes: 1 Procs: 1 Mar16-2024 15:12:05 Nodes: 1 Procs: 1 Phosphorus (TZP, 1s frozen) 0 Mar16-2024 15:12:06 Nodes: 1 Procs: 1 Mar16-2024 15:12:06 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Mar16-2024 15:12:07 Nodes: 1 Procs: 1 Mar16-2024 15:12:08 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Mar16-2024 15:12:10 Hydrogen (TZP) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP 2877.0297610000057 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0.3187858E+03 3,-3 14 3 -3 -0.898912 -0.898193 -0.913114 Rho 0.3187797E+03 3,-3 15 3 -3 0.897055 0.899799 -0.912185 Rho 0.3187795E+03 3,-3 16 3 -3 -0.921231 0.919163 0.859208 Rho 0.3187776E+03 3,-3 17 3 -3 -3.019698 -1.166127 1.171035 Rho 0.3188764E+03 3,-3 18 3 -3 3.020366 -1.175056 -1.171643 Rho 0.3188744E+03 3,-3 19 3 -3 -2.991015 1.169859 -1.140137 Rho 0.3189352E+03 3,-3 20 3 -3 3.011023 1.175993 1.173900 Rho 0.3188750E+03 3,-3 21 3 -3 1.169270 -1.171239 -3.020561 Rho 0.3188763E+03 3,-3 22 3 -3 1.174387 1.183252 3.034821 Rho 0.3188775E+03 3,-3 23 3 -3 -1.168426 1.165949 -3.006759 Rho 0.3188729E+03 3,-3 24 3 -3 -1.181454 -1.173734 3.031509 Rho 0.3188768E+03 3,-3 25 3 -3 -1.167911 2.992415 -1.144133 Rho 0.3189236E+03 3,-3 26 3 -3 -1.174031 -3.014408 1.172587 Rho 0.3188751E+03 3,-3 27 3 -3 1.158862 3.018068 1.168264 Rho 0.3188765E+03 3,-3 28 3 -3 1.175843 -3.024327 -1.171574 Rho 0.3188744E+03 3,-3 29 3 -3 3.377097 -1.490445 1.493435 Rho 0.3189745E+03 3,-3 30 3 -3 -3.378266 -1.483289 -1.495999 Rho 0.3189797E+03 3,-3 31 3 -3 3.372693 1.495037 -1.498420 Rho 0.3189766E+03 3,-3 32 3 -3 -3.360480 1.497446 1.472901 Rho 0.3190044E+03 3,-3 33 3 -3 1.486859 -1.485040 3.376451 Rho 0.3189756E+03 3,-3 34 3 -3 1.499772 1.493827 -3.399364 Rho 0.3189812E+03 3,-3 35 3 -3 -1.494877 1.493174 3.367319 Rho 0.3189727E+03 3,-3 36 3 -3 -1.494785 -1.504307 -3.402229 Rho 0.3189821E+03 3,-3 37 3 -3 -1.495106 -3.373549 -1.499884 Rho 0.3189764E+03 3,-3 38 3 -3 -1.506410 3.353609 1.468411 Rho 0.3190110E+03 3,-3 39 3 -3 1.492696 -3.374775 1.494048 Rho 0.3189749E+03 3,-3 40 3 -3 1.484699 3.379723 -1.498187 Rho 0.3189801E+03 3,-3 41 3 -3 -0.186542 -3.751691 3.746852 Rho 0.3194347E+03 3,-3 42 3 -3 0.206619 -3.763031 -3.740885 Rho 0.3194353E+03 3,-3 43 3 -3 -0.200430 3.742723 -3.746065 Rho 0.3194416E+03 3,-3 44 3 -3 0.179144 3.759862 3.744469 Rho 0.3194430E+03 3,-3 45 3 -3 3.752783 -3.750471 -0.182824 Rho 0.3194364E+03 3,-3 46 3 -3 3.739418 3.751168 0.188993 Rho 0.3194333E+03 3,-3 47 3 -3 -3.791728 3.799498 -0.197014 Rho 0.3186913E+03 3,-3 48 3 -3 -3.749929 -3.743407 0.187276 Rho 0.3194334E+03 3,-3 49 3 -3 -3.742178 0.196846 -3.745869 Rho 0.3194433E+03 3,-3 50 3 -3 -3.760375 -0.184481 3.747695 Rho 0.3194415E+03 3,-3 51 3 -3 3.754500 0.187210 3.745922 Rho 0.3194352E+03 3,-3 52 3 -3 3.759039 -0.203549 -3.741992 Rho 0.3194349E+03 3,-3 53 3 -3 -0.004867 0.004478 -0.019528 Rho 0.2439501E+04 3,-3 54 3 -3 -4.188429 3.993542 -1.074371 Rho 0.4413086E+00 3,-3 55 3 +1 -1.983035 -1.986881 -1.996606 Rho 0.1266121E-01 |GRAD(Rho)| 0.6708319E-14 GRAD(Rho)x 0.3063562E-14 GRAD(Rho)y -0.3266632E-14 GRAD(Rho)z 0.4994521E-14 Laplacian 0.5985287E-01 (-1/4)Del**2(Rho)) -0.1496322E-01 Diamond 0.2108556E-02 Metallicity 0.7918696E+00 Ellipticity -0.1151350E+01 Gb(Abramov) 0.1195030E-01 Vb(Abramov) -0.8937378E-02 Hb(Abramov) 0.3012920E-02 Ex_ueg -0.2179476E-02 Ec_ueg -0.4901783E-03 Delta_ex -0.2856815E-02 Delta_ec 0.5497400E-03 Delta_et -0.4345837E-02 Pxc 0.4446293E+01 Qxc -0.5196666E+01 3,+1 56 3 +1 -2.108464 -1.231043 -1.136466 Rho 0.2586427E-01 |GRAD(Rho)| 0.9688770E-14 GRAD(Rho)x 0.7346743E-14 GRAD(Rho)y 0.1608704E-15 GRAD(Rho)z 0.6314408E-14 Laplacian 0.1046178E+00 (-1/4)Del**2(Rho)) -0.2615445E-01 Diamond 0.1560219E-01 Metallicity 0.1489960E+01 Ellipticity -0.6446077E+01 Gb(Abramov) 0.2393115E-01 Vb(Abramov) -0.2170784E-01 Hb(Abramov) 0.2223302E-02 Ex_ueg -0.5649179E-02 Ec_ueg -0.1132327E-02 Delta_ex -0.6697239E-02 Delta_ec 0.2009494E-02 Delta_et -0.1783725E-01 Pxc 0.4989002E+01 Qxc -0.3332798E+01 3,+1 57 3 +1 -1.678161 0.509558 -0.577687 Rho 0.9259001E-02 |GRAD(Rho)| 0.8210198E-15 GRAD(Rho)x 0.4950318E-15 GRAD(Rho)y 0.6796862E-16 GRAD(Rho)z 0.6514578E-15 Laplacian 0.3974590E-01 (-1/4)Del**2(Rho)) -0.9936476E-02 Diamond 0.1242006E-02 Metallicity 0.7078279E+00 Ellipticity -0.1428908E+01 Gb(Abramov) 0.7796536E-02 Vb(Abramov) -0.5656597E-02 Hb(Abramov) 0.2139939E-02 Ex_ueg -0.1435943E-02 Ec_ueg -0.3345612E-03 Delta_ex -0.1876944E-02 Delta_ec 0.6071812E-03 Delta_et -0.4191418E-02 Pxc 0.4292019E+01 Qxc -0.3091243E+01 3,+1 58 3 -1 -2.970594 -1.969758 -0.839760 Rho 0.1414687E+00 |GRAD(Rho)| 0.3034248E-12 GRAD(Rho)x -0.1249227E-12 GRAD(Rho)y 0.1692827E-12 GRAD(Rho)z -0.2186419E-12 Laplacian 0.5643650E+00 (-1/4)Del**2(Rho)) -0.1410912E+00 Diamond 0.1071573E+01 Metallicity 0.4689794E+01 Ellipticity 0.2561747E-01 Gb(Abramov) 0.2043423E+00 Vb(Abramov) -0.2675934E+00 Hb(Abramov) -0.6325106E-01 Ex_ueg -0.5444177E-01 Ec_ueg -0.7899645E-02 Delta_ex -0.5980463E-01 Delta_ec 0.1463431E-01 Delta_et -0.1934015E+00 Pxc 0.6891673E+01 Qxc -0.4086605E+01 3,-1 59 3 +3 -1.107938 -1.093267 1.109913 Rho 0.4921443E-02 |GRAD(Rho)| 0.8546775E-17 GRAD(Rho)x -0.6195566E-17 GRAD(Rho)y -0.3967989E-17 GRAD(Rho)z 0.4349412E-17 Laplacian 0.2010207E-01 (-1/4)Del**2(Rho)) -0.5025518E-02 Diamond 0.1468642E-03 Metallicity 0.4881197E+00 Ellipticity -0.6766839E-01 Gb(Abramov) 0.3759188E-02 Vb(Abramov) -0.2492858E-02 Hb(Abramov) 0.1266330E-02 Ex_ueg -0.6182654E-03 Ec_ueg -0.1435337E-03 Delta_ex -0.7004740E-03 Delta_ec 0.1046319E-03 Delta_et -0.7795283E-03 Pxc 0.4307458E+01 Qxc -0.6694650E+01 3,+3 60 3 -1 -2.783117 -1.807990 0.578201 Rho 0.1420220E+00 |GRAD(Rho)| 0.2735910E-12 GRAD(Rho)x -0.6952534E-13 GRAD(Rho)y 0.1946625E-12 GRAD(Rho)z 0.1792338E-12 Laplacian 0.6000121E+00 (-1/4)Del**2(Rho)) -0.1500030E+00 Diamond 0.1141982E+01 Metallicity 0.4439959E+01 Ellipticity 0.8808607E-02 Gb(Abramov) 0.2110032E+00 Vb(Abramov) -0.2720035E+00 Hb(Abramov) -0.6100022E-01 Ex_ueg -0.5472584E-01 Ec_ueg -0.7934777E-02 Delta_ex -0.6361440E-01 Delta_ec 0.1549358E-01 Delta_et -0.2047713E+00 Pxc 0.6896960E+01 Qxc -0.4105854E+01 3,-1 61 3 -1 -1.688393 -1.687030 -0.496971 Rho 0.3916184E-01 |GRAD(Rho)| 0.2258285E-16 GRAD(Rho)x -0.1081767E-16 GRAD(Rho)y 0.1609384E-16 GRAD(Rho)z -0.1157375E-16 Laplacian 0.1559559E+00 (-1/4)Del**2(Rho)) -0.3898899E-01 Diamond 0.5578757E-01 Metallicity 0.1995490E+01 Ellipticity 0.1090373E-01 Gb(Abramov) 0.3895968E-01 Vb(Abramov) -0.3893038E-01 Hb(Abramov) 0.2930412E-04 Ex_ueg -0.9822057E-02 Ec_ueg -0.1825180E-02 Delta_ex -0.1202255E-01 Delta_ec 0.4556088E-02 Delta_et -0.4501159E-01 Pxc 0.5381417E+01 Qxc -0.2638787E+01 3,-1 62 3 +1 -1.113951 -1.252322 -2.127183 Rho 0.2534230E-01 |GRAD(Rho)| 0.2002575E-13 GRAD(Rho)x 0.1761027E-13 GRAD(Rho)y 0.6184119E-14 GRAD(Rho)z -0.7257108E-14 Laplacian 0.1010419E+00 (-1/4)Del**2(Rho)) -0.2526047E-01 Diamond 0.1428138E-01 Metallicity 0.1491152E+01 Ellipticity -0.5117896E+01 Gb(Abramov) 0.2311818E-01 Vb(Abramov) -0.2097589E-01 Hb(Abramov) 0.2142290E-02 Ex_ueg -0.5497684E-02 Ec_ueg -0.1105964E-02 Delta_ex -0.6394215E-02 Delta_ec 0.1870078E-02 Delta_et -0.1652792E-01 Pxc 0.4970943E+01 Qxc -0.3419223E+01 3,+1 63 3 +1 -1.758849 -1.755082 1.761710 Rho 0.1246795E-01 |GRAD(Rho)| 0.7889075E-15 GRAD(Rho)x -0.7534410E-16 GRAD(Rho)y 0.5680137E-15 GRAD(Rho)z 0.5422719E-15 Laplacian 0.6318261E-01 (-1/4)Del**2(Rho)) -0.1579565E-01 Diamond 0.2656320E-02 Metallicity 0.7311516E+00 Ellipticity -0.1244309E+01 Gb(Abramov) 0.1245527E-01 Vb(Abramov) -0.9114890E-02 Hb(Abramov) 0.3340381E-02 Ex_ueg -0.2135233E-02 Ec_ueg -0.4812142E-03 Delta_ex -0.3134001E-02 Delta_ec 0.8143111E-03 Delta_et -0.6167631E-02 Pxc 0.4437178E+01 Qxc -0.3848653E+01 3,+1 64 3 +1 -0.551703 -1.679598 0.534336 Rho 0.8608926E-02 |GRAD(Rho)| 0.3477952E-14 GRAD(Rho)x -0.7462599E-15 GRAD(Rho)y 0.7434171E-15 GRAD(Rho)z -0.3314600E-14 Laplacian 0.3578781E-01 (-1/4)Del**2(Rho)) -0.8946952E-02 Diamond 0.1017503E-02 Metallicity 0.6962947E+00 Ellipticity -0.1440703E+01 Gb(Abramov) 0.7002920E-02 Vb(Abramov) -0.5058889E-02 Hb(Abramov) 0.1944031E-02 Ex_ueg -0.1303118E-02 Ec_ueg -0.3053795E-03 Delta_ex -0.1661643E-02 Delta_ec 0.5505255E-03 Delta_et -0.3725704E-02 Pxc 0.4267208E+01 Qxc -0.3018285E+01 3,+1 65 3 +3 -1.835698 -1.843176 -1.851891 Rho 0.1244759E-01 |GRAD(Rho)| 0.5782792E-14 GRAD(Rho)x 0.3275787E-14 GRAD(Rho)y 0.3416615E-14 GRAD(Rho)z 0.3322145E-14 Laplacian 0.5718365E-01 (-1/4)Del**2(Rho)) -0.1429591E-01 Diamond 0.1318814E-02 Metallicity 0.8056572E+00 Ellipticity -0.7187052E+00 Gb(Abramov) 0.1145021E-01 Vb(Abramov) -0.8604506E-02 Hb(Abramov) 0.2845703E-02 Ex_ueg -0.2130585E-02 Ec_ueg -0.4802707E-03 Delta_ex -0.2538013E-02 Delta_ec 0.2063740E-03 Delta_et -0.1964955E-02 Pxc 0.4436217E+01 Qxc -0.1229812E+02 3,+3 66 3 +1 -0.578209 -0.513989 1.680819 Rho 0.8279383E-02 |GRAD(Rho)| 0.2276518E-13 GRAD(Rho)x -0.1024052E-13 GRAD(Rho)y 0.1900246E-13 GRAD(Rho)z -0.7231286E-14 Laplacian 0.3410854E-01 (-1/4)Del**2(Rho)) -0.8527135E-02 Diamond 0.9166753E-03 Metallicity 0.6845628E+00 Ellipticity -0.1431291E+01 Gb(Abramov) 0.6657650E-02 Vb(Abramov) -0.4788165E-02 Hb(Abramov) 0.1869485E-02 Ex_ueg -0.1237036E-02 Ec_ueg -0.2906577E-03 Delta_ex -0.1566992E-02 Delta_ec 0.5222229E-03 Delta_et -0.3499903E-02 Pxc 0.4255989E+01 Qxc -0.3000618E+01 3,+1 67 3 +1 -1.691941 -0.536704 0.525420 Rho 0.8619092E-02 |GRAD(Rho)| 0.1865154E-16 GRAD(Rho)x -0.1234996E-16 GRAD(Rho)y -0.1397183E-16 GRAD(Rho)z -0.3827957E-18 Laplacian 0.3570810E-01 (-1/4)Del**2(Rho)) -0.8927025E-02 Diamond 0.1015505E-02 Metallicity 0.6992228E+00 Ellipticity -0.1443486E+01 Gb(Abramov) 0.6991680E-02 Vb(Abramov) -0.5056335E-02 Hb(Abramov) 0.1935345E-02 Ex_ueg -0.1305170E-02 Ec_ueg -0.3058344E-03 Delta_ex -0.1657817E-02 Delta_ec 0.5482054E-03 Delta_et -0.3711966E-02 Pxc 0.4267570E+01 Qxc -0.3024080E+01 3,+1 68 3 +1 -1.983253 1.978890 1.992545 Rho 0.1294312E-01 |GRAD(Rho)| 0.2907265E-16 GRAD(Rho)x 0.2201182E-16 GRAD(Rho)y 0.1688028E-16 GRAD(Rho)z -0.8703740E-17 Laplacian 0.6281857E-01 (-1/4)Del**2(Rho)) -0.1570464E-01 Diamond 0.2331615E-02 Metallicity 0.7826907E+00 Ellipticity -0.1156036E+01 Gb(Abramov) 0.1251841E-01 Vb(Abramov) -0.9332173E-02 Hb(Abramov) 0.3186235E-02 Ex_ueg -0.2244418E-02 Ec_ueg -0.5032799E-03 Delta_ex -0.3029826E-02 Delta_ec 0.6004017E-03 Delta_et -0.4744033E-02 Pxc 0.4459582E+01 Qxc -0.5046330E+01 3,+1 69 3 +1 0.032958 -0.031669 2.913159 Rho 0.4779992E-02 |GRAD(Rho)| 0.9337318E-17 GRAD(Rho)x 0.8906417E-17 GRAD(Rho)y 0.2803787E-17 GRAD(Rho)z 0.5346517E-20 Laplacian 0.1954032E-01 (-1/4)Del**2(Rho)) -0.4885080E-02 Diamond 0.4682246E-03 Metallicity 0.4783290E+00 Ellipticity -0.6790424E+01 Gb(Abramov) 0.3646166E-02 Vb(Abramov) -0.2407252E-02 Hb(Abramov) 0.1238914E-02 Ex_ueg -0.5946863E-03 Ec_ueg -0.1374573E-03 Delta_ex -0.1001892E-02 Delta_ec 0.6844695E-03 Delta_et -0.3639232E-02 Pxc 0.4326336E+01 Qxc -0.1463750E+01 3,+1 70 3 -1 -1.815037 -0.588281 2.795356 Rho 0.1493839E+00 |GRAD(Rho)| 0.2243498E-15 GRAD(Rho)x 0.1480478E-15 GRAD(Rho)y 0.1559354E-15 GRAD(Rho)z 0.6402214E-16 Laplacian 0.6303953E+00 (-1/4)Del**2(Rho)) -0.1575988E+00 Diamond 0.1273449E+01 Metallicity 0.4597341E+01 Ellipticity 0.9754113E-02 Gb(Abramov) 0.2258218E+00 Vb(Abramov) -0.2940448E+00 Hb(Abramov) -0.6822297E-01 Ex_ueg -0.5854057E-01 Ec_ueg -0.8404089E-02 Delta_ex -0.6765263E-01 Delta_ec 0.1605120E-01 Delta_et -0.2136428E+00 Pxc 0.6965724E+01 Qxc -0.4214803E+01 3,-1 71 3 -1 -1.678228 -0.503187 -1.706486 Rho 0.4107440E-01 |GRAD(Rho)| 0.2136278E-15 GRAD(Rho)x -0.1122759E-15 GRAD(Rho)y 0.5372995E-16 GRAD(Rho)z -0.1736204E-15 Laplacian 0.1645992E+00 (-1/4)Del**2(Rho)) -0.4114980E-01 Diamond 0.6309071E-01 Metallicity 0.2047093E+01 Ellipticity 0.1378274E-01 Gb(Abramov) 0.4147278E-01 Vb(Abramov) -0.4179575E-01 Hb(Abramov) -0.3229790E-03 Ex_ueg -0.1046679E-01 Ec_ueg -0.1927791E-02 Delta_ex -0.1285523E-01 Delta_ec 0.4833703E-02 Delta_et -0.4837227E-01 Pxc 0.5429420E+01 Qxc -0.2659500E+01 3,-1 72 3 +1 -0.538652 0.538825 -1.688314 Rho 0.9014862E-02 |GRAD(Rho)| 0.1270518E-16 GRAD(Rho)x 0.7174729E-17 GRAD(Rho)y 0.6174569E-17 GRAD(Rho)z 0.8474647E-17 Laplacian 0.3773354E-01 (-1/4)Del**2(Rho)) -0.9433384E-02 Diamond 0.1139746E-02 Metallicity 0.7131007E+00 Ellipticity -0.1449410E+01 Gb(Abramov) 0.7410081E-02 Vb(Abramov) -0.5386779E-02 Hb(Abramov) 0.2023303E-02 Ex_ueg -0.1385683E-02 Ec_ueg -0.3235802E-03 Delta_ex -0.1771183E-02 Delta_ec 0.5785389E-03 Delta_et -0.3964338E-02 Pxc 0.4282348E+01 Qxc -0.3061477E+01 3,+1 73 3 +1 -2.901643 -0.123374 -0.116632 Rho 0.5085029E-02 |GRAD(Rho)| 0.4055132E-16 GRAD(Rho)x 0.5384057E-17 GRAD(Rho)y -0.4010951E-16 GRAD(Rho)z 0.2578442E-17 Laplacian 0.2125370E-01 (-1/4)Del**2(Rho)) -0.5313425E-02 Diamond 0.5133848E-03 Metallicity 0.4875296E+00 Ellipticity -0.2992681E+01 Gb(Abramov) 0.3974025E-02 Vb(Abramov) -0.2634626E-02 Hb(Abramov) 0.1339400E-02 Ex_ueg -0.6458172E-03 Ec_ueg -0.1505738E-03 Delta_ex -0.1065955E-02 Delta_ec 0.6796094E-03 Delta_et -0.3705409E-02 Pxc 0.4289042E+01 Qxc -0.1568483E+01 3,+1 74 3 +3 1.091604 1.105977 1.112562 Rho 0.4925733E-02 |GRAD(Rho)| 0.3499065E-17 GRAD(Rho)x -0.2124208E-17 GRAD(Rho)y -0.2701543E-17 GRAD(Rho)z -0.6579222E-18 Laplacian 0.2011854E-01 (-1/4)Del**2(Rho)) -0.5029634E-02 Diamond 0.1471073E-03 Metallicity 0.4884291E+00 Ellipticity -0.7584977E-01 Gb(Abramov) 0.3762526E-02 Vb(Abramov) -0.2495418E-02 Hb(Abramov) 0.1267108E-02 Ex_ueg -0.6189842E-03 Ec_ueg -0.1437182E-03 Delta_ex -0.7011653E-03 Delta_ec 0.1046289E-03 Delta_et -0.7798513E-03 Pxc 0.4306930E+01 Qxc -0.6701452E+01 3,+3 75 3 +1 2.096983 -1.204781 1.144583 Rho 0.2459964E-01 |GRAD(Rho)| 0.6166032E-16 GRAD(Rho)x 0.5869013E-16 GRAD(Rho)y -0.1505324E-16 GRAD(Rho)z 0.1143960E-16 Laplacian 0.9872047E-01 (-1/4)Del**2(Rho)) -0.2468012E-01 Diamond 0.1388838E-01 Metallicity 0.1452403E+01 Ellipticity -0.6574944E+01 Gb(Abramov) 0.2242766E-01 Vb(Abramov) -0.2017520E-01 Hb(Abramov) 0.2252458E-02 Ex_ueg -0.5283927E-02 Ec_ueg -0.1068578E-02 Delta_ex -0.6253361E-02 Delta_ec 0.1924967E-02 Delta_et -0.1686424E-01 Pxc 0.4944821E+01 Qxc -0.3248556E+01 3,+1 76 3 +3 -2.356307 -0.038089 -0.024808 Rho 0.4528940E-02 |GRAD(Rho)| 0.5100143E-17 GRAD(Rho)x 0.8370340E-18 GRAD(Rho)y -0.4438932E-17 GRAD(Rho)z 0.2367850E-17 Laplacian 0.1905438E-01 (-1/4)Del**2(Rho)) -0.4763595E-02 Diamond 0.1773243E-03 Metallicity 0.4483452E+00 Ellipticity -0.3159602E+00 Gb(Abramov) 0.3531686E-02 Vb(Abramov) -0.2299777E-02 Hb(Abramov) 0.1231909E-02 Ex_ueg -0.5534101E-03 Ec_ueg -0.1266978E-03 Delta_ex -0.7052865E-03 Delta_ec 0.1995426E-03 Delta_et -0.1215401E-02 Pxc 0.4367953E+01 Qxc -0.3534516E+01 3,+3 77 3 +3 -0.031955 0.033775 2.352093 Rho 0.4213114E-02 |GRAD(Rho)| 0.4051128E-17 GRAD(Rho)x 0.1549091E-17 GRAD(Rho)y 0.2112587E-17 GRAD(Rho)z 0.3090134E-17 Laplacian 0.1728648E-01 (-1/4)Del**2(Rho)) -0.4321621E-02 Diamond 0.1418889E-03 Metallicity 0.4381052E+00 Ellipticity -0.2480935E+00 Gb(Abramov) 0.3196635E-02 Vb(Abramov) -0.2071649E-02 Hb(Abramov) 0.1124986E-02 Ex_ueg -0.5025616E-03 Ec_ueg -0.1132086E-03 Delta_ex -0.6237714E-03 Delta_ec 0.1727496E-03 Delta_et -0.1043601E-02 Pxc 0.4439251E+01 Qxc -0.3610842E+01 3,+3 78 3 -1 -0.561898 2.760068 -1.810607 Rho 0.1272946E+00 |GRAD(Rho)| 0.5559707E-15 GRAD(Rho)x -0.4638623E-15 GRAD(Rho)y 0.1072513E-15 GRAD(Rho)z 0.2871103E-15 Laplacian 0.5325474E+00 (-1/4)Del**2(Rho)) -0.1331369E+00 Diamond 0.8962687E+00 Metallicity 0.4168100E+01 Ellipticity 0.1314165E-01 Gb(Abramov) 0.1812459E+00 Vb(Abramov) -0.2293549E+00 Hb(Abramov) -0.4810901E-01 Ex_ueg -0.4729316E-01 Ec_ueg -0.7006305E-02 Delta_ex -0.5507985E-01 Delta_ec 0.1428696E-01 Delta_et -0.1858900E+00 Pxc 0.6750086E+01 Qxc -0.3855254E+01 3,-1 79 3 +3 -1.095147 1.092852 -1.136026 Rho 0.5220007E-02 |GRAD(Rho)| 0.3238108E-13 GRAD(Rho)x 0.5148758E-14 GRAD(Rho)y 0.3168181E-13 GRAD(Rho)z 0.4276394E-14 Laplacian 0.2204686E-01 (-1/4)Del**2(Rho)) -0.5511716E-02 Diamond 0.1748696E-03 Metallicity 0.4909660E+00 Ellipticity -0.1757193E+00 Gb(Abramov) 0.4125488E-02 Vb(Abramov) -0.2739260E-02 Hb(Abramov) 0.1386228E-02 Ex_ueg -0.6687746E-03 Ec_ueg -0.1563928E-03 Delta_ex -0.7810041E-03 Delta_ec 0.1151979E-03 Delta_et -0.8667006E-03 Pxc 0.4276249E+01 Qxc -0.6779675E+01 3,+3 80 3 +3 0.032094 2.350855 -0.023213 Rho 0.4566703E-02 |GRAD(Rho)| 0.4129736E-15 GRAD(Rho)x -0.2021165E-15 GRAD(Rho)y -0.3167307E-15 GRAD(Rho)z 0.1713995E-15 Laplacian 0.1919151E-01 (-1/4)Del**2(Rho)) -0.4797876E-02 Diamond 0.1790985E-03 Metallicity 0.4513451E+00 Ellipticity -0.3178949E+00 Gb(Abramov) 0.3559500E-02 Vb(Abramov) -0.2321125E-02 Hb(Abramov) 0.1238376E-02 Ex_ueg -0.5595712E-03 Ec_ueg -0.1283142E-03 Delta_ex -0.7102449E-03 Delta_ec 0.1981282E-03 Delta_et -0.1212780E-02 Pxc 0.4360947E+01 Qxc -0.3584774E+01 3,+3 81 3 -1 -0.836228 2.957495 1.973063 Rho 0.1317799E+00 |GRAD(Rho)| 0.6407976E-15 GRAD(Rho)x 0.5139660E-15 GRAD(Rho)y -0.2314297E-15 GRAD(Rho)z 0.3047963E-15 Laplacian 0.5292887E+00 (-1/4)Del**2(Rho)) -0.1323222E+00 Diamond 0.9254986E+00 Metallicity 0.4442930E+01 Ellipticity 0.3581019E-01 Gb(Abramov) 0.1861978E+00 Vb(Abramov) -0.2400734E+00 Hb(Abramov) -0.5387563E-01 Ex_ueg -0.4952800E-01 Ec_ueg -0.7287581E-02 Delta_ex -0.5516278E-01 Delta_ec 0.1401726E-01 Delta_et -0.1833096E+00 Pxc 0.6796220E+01 Qxc -0.3935347E+01 3,-1 82 3 +1 0.125726 2.900980 -0.123230 Rho 0.5144771E-02 |GRAD(Rho)| 0.2204474E-14 GRAD(Rho)x 0.1573230E-14 GRAD(Rho)y 0.8208833E-16 GRAD(Rho)z -0.1542049E-14 Laplacian 0.2148229E-01 (-1/4)Del**2(Rho)) -0.5370574E-02 Diamond 0.5251511E-03 Metallicity 0.4918234E+00 Ellipticity -0.3007116E+01 Gb(Abramov) 0.4020611E-02 Vb(Abramov) -0.2670649E-02 Hb(Abramov) 0.1349962E-02 Ex_ueg -0.6559535E-03 Ec_ueg -0.1531482E-03 Delta_ex -0.1078087E-02 Delta_ec 0.6837787E-03 Delta_et -0.3742502E-02 Pxc 0.4283130E+01 Qxc -0.1576661E+01 3,+1 83 3 -1 -0.494903 1.696209 1.675905 Rho 0.3714855E-01 |GRAD(Rho)| 0.1170833E-12 GRAD(Rho)x -0.8215753E-13 GRAD(Rho)y -0.5225630E-13 GRAD(Rho)z 0.6502242E-13 Laplacian 0.1459167E+00 (-1/4)Del**2(Rho)) -0.3647917E-01 Diamond 0.4836026E-01 Metallicity 0.1953191E+01 Ellipticity 0.1657233E-01 Gb(Abramov) 0.3619457E-01 Vb(Abramov) -0.3590998E-01 Hb(Abramov) 0.2845924E-03 Ex_ueg -0.9154632E-02 Ec_ueg -0.1717900E-02 Delta_ex -0.1108827E-01 Delta_ec 0.4239013E-02 Delta_et -0.4128514E-01 Pxc 0.5328967E+01 Qxc -0.2615767E+01 3,-1 84 3 +1 1.758066 -1.760053 -1.757630 Rho 0.1244727E-01 |GRAD(Rho)| 0.5409825E-17 GRAD(Rho)x 0.5134596E-17 GRAD(Rho)y 0.1703535E-17 GRAD(Rho)z -0.9739426E-20 Laplacian 0.6307728E-01 (-1/4)Del**2(Rho)) -0.1576932E-01 Diamond 0.2647371E-02 Metallicity 0.7303492E+00 Ellipticity -0.1243186E+01 Gb(Abramov) 0.1243240E-01 Vb(Abramov) -0.9095477E-02 Hb(Abramov) 0.3336922E-02 Ex_ueg -0.2130512E-02 Ec_ueg -0.4802559E-03 Delta_ex -0.3127818E-02 Delta_ec 0.8136973E-03 Delta_et -0.6159932E-02 Pxc 0.4436202E+01 Qxc -0.3843958E+01 3,+1 85 3 -1 0.588183 -2.792132 -1.809899 Rho 0.1467469E+00 |GRAD(Rho)| 0.1760658E-13 GRAD(Rho)x -0.1329764E-13 GRAD(Rho)y 0.1102372E-13 GRAD(Rho)z -0.3412038E-14 Laplacian 0.6201641E+00 (-1/4)Del**2(Rho)) -0.1550410E+00 Diamond 0.1227360E+01 Metallicity 0.4536507E+01 Ellipticity 0.8987403E-02 Gb(Abramov) 0.2205848E+00 Vb(Abramov) -0.2861286E+00 Hb(Abramov) -0.6554377E-01 Ex_ueg -0.5716678E-01 Ec_ueg -0.8235597E-02 Delta_ex -0.6627577E-01 Delta_ec 0.1588041E-01 Delta_et -0.2108806E+00 Pxc 0.6941426E+01 Qxc -0.4173430E+01 3,-1 86 3 +3 0.002497 -2.354399 -0.001062 Rho 0.4332966E-02 |GRAD(Rho)| 0.5438361E-17 GRAD(Rho)x 0.2560859E-17 GRAD(Rho)y 0.4789130E-17 GRAD(Rho)z -0.2863773E-18 Laplacian 0.1787767E-01 (-1/4)Del**2(Rho)) -0.4469418E-02 Diamond 0.1554491E-03 Metallicity 0.4438923E+00 Ellipticity -0.2752709E+00 Gb(Abramov) 0.3310269E-02 Vb(Abramov) -0.2151120E-02 Hb(Abramov) 0.1159149E-02 Ex_ueg -0.5217135E-03 Ec_ueg -0.1183215E-03 Delta_ex -0.6530574E-03 Delta_ec 0.1847228E-03 Delta_et -0.1115863E-02 Pxc 0.4409287E+01 Qxc -0.3535338E+01 3,+3 87 3 -1 0.583800 -1.817050 -2.782749 Rho 0.1432085E+00 |GRAD(Rho)| 0.1258989E-12 GRAD(Rho)x -0.7632344E-13 GRAD(Rho)y -0.9953078E-13 GRAD(Rho)z 0.1090368E-13 Laplacian 0.6043887E+00 (-1/4)Del**2(Rho)) -0.1510972E+00 Diamond 0.1160164E+01 Metallicity 0.4469354E+01 Ellipticity 0.8231426E-02 Gb(Abramov) 0.2132826E+00 Vb(Abramov) -0.2754680E+00 Hb(Abramov) -0.6218540E-01 Ex_ueg -0.5533629E-01 Ec_ueg -0.8010186E-02 Delta_ex -0.6419056E-01 Delta_ec 0.1554269E-01 Delta_et -0.2056053E+00 Pxc 0.6908240E+01 Qxc -0.4129951E+01 3,-1 88 3 +1 -0.994962 2.099160 1.355041 Rho 0.2645285E-01 |GRAD(Rho)| 0.1889966E-15 GRAD(Rho)x 0.7061242E-16 GRAD(Rho)y 0.1083281E-15 GRAD(Rho)z 0.1378354E-15 Laplacian 0.1042405E+00 (-1/4)Del**2(Rho)) -0.2606012E-01 Diamond 0.1344418E-01 Metallicity 0.1552498E+01 Ellipticity -0.2659167E+01 Gb(Abramov) 0.2411646E-01 Vb(Abramov) -0.2217280E-01 Hb(Abramov) 0.1943661E-02 Ex_ueg -0.5821233E-02 Ec_ueg -0.1162138E-02 Delta_ex -0.6451786E-02 Delta_ec 0.1536518E-02 Delta_et -0.1379529E-01 Pxc 0.5009074E+01 Qxc -0.4198964E+01 3,+1 89 3 +1 0.549119 -1.683631 -0.542641 Rho 0.8521490E-02 |GRAD(Rho)| 0.2162309E-15 GRAD(Rho)x -0.4388184E-16 GRAD(Rho)y 0.1867796E-15 GRAD(Rho)z -0.9971744E-16 Laplacian 0.3523605E-01 (-1/4)Del**2(Rho)) -0.8809013E-02 Diamond 0.9924675E-03 Metallicity 0.6952673E+00 Ellipticity -0.1447276E+01 Gb(Abramov) 0.6893445E-02 Vb(Abramov) -0.4977877E-02 Hb(Abramov) 0.1915568E-02 Ex_ueg -0.1285501E-02 Ec_ueg -0.3014687E-03 Delta_ex -0.1633912E-02 Delta_ec 0.5456822E-03 Delta_et -0.3680310E-02 Pxc 0.4264127E+01 Qxc -0.2994255E+01 3,+1 90 3 -1 0.478650 -1.679057 1.689354 Rho 0.3864901E-01 |GRAD(Rho)| 0.1109210E-12 GRAD(Rho)x -0.4699175E-13 GRAD(Rho)y 0.1004214E-12 GRAD(Rho)z -0.3284627E-14 Laplacian 0.1537818E+00 (-1/4)Del**2(Rho)) -0.3844546E-01 Diamond 0.5415540E-01 Metallicity 0.1979728E+01 Ellipticity 0.1118673E-01 Gb(Abramov) 0.3831556E-01 Vb(Abramov) -0.3818566E-01 Hb(Abramov) 0.1298974E-03 Ex_ueg -0.9650939E-02 Ec_ueg -0.1797781E-02 Delta_ex -0.1182368E-01 Delta_ec 0.4506298E-02 Delta_et -0.4436328E-01 Pxc 0.5368251E+01 Qxc -0.2623812E+01 3,-1 91 3 +1 1.681501 -0.548045 -0.542714 Rho 0.8554165E-02 |GRAD(Rho)| 0.3748796E-13 GRAD(Rho)x 0.1090099E-13 GRAD(Rho)y -0.3465950E-13 GRAD(Rho)z 0.9232241E-14 Laplacian 0.3539127E-01 (-1/4)Del**2(Rho)) -0.8847818E-02 Diamond 0.1002355E-02 Metallicity 0.6966474E+00 Ellipticity -0.1448576E+01 Gb(Abramov) 0.6925847E-02 Vb(Abramov) -0.5003876E-02 Hb(Abramov) 0.1921971E-02 Ex_ueg -0.1292078E-02 Ec_ueg -0.3029298E-03 Delta_ex -0.1642813E-02 Delta_ec 0.5483373E-03 Delta_et -0.3701762E-02 Pxc 0.4265270E+01 Qxc -0.2995989E+01 3,+1 92 3 +1 1.169173 -1.166901 2.108301 Rho 0.2528826E-01 |GRAD(Rho)| 0.2289702E-16 GRAD(Rho)x 0.6639806E-17 GRAD(Rho)y 0.2391438E-17 GRAD(Rho)z 0.2178228E-16 Laplacian 0.1030193E+00 (-1/4)Del**2(Rho)) -0.2575484E-01 Diamond 0.1529475E-01 Metallicity 0.1457335E+01 Ellipticity -0.7967702E+01 Gb(Abramov) 0.2342546E-01 Vb(Abramov) -0.2109609E-01 Hb(Abramov) 0.2329374E-02 Ex_ueg -0.5482060E-02 Ec_ueg -0.1103239E-02 Delta_ex -0.6598742E-02 Delta_ec 0.2054965E-02 Delta_et -0.1812180E-01 Pxc 0.4969060E+01 Qxc -0.3211121E+01 3,+1 93 3 +1 0.055628 0.050457 -2.894877 Rho 0.5037225E-02 |GRAD(Rho)| 0.5499959E-15 GRAD(Rho)x 0.3554540E-15 GRAD(Rho)y 0.4183373E-15 GRAD(Rho)z 0.3379062E-16 Laplacian 0.2053229E-01 (-1/4)Del**2(Rho)) -0.5133072E-02 Diamond 0.5272837E-03 Metallicity 0.4967769E+00 Ellipticity -0.1367702E+02 Gb(Abramov) 0.3847047E-02 Vb(Abramov) -0.2561021E-02 Hb(Abramov) 0.1286025E-02 Ex_ueg -0.6377350E-03 Ec_ueg -0.1485151E-03 Delta_ex -0.1062460E-02 Delta_ec 0.7182343E-03 Delta_et -0.3880353E-02 Pxc 0.4294075E+01 Qxc -0.1479266E+01 3,+1 94 3 +1 0.541360 -0.540400 -1.693241 Rho 0.8803105E-02 |GRAD(Rho)| 0.7441884E-17 GRAD(Rho)x 0.4793958E-17 GRAD(Rho)y -0.3265908E-18 GRAD(Rho)z -0.5682688E-17 Laplacian 0.3667620E-01 (-1/4)Del**2(Rho)) -0.9169049E-02 Diamond 0.1072478E-02 Metallicity 0.7051617E+00 Ellipticity -0.1444588E+01 Gb(Abramov) 0.7190310E-02 Vb(Abramov) -0.5211570E-02 Hb(Abramov) 0.1978739E-02 Ex_ueg -0.1342455E-02 Ec_ueg -0.3140767E-03 Delta_ex -0.1711328E-02 Delta_ec 0.5622935E-03 Delta_et -0.3829109E-02 Pxc 0.4274288E+01 Qxc -0.3043479E+01 3,+1 95 3 +3 2.354716 -0.000750 -0.000666 Rho 0.4334302E-02 |GRAD(Rho)| 0.5076287E-17 GRAD(Rho)x 0.1100823E-17 GRAD(Rho)y 0.4655631E-18 GRAD(Rho)z -0.4933572E-17 Laplacian 0.1788866E-01 (-1/4)Del**2(Rho)) -0.4472164E-02 Diamond 0.1563658E-03 Metallicity 0.4438477E+00 Ellipticity -0.2717376E+00 Gb(Abramov) 0.3312269E-02 Vb(Abramov) -0.2152375E-02 Hb(Abramov) 0.1159895E-02 Ex_ueg -0.5219280E-03 Ec_ueg -0.1183785E-03 Delta_ex -0.6543585E-03 Delta_ec 0.1863530E-03 Delta_et -0.1123904E-02 Pxc 0.4408975E+01 Qxc -0.3511392E+01 3,+3 96 3 +1 -0.512701 1.677179 -0.575287 Rho 0.9275010E-02 |GRAD(Rho)| 0.1831538E-16 GRAD(Rho)x -0.1058711E-16 GRAD(Rho)y 0.1374233E-16 GRAD(Rho)z -0.5874927E-17 Laplacian 0.3970527E-01 (-1/4)Del**2(Rho)) -0.9926316E-02 Diamond 0.1238176E-02 Metallicity 0.7105954E+00 Ellipticity -0.1427913E+01 Gb(Abramov) 0.7793143E-02 Vb(Abramov) -0.5659970E-02 Hb(Abramov) 0.2133173E-02 Ex_ueg -0.1439254E-02 Ec_ueg -0.3352822E-03 Delta_ex -0.1873605E-02 Delta_ec 0.6025708E-03 Delta_et -0.4164383E-02 Pxc 0.4292666E+01 Qxc -0.3109352E+01 3,+1 97 3 +1 0.514568 0.578498 1.682286 Rho 0.8240197E-02 |GRAD(Rho)| 0.9920938E-17 GRAD(Rho)x -0.7463677E-17 GRAD(Rho)y 0.4203547E-17 GRAD(Rho)z -0.5004870E-17 Laplacian 0.3389420E-01 (-1/4)Del**2(Rho)) -0.8473550E-02 Diamond 0.9044183E-03 Metallicity 0.6834664E+00 Ellipticity -0.1430333E+01 Gb(Abramov) 0.6614264E-02 Vb(Abramov) -0.4754979E-02 Hb(Abramov) 0.1859286E-02 Ex_ueg -0.1229236E-02 Ec_ueg -0.2889104E-03 Delta_ex -0.1555007E-02 Delta_ec 0.5183997E-03 Delta_et -0.3470353E-02 Pxc 0.4254730E+01 Qxc -0.2999630E+01 3,+1 98 3 +1 1.677955 0.552292 0.535122 Rho 0.8621002E-02 |GRAD(Rho)| 0.1830859E-16 GRAD(Rho)x -0.1554348E-16 GRAD(Rho)y -0.9501795E-17 GRAD(Rho)z -0.1822224E-17 Laplacian 0.3586330E-01 (-1/4)Del**2(Rho)) -0.8965826E-02 Diamond 0.1022188E-02 Metallicity 0.6964540E+00 Ellipticity -0.1441129E+01 Gb(Abramov) 0.7017931E-02 Vb(Abramov) -0.5070037E-02 Hb(Abramov) 0.1947894E-02 Ex_ueg -0.1305556E-02 Ec_ueg -0.3059199E-03 Delta_ex -0.1665995E-02 Delta_ec 0.5521607E-03 Delta_et -0.3737796E-02 Pxc 0.4267639E+01 Qxc -0.3017229E+01 3,+1 99 3 +3 0.005485 -0.003540 -2.365488 Rho 0.4509916E-02 |GRAD(Rho)| 0.3379994E-15 GRAD(Rho)x 0.1513229E-15 GRAD(Rho)y 0.1592479E-15 GRAD(Rho)z 0.2568757E-15 Laplacian 0.1864366E-01 (-1/4)Del**2(Rho)) -0.4660916E-02 Diamond 0.1724148E-03 Metallicity 0.4550187E+00 Ellipticity -0.2809661E+00 Gb(Abramov) 0.3460745E-02 Vb(Abramov) -0.2260573E-02 Hb(Abramov) 0.1200171E-02 Ex_ueg -0.5503128E-03 Ec_ueg -0.1258838E-03 Delta_ex -0.6892503E-03 Delta_ec 0.1950509E-03 Delta_et -0.1187032E-02 Pxc 0.4371593E+01 Qxc -0.3533694E+01 3,+3 100 3 +1 1.985026 1.983370 -1.995878 Rho 0.1266262E-01 |GRAD(Rho)| 0.3364306E-15 GRAD(Rho)x -0.1954384E-15 GRAD(Rho)y -0.2077489E-15 GRAD(Rho)z 0.1784091E-15 Laplacian 0.5988185E-01 (-1/4)Del**2(Rho)) -0.1497046E-01 Diamond 0.2108851E-02 Metallicity 0.7916331E+00 Ellipticity -0.1150070E+01 Gb(Abramov) 0.1195549E-01 Vb(Abramov) -0.8940525E-02 Hb(Abramov) 0.3014969E-02 Ex_ueg -0.2179799E-02 Ec_ueg -0.4902436E-03 Delta_ex -0.2858004E-02 Delta_ec 0.5495018E-03 Delta_et -0.4344588E-02 Pxc 0.4446359E+01 Qxc -0.5201082E+01 3,+1 101 3 +1 1.221922 2.109979 -1.145263 Rho 0.2582136E-01 |GRAD(Rho)| 0.8582780E-16 GRAD(Rho)x 0.6384461E-17 GRAD(Rho)y -0.8450203E-16 GRAD(Rho)z 0.1360357E-16 Laplacian 0.1044735E+00 (-1/4)Del**2(Rho)) -0.2611838E-01 Diamond 0.1558101E-01 Metallicity 0.1487894E+01 Ellipticity -0.6569047E+01 Gb(Abramov) 0.2388915E-01 Vb(Abramov) -0.2165992E-01 Hb(Abramov) 0.2229231E-02 Ex_ueg -0.5636685E-02 Ec_ueg -0.1130156E-02 Delta_ex -0.6688818E-02 Delta_ec 0.2013378E-02 Delta_et -0.1786298E-01 Pxc 0.4987526E+01 Qxc -0.3322186E+01 3,+1 102 3 +1 0.532731 1.690356 0.524675 Rho 0.8670993E-02 |GRAD(Rho)| 0.1089601E-16 GRAD(Rho)x -0.7274795E-17 GRAD(Rho)y 0.5032072E-17 GRAD(Rho)z 0.6362285E-17 Laplacian 0.3597442E-01 (-1/4)Del**2(Rho)) -0.8993604E-02 Diamond 0.1031060E-02 Metallicity 0.7010260E+00 Ellipticity -0.1443863E+01 Gb(Abramov) 0.7046528E-02 Vb(Abramov) -0.5099452E-02 Hb(Abramov) 0.1947076E-02 Ex_ueg -0.1315659E-02 Ec_ueg -0.3081577E-03 Delta_ex -0.1672498E-02 Delta_ec 0.5519636E-03 Delta_et -0.3743558E-02 Pxc 0.4269436E+01 Qxc -0.3030088E+01 3,+1 103 3 +1 1.751639 1.759665 1.762240 Rho 0.1246457E-01 |GRAD(Rho)| 0.1630626E-15 GRAD(Rho)x 0.1367533E-15 GRAD(Rho)y -0.7298028E-16 GRAD(Rho)z -0.5061448E-16 Laplacian 0.6315259E-01 (-1/4)Del**2(Rho)) -0.1578815E-01 Diamond 0.2654250E-02 Metallicity 0.7311685E+00 Ellipticity -0.1245335E+01 Gb(Abramov) 0.1244940E-01 Vb(Abramov) -0.9110649E-02 Hb(Abramov) 0.3338750E-02 Ex_ueg -0.2134461E-02 Ec_ueg -0.4810575E-03 Delta_ex -0.3132336E-02 Delta_ec 0.8140125E-03 Delta_et -0.6164896E-02 Pxc 0.4437018E+01 Qxc -0.3848020E+01 3,+1 104 3 +3 1.841434 1.837039 -1.851357 Rho 0.1245082E-01 |GRAD(Rho)| 0.3729774E-15 GRAD(Rho)x -0.2034496E-15 GRAD(Rho)y -0.2222286E-15 GRAD(Rho)z 0.2198519E-15 Laplacian 0.5722275E-01 (-1/4)Del**2(Rho)) -0.1430569E-01 Diamond 0.1320799E-02 Metallicity 0.8054548E+00 Ellipticity -0.7217994E+00 Gb(Abramov) 0.1145756E-01 Vb(Abramov) -0.8609424E-02 Hb(Abramov) 0.2848132E-02 Ex_ueg -0.2131322E-02 Ec_ueg -0.4804203E-03 Delta_ex -0.2540109E-02 Delta_ec 0.2068113E-03 Delta_et -0.1968356E-02 Pxc 0.4436370E+01 Qxc -0.1228226E+02 3,+3 105 3 -1 1.969025 2.971871 -0.841490 Rho 0.1419326E+00 |GRAD(Rho)| 0.2564773E-15 GRAD(Rho)x -0.8761709E-16 GRAD(Rho)y -0.2243689E-15 GRAD(Rho)z 0.8810498E-16 Laplacian 0.5665672E+00 (-1/4)Del**2(Rho)) -0.1416418E+00 Diamond 0.1079830E+01 Metallicity 0.4697123E+01 Ellipticity 0.2624337E-01 Gb(Abramov) 0.2053127E+00 Vb(Abramov) -0.2689836E+00 Hb(Abramov) -0.6367089E-01 Ex_ueg -0.5467992E-01 Ec_ueg -0.7929100E-02 Delta_ex -0.6008415E-01 Delta_ec 0.1467659E-01 Delta_et -0.1940492E+00 Pxc 0.6896107E+01 Qxc -0.4093876E+01 3,-1 106 3 -1 1.802896 2.782598 0.576125 Rho 0.1415137E+00 |GRAD(Rho)| 0.4631093E-15 GRAD(Rho)x -0.3332160E-15 GRAD(Rho)y 0.4302927E-17 GRAD(Rho)z 0.3215879E-15 Laplacian 0.5974108E+00 (-1/4)Del**2(Rho)) -0.1493527E+00 Diamond 0.1132191E+01 Metallicity 0.4432724E+01 Ellipticity 0.8977176E-02 Gb(Abramov) 0.2099084E+00 Vb(Abramov) -0.2704640E+00 Hb(Abramov) -0.6055566E-01 Ex_ueg -0.5446484E-01 Ec_ueg -0.7902499E-02 Delta_ex -0.6328378E-01 Delta_ec 0.1544081E-01 Delta_et -0.2039662E+00 Pxc 0.6892103E+01 Qxc -0.4098475E+01 3,-1 107 3 -1 1.684983 1.689145 -0.496973 Rho 0.3931983E-01 |GRAD(Rho)| 0.1857594E-13 GRAD(Rho)x 0.1244696E-13 GRAD(Rho)y 0.1248562E-13 GRAD(Rho)z 0.5852181E-14 Laplacian 0.1567300E+00 (-1/4)Del**2(Rho)) -0.3918250E-01 Diamond 0.5640530E-01 Metallicity 0.1999004E+01 Ellipticity 0.1078973E-01 Gb(Abramov) 0.3917600E-01 Vb(Abramov) -0.3916950E-01 Hb(Abramov) 0.6504172E-05 Ex_ueg -0.9874927E-02 Ec_ueg -0.1833631E-02 Delta_ex -0.1209627E-01 Delta_ec 0.4582077E-02 Delta_et -0.4531774E-01 Pxc 0.5385448E+01 Qxc -0.2639910E+01 3,-1 108 3 -1 2.788171 -0.586253 -1.810436 Rho 0.1460056E+00 |GRAD(Rho)| 0.8721593E-16 GRAD(Rho)x -0.3033733E-16 GRAD(Rho)y 0.6635317E-16 GRAD(Rho)z 0.4778621E-16 Laplacian 0.6171246E+00 (-1/4)Del**2(Rho)) -0.1542811E+00 Diamond 0.1214078E+01 Metallicity 0.4520534E+01 Ellipticity 0.8924061E-02 Gb(Abramov) 0.2190929E+00 Vb(Abramov) -0.2839047E+00 Hb(Abramov) -0.6481180E-01 Ex_ueg -0.5678207E-01 Ec_ueg -0.8188310E-02 Delta_ex -0.6587068E-01 Delta_ec 0.1582488E-01 Delta_et -0.2099955E+00 Pxc 0.6934529E+01 Qxc -0.4162477E+01 3,-1 109 3 -1 2.973225 -0.837746 1.975744 Rho 0.1454856E+00 |GRAD(Rho)| 0.8762619E-16 GRAD(Rho)x -0.5873665E-16 GRAD(Rho)y 0.6268044E-16 GRAD(Rho)z 0.1730658E-16 Laplacian 0.5822774E+00 (-1/4)Del**2(Rho)) -0.1455694E+00 Diamond 0.1142632E+01 Metallicity 0.4762665E+01 Ellipticity 0.2871267E-01 Gb(Abramov) 0.2125959E+00 Vb(Abramov) -0.2796225E+00 Hb(Abramov) -0.6702657E-01 Ex_ueg -0.5651259E-01 Ec_ueg -0.8155159E-02 Delta_ex -0.6211776E-01 Delta_ec 0.1498159E-01 Delta_et -0.1987840E+00 Pxc 0.6929674E+01 Qxc -0.4146273E+01 3,-1 110 3 -1 2.780948 0.580691 1.813054 Rho 0.1433056E+00 |GRAD(Rho)| 0.5070279E-14 GRAD(Rho)x -0.6405128E-15 GRAD(Rho)y -0.3097213E-14 GRAD(Rho)z 0.3962922E-14 Laplacian 0.6060029E+00 (-1/4)Del**2(Rho)) -0.1515007E+00 Diamond 0.1165249E+01 Metallicity 0.4462488E+01 Ellipticity 0.8329131E-02 Gb(Abramov) 0.2136788E+00 Vb(Abramov) -0.2758569E+00 Hb(Abramov) -0.6217811E-01 Ex_ueg -0.5538633E-01 Ec_ueg -0.8016362E-02 Delta_ex -0.6438367E-01 Delta_ec 0.1560127E-01 Delta_et -0.2064431E+00 Pxc 0.6909160E+01 Qxc -0.4126822E+01 3,-1 111 3 +1 2.107324 1.185982 -1.182419 Rho 0.2573115E-01 |GRAD(Rho)| 0.1214129E-10 GRAD(Rho)x -0.3723048E-11 GRAD(Rho)y 0.7109161E-11 GRAD(Rho)z 0.9110965E-11 Laplacian 0.1048483E+00 (-1/4)Del**2(Rho)) -0.2621208E-01 Diamond 0.1592130E-01 Metallicity 0.1473953E+01 Ellipticity -0.8394647E+01 Gb(Abramov) 0.2391395E-01 Vb(Abramov) -0.2161582E-01 Hb(Abramov) 0.2298129E-02 Ex_ueg -0.5610445E-02 Ec_ueg -0.1125597E-02 Delta_ex -0.6744212E-02 Delta_ec 0.2087656E-02 Delta_et -0.1849306E-01 Pxc 0.4984420E+01 Qxc -0.3230518E+01 3,+1 112 3 +1 -2.102189 0.995591 1.350314 Rho 0.2646675E-01 |GRAD(Rho)| 0.3388821E-12 GRAD(Rho)x -0.8600086E-13 GRAD(Rho)y 0.2554152E-12 GRAD(Rho)z -0.2054459E-12 Laplacian 0.1041977E+00 (-1/4)Del**2(Rho)) -0.2604943E-01 Diamond 0.1357275E-01 Metallicity 0.1554495E+01 Ellipticity -0.2744750E+01 Gb(Abramov) 0.2411524E-01 Vb(Abramov) -0.2218105E-01 Hb(Abramov) 0.1934193E-02 Ex_ueg -0.5825312E-02 Ec_ueg -0.1162843E-02 Delta_ex -0.6462580E-02 Delta_ec 0.1558230E-02 Delta_et -0.1398701E-01 Pxc 0.5009545E+01 Qxc -0.4147386E+01 3,+1 113 3 -1 -1.784649 2.744899 -0.568560 Rho 0.1605956E+00 |GRAD(Rho)| 0.2175850E-12 GRAD(Rho)x -0.1564202E-12 GRAD(Rho)y -0.4741257E-13 GRAD(Rho)z 0.1436246E-12 Laplacian 0.6766397E+00 (-1/4)Del**2(Rho)) -0.1691599E+00 Diamond 0.1476911E+01 Metallicity 0.4832203E+01 Ellipticity 0.1619324E-01 Gb(Abramov) 0.2490091E+00 Vb(Abramov) -0.3288583E+00 Hb(Abramov) -0.7984920E-01 Ex_ueg -0.6447084E-01 Ec_ueg -0.9125200E-02 Delta_ex -0.7379573E-01 Delta_ec 0.1669059E-01 Delta_et -0.2237401E+00 Pxc 0.7065142E+01 Qxc -0.4421397E+01 3,-1 114 3 -1 -2.962433 -0.848327 -1.987237 Rho 0.1472946E+00 |GRAD(Rho)| 0.1743564E-15 GRAD(Rho)x 0.1295893E-15 GRAD(Rho)y 0.2915149E-16 GRAD(Rho)z -0.1129468E-15 Laplacian 0.5884196E+00 (-1/4)Del**2(Rho)) -0.1471049E+00 Diamond 0.1169763E+01 Metallicity 0.4811022E+01 Ellipticity 0.3294343E-01 Gb(Abramov) 0.2160241E+00 Vb(Abramov) -0.2849433E+00 Hb(Abramov) -0.6891919E-01 Ex_ueg -0.5745142E-01 Ec_ueg -0.8270554E-02 Delta_ex -0.6294077E-01 Delta_ec 0.1505380E-01 Delta_et -0.2000108E+00 Pxc 0.6946502E+01 Qxc -0.4181056E+01 3,-1 115 3 -1 -2.782852 -0.583206 1.816163 Rho 0.1448239E+00 |GRAD(Rho)| 0.5031495E-15 GRAD(Rho)x 0.1659642E-15 GRAD(Rho)y 0.2856873E-15 GRAD(Rho)z 0.3794708E-15 Laplacian 0.6115359E+00 (-1/4)Del**2(Rho)) -0.1528840E+00 Diamond 0.1189249E+01 Metallicity 0.4500475E+01 Ellipticity 0.8581228E-02 Gb(Abramov) 0.2165977E+00 Vb(Abramov) -0.2803115E+00 Hb(Abramov) -0.6371376E-01 Ex_ueg -0.5617013E-01 Ec_ueg -0.8112998E-02 Delta_ex -0.6512211E-01 Delta_ec 0.1567289E-01 Delta_et -0.2076458E+00 Pxc 0.6923474E+01 Qxc -0.4155080E+01 3,-1 116 3 -1 -3.186390 0.047481 -3.209415 Rho 0.2573278E+00 |GRAD(Rho)| 0.1203034E-14 GRAD(Rho)x 0.5113097E-15 GRAD(Rho)y -0.3137681E-15 GRAD(Rho)z 0.1042786E-14 Laplacian 0.9256868E+00 (-1/4)Del**2(Rho)) -0.2314217E+00 Diamond 0.3552874E+01 Metallicity 0.7749857E+01 Ellipticity 0.2969226E-02 Gb(Abramov) 0.4531953E+00 Vb(Abramov) -0.6749689E+00 Hb(Abramov) -0.2217736E+00 Ex_ueg -0.1208836E+00 Ec_ueg -0.1564515E-01 Delta_ex -0.1138678E+00 Delta_ec 0.1995725E-01 Delta_et -0.2765930E+00 Pxc 0.7726585E+01 Qxc -0.5705585E+01 3,-1 117 3 -1 -3.205210 -0.063212 3.204443 Rho 0.2576810E+00 |GRAD(Rho)| 0.1828408E-10 GRAD(Rho)x -0.1291230E-10 GRAD(Rho)y -0.2814357E-11 GRAD(Rho)z 0.1263564E-10 Laplacian 0.9194303E+00 (-1/4)Del**2(Rho)) -0.2298576E+00 Diamond 0.3543433E+01 Metallicity 0.7820450E+01 Ellipticity 0.1507497E-02 Gb(Abramov) 0.4528367E+00 Vb(Abramov) -0.6758158E+00 Hb(Abramov) -0.2229791E+00 Ex_ueg -0.1211049E+00 Ec_ueg -0.1566991E-01 Delta_ex -0.1131814E+00 Delta_ec 0.1988952E-01 Delta_et -0.2760251E+00 Pxc 0.7728500E+01 Qxc -0.5690503E+01 3,-1 118 3 -1 -2.757686 0.558962 -1.811206 Rho 0.1235867E+00 |GRAD(Rho)| 0.2816689E-12 GRAD(Rho)x 0.6498569E-13 GRAD(Rho)y -0.1671420E-12 GRAD(Rho)z -0.2172045E-12 Laplacian 0.5160849E+00 (-1/4)Del**2(Rho)) -0.1290212E+00 Diamond 0.8393397E+00 Metallicity 0.4094284E+01 Ellipticity 0.1426389E-01 Gb(Abramov) 0.1740557E+00 Vb(Abramov) -0.2190903E+00 Hb(Abramov) -0.4503452E-01 Ex_ueg -0.4546535E-01 Ec_ueg -0.6774799E-02 Delta_ex -0.5301543E-01 Delta_ec 0.1396698E-01 Delta_et -0.1808538E+00 Pxc 0.6710951E+01 Qxc -0.3795768E+01 3,-1 119 3 -1 -1.958205 2.935148 0.826941 Rho 0.1581764E+00 |GRAD(Rho)| 0.2605828E-15 GRAD(Rho)x -0.4193152E-16 GRAD(Rho)y 0.1641347E-15 GRAD(Rho)z -0.1980024E-15 Laplacian 0.6266348E+00 (-1/4)Del**2(Rho)) -0.1566587E+00 Diamond 0.1346667E+01 Metallicity 0.5087466E+01 Ellipticity 0.2428733E-01 Gb(Abramov) 0.2372718E+00 Vb(Abramov) -0.3178848E+00 Hb(Abramov) -0.8061306E-01 Ex_ueg -0.6317918E-01 Ec_ueg -0.8968960E-02 Delta_ex -0.6811849E-01 Delta_ec 0.1557673E-01 Delta_et -0.2085621E+00 Pxc 0.7044204E+01 Qxc -0.4373093E+01 3,-1 120 3 +1 -1.742494 1.741478 -1.752813 Rho 0.1276089E-01 |GRAD(Rho)| 0.3840290E-16 GRAD(Rho)x -0.2145429E-17 GRAD(Rho)y 0.2674763E-16 GRAD(Rho)z 0.2747260E-16 Laplacian 0.6493140E-01 (-1/4)Del**2(Rho)) -0.1623285E-01 Diamond 0.2822028E-02 Metallicity 0.7395374E+00 Ellipticity -0.1257973E+01 Gb(Abramov) 0.1282270E-01 Vb(Abramov) -0.9412550E-02 Hb(Abramov) 0.3410150E-02 Ex_ueg -0.2202384E-02 Ec_ueg -0.4948074E-03 Delta_ex -0.3241635E-02 Delta_ec 0.8386386E-03 Delta_et -0.6386470E-02 Pxc 0.4450993E+01 Qxc -0.3865354E+01 3,+1 121 3 +3 -1.828040 1.824061 1.846924 Rho 0.1269253E-01 |GRAD(Rho)| 0.1020269E-16 GRAD(Rho)x -0.2876789E-17 GRAD(Rho)y -0.9006250E-17 GRAD(Rho)z 0.3834902E-17 Laplacian 0.5989499E-01 (-1/4)Del**2(Rho)) -0.1497375E-01 Diamond 0.1445034E-02 Metallicity 0.7945775E+00 Ellipticity -0.6983427E+00 Gb(Abramov) 0.1196546E-01 Vb(Abramov) -0.8957183E-02 Hb(Abramov) 0.3008282E-02 Ex_ueg -0.2186667E-02 Ec_ueg -0.4916322E-03 Delta_ex -0.2680526E-02 Delta_ec 0.2282995E-03 Delta_et -0.2144422E-02 Pxc 0.4447770E+01 Qxc -0.1174127E+02 3,+3 122 3 -1 -0.832987 1.972334 2.970995 Rho 0.1443663E+00 |GRAD(Rho)| 0.5582344E-15 GRAD(Rho)x 0.4330303E-15 GRAD(Rho)y 0.4538741E-16 GRAD(Rho)z -0.3493570E-15 Laplacian 0.5776692E+00 (-1/4)Del**2(Rho)) -0.1444173E+00 Diamond 0.1121031E+01 Metallicity 0.4739256E+01 Ellipticity 0.2802056E-01 Gb(Abramov) 0.2103500E+00 Vb(Abramov) -0.2762826E+00 Hb(Abramov) -0.6593266E-01 Ex_ueg -0.5593359E-01 Ec_ueg -0.8083855E-02 Delta_ex -0.6148804E-01 Delta_ec 0.1485209E-01 Delta_et -0.1967582E+00 Pxc 0.6919173E+01 Qxc -0.4140026E+01 3,-1 123 3 +3 1.110709 -1.113074 -1.103884 Rho 0.4985942E-02 |GRAD(Rho)| 0.6820376E-12 GRAD(Rho)x -0.6816003E-12 GRAD(Rho)y 0.1635794E-13 GRAD(Rho)z 0.1813118E-13 Laplacian 0.2040550E-01 (-1/4)Del**2(Rho)) -0.5101376E-02 Diamond 0.1510361E-03 Metallicity 0.4914106E+00 Ellipticity -0.1146661E-01 Gb(Abramov) 0.3818729E-02 Vb(Abramov) -0.2536082E-02 Hb(Abramov) 0.1282647E-02 Ex_ueg -0.6290927E-03 Ec_ueg -0.1463079E-03 Delta_ex -0.7129140E-03 Delta_ec 0.1050084E-03 Delta_et -0.7871995E-03 Pxc 0.4299787E+01 Qxc -0.6789111E+01 3,+3 124 3 -1 0.588652 1.813227 2.797597 Rho 0.1508595E+00 |GRAD(Rho)| 0.5047958E-14 GRAD(Rho)x -0.3118436E-14 GRAD(Rho)y 0.3905703E-14 GRAD(Rho)z -0.7090276E-15 Laplacian 0.6362811E+00 (-1/4)Del**2(Rho)) -0.1590703E+00 Diamond 0.1300165E+01 Metallicity 0.4630047E+01 Ellipticity 0.1008782E-01 Gb(Abramov) 0.2287973E+00 Vb(Abramov) -0.2985244E+00 Hb(Abramov) -0.6972705E-01 Ex_ueg -0.5931284E-01 Ec_ueg -0.8498559E-02 Delta_ex -0.6844507E-01 Delta_ec 0.1615386E-01 Delta_et -0.2152865E+00 Pxc 0.6979164E+01 Qxc -0.4237073E+01 3,-1 125 3 -1 -0.367229 -0.360453 -0.381722 Rho 0.2039359E+00 |GRAD(Rho)| 0.3229732E-15 GRAD(Rho)x 0.1928618E-15 GRAD(Rho)y 0.2438200E-15 GRAD(Rho)z 0.8756619E-16 Laplacian 0.7427176E+00 (-1/4)Del**2(Rho)) -0.1856794E+00 Diamond 0.2421892E+01 Metallicity 0.6555599E+01 Ellipticity 0.1282343E-02 Gb(Abramov) 0.3266595E+00 Vb(Abramov) -0.4676396E+00 Hb(Abramov) -0.1409801E+00 Ex_ueg -0.8865639E-01 Ec_ueg -0.1198184E-01 Delta_ex -0.8776866E-01 Delta_ec 0.2028726E-01 Delta_et -0.2895875E+00 Pxc 0.7399229E+01 Qxc -0.4326294E+01 3,-1 126 3 +1 1.205799 -2.095908 1.144731 Rho 0.2464938E-01 |GRAD(Rho)| 0.3419579E-16 GRAD(Rho)x 0.1697443E-16 GRAD(Rho)y -0.2793980E-16 GRAD(Rho)z 0.1002938E-16 Laplacian 0.9899531E-01 (-1/4)Del**2(Rho)) -0.2474883E-01 Diamond 0.1397880E-01 Metallicity 0.1453255E+01 Ellipticity -0.6658940E+01 Gb(Abramov) 0.2249361E-01 Vb(Abramov) -0.2023840E-01 Hb(Abramov) 0.2255215E-02 Ex_ueg -0.5298177E-02 Ec_ueg -0.1071077E-02 Delta_ex -0.6275524E-02 Delta_ec 0.1932912E-02 Delta_et -0.1694208E-01 Pxc 0.4946587E+01 Qxc -0.3246668E+01 3,+1 127 3 -1 0.838659 -2.970840 1.976136 Rho 0.1449148E+00 |GRAD(Rho)| 0.1342833E-14 GRAD(Rho)x -0.1032418E-14 GRAD(Rho)y 0.2990501E-15 GRAD(Rho)z 0.8049117E-15 Laplacian 0.5799840E+00 (-1/4)Del**2(Rho)) -0.1449960E+00 Diamond 0.1132794E+01 Metallicity 0.4750270E+01 Ellipticity 0.2816025E-01 Gb(Abramov) 0.2114590E+00 Vb(Abramov) -0.2779220E+00 Hb(Abramov) -0.6646302E-01 Ex_ueg -0.5621713E-01 Ec_ueg -0.8118785E-02 Delta_ex -0.6181393E-01 Delta_ec 0.1493745E-01 Delta_et -0.1980855E+00 Pxc 0.6924327E+01 Qxc -0.4138185E+01 3,-1 128 3 +1 1.990559 -1.988584 1.992926 Rho 0.1268186E-01 |GRAD(Rho)| 0.2624944E-16 GRAD(Rho)x -0.2309481E-16 GRAD(Rho)y 0.1084455E-16 GRAD(Rho)z -0.6169174E-17 Laplacian 0.6021901E-01 (-1/4)Del**2(Rho)) -0.1505475E-01 Diamond 0.2176189E-02 Metallicity 0.7891949E+00 Ellipticity -0.1162735E+01 Gb(Abramov) 0.1201669E-01 Vb(Abramov) -0.8978628E-02 Hb(Abramov) 0.3038062E-02 Ex_ueg -0.2184215E-02 Ec_ueg -0.4911367E-03 Delta_ex -0.2888997E-02 Delta_ec 0.5770454E-03 Delta_et -0.4538051E-02 Pxc 0.4447266E+01 Qxc -0.5006533E+01 3,+1 129 3 +3 1.818143 -1.816318 1.818962 Rho 0.1232835E-01 |GRAD(Rho)| 0.2708231E-16 GRAD(Rho)x -0.1756571E-16 GRAD(Rho)y 0.1959562E-16 GRAD(Rho)z -0.6396040E-17 Laplacian 0.5642259E-01 (-1/4)Del**2(Rho)) -0.1410565E-01 Diamond 0.1231873E-02 Metallicity 0.8035289E+00 Ellipticity -0.6618983E+00 Gb(Abramov) 0.1129281E-01 Vb(Abramov) -0.8479981E-02 Hb(Abramov) 0.2812833E-02 Ex_ueg -0.2103414E-02 Ec_ueg -0.4747478E-03 Delta_ex -0.2482643E-02 Delta_ec 0.1777872E-03 Delta_et -0.1761880E-02 Pxc 0.4430593E+01 Qxc -0.1396413E+02 3,+3 130 3 -1 0.835247 -1.972047 2.970744 Rho 0.1439096E+00 |GRAD(Rho)| 0.6057806E-14 GRAD(Rho)x 0.5960903E-14 GRAD(Rho)y -0.1022403E-14 GRAD(Rho)z -0.3454539E-15 Laplacian 0.5749546E+00 (-1/4)Del**2(Rho)) -0.1437387E+00 Diamond 0.1112994E+01 Metallicity 0.4736557E+01 Ellipticity 0.2782270E-01 Gb(Abramov) 0.2092968E+00 Vb(Abramov) -0.2748550E+00 Hb(Abramov) -0.6555817E-01 Ex_ueg -0.5569783E-01 Ec_ueg -0.8054791E-02 Delta_ex -0.6116721E-01 Delta_ec 0.1482139E-01 Delta_et -0.1963199E+00 Pxc 0.6914870E+01 Qxc -0.4126955E+01 3,-1 131 3 -1 1.973982 -0.834464 2.970765 Rho 0.1443530E+00 |GRAD(Rho)| 0.5905199E-15 GRAD(Rho)x 0.4610570E-15 GRAD(Rho)y -0.2710641E-15 GRAD(Rho)z -0.2503287E-15 Laplacian 0.5768808E+00 (-1/4)Del**2(Rho)) -0.1442202E+00 Diamond 0.1120625E+01 Metallicity 0.4745007E+01 Ellipticity 0.2836882E-01 Gb(Abramov) 0.2102011E+00 Vb(Abramov) -0.2761820E+00 Hb(Abramov) -0.6598090E-01 Ex_ueg -0.5592674E-01 Ec_ueg -0.8083011E-02 Delta_ex -0.6141582E-01 Delta_ec 0.1485550E-01 Delta_et -0.1968515E+00 Pxc 0.6919048E+01 Qxc -0.4134213E+01 3,-1 132 3 -1 1.814257 -0.583425 -2.783143 Rho 0.1426552E+00 |GRAD(Rho)| 0.1180767E-13 GRAD(Rho)x 0.8765382E-14 GRAD(Rho)y 0.7690043E-14 GRAD(Rho)z 0.1858058E-14 Laplacian 0.6019017E+00 (-1/4)Del**2(Rho)) -0.1504754E+00 Diamond 0.1150354E+01 Metallicity 0.4458960E+01 Ellipticity 0.8543531E-02 Gb(Abramov) 0.2121443E+00 Vb(Abramov) -0.2738131E+00 Hb(Abramov) -0.6166885E-01 Ex_ueg -0.5505142E-01 Ec_ueg -0.7975012E-02 Delta_ex -0.6386949E-01 Delta_ec 0.1549957E-01 Delta_et -0.2049307E+00 Pxc 0.6902990E+01 Qxc -0.4120727E+01 3,-1 133 3 -1 1.680212 -0.478826 1.689399 Rho 0.3853687E-01 |GRAD(Rho)| 0.1694373E-15 GRAD(Rho)x 0.1130281E-15 GRAD(Rho)y 0.6355129E-16 GRAD(Rho)z 0.1090638E-15 Laplacian 0.1532777E+00 (-1/4)Del**2(Rho)) -0.3831943E-01 Diamond 0.5374676E-01 Metallicity 0.1976643E+01 Ellipticity 0.1194440E-01 Gb(Abramov) 0.3817026E-01 Vb(Abramov) -0.3802108E-01 Hb(Abramov) 0.1491741E-03 Ex_ueg -0.9613620E-02 Ec_ueg -0.1791796E-02 Delta_ex -0.1177532E-01 Delta_ec 0.4489627E-02 Delta_et -0.4416435E-01 Pxc 0.5365354E+01 Qxc -0.2622784E+01 3,-1 134 3 -1 1.680871 -1.680402 0.493416 Rho 0.3668689E-01 |GRAD(Rho)| 0.1714627E-13 GRAD(Rho)x 0.1212719E-13 GRAD(Rho)y -0.1212125E-13 GRAD(Rho)z -0.3626757E-16 Laplacian 0.1441615E+00 (-1/4)Del**2(Rho)) -0.3604038E-01 Diamond 0.4693738E-01 Metallicity 0.1936193E+01 Ellipticity 0.1055745E-01 Gb(Abramov) 0.3565711E-01 Vb(Abramov) -0.3527384E-01 Hb(Abramov) 0.3832733E-03 Ex_ueg -0.9003255E-02 Ec_ueg -0.1693409E-02 Delta_ex -0.1091873E-01 Delta_ec 0.4184243E-02 Delta_et -0.4061382E-01 Pxc 0.5316644E+01 Qxc -0.2609487E+01 3,-1 135 3 +1 -1.187677 -2.108508 -1.180726 Rho 0.2570494E-01 |GRAD(Rho)| 0.1046737E-15 GRAD(Rho)x -0.1277765E-16 GRAD(Rho)y -0.9625964E-16 GRAD(Rho)z -0.3908202E-16 Laplacian 0.1047586E+00 (-1/4)Del**2(Rho)) -0.2618965E-01 Diamond 0.1590499E-01 Metallicity 0.1472712E+01 Ellipticity -0.8522052E+01 Gb(Abramov) 0.2388807E-01 Vb(Abramov) -0.2158649E-01 Hb(Abramov) 0.2301580E-02 Ex_ueg -0.5602828E-02 Ec_ueg -0.1124272E-02 Delta_ex -0.6738697E-02 Delta_ec 0.2089523E-02 Delta_et -0.1850410E-01 Pxc 0.4983516E+01 Qxc -0.3224994E+01 3,+1 136 3 -1 -3.192081 3.185392 -0.095176 Rho 0.1791103E+00 |GRAD(Rho)| 0.7753615E-15 GRAD(Rho)x 0.1729302E-15 GRAD(Rho)y -0.7495903E-15 GRAD(Rho)z -0.9692767E-16 Laplacian 0.6917968E+00 (-1/4)Del**2(Rho)) -0.1729492E+00 Diamond 0.1763291E+01 Metallicity 0.5668945E+01 Ellipticity 0.1140562E+00 Gb(Abramov) 0.2787061E+00 Vb(Abramov) -0.3844629E+00 Hb(Abramov) -0.1057569E+00 Ex_ueg -0.7456686E-01 Ec_ueg -0.1033236E-01 Delta_ex -0.7786714E-01 Delta_ec 0.1717601E-01 Delta_et -0.2348793E+00 Pxc 0.7216825E+01 Qxc -0.4533483E+01 3,-1 137 3 -1 -2.940569 1.951973 0.828942 Rho 0.1554523E+00 |GRAD(Rho)| 0.2470904E-15 GRAD(Rho)x 0.9946200E-16 GRAD(Rho)y 0.1943432E-16 GRAD(Rho)z -0.2253514E-15 Laplacian 0.6138758E+00 (-1/4)Del**2(Rho)) -0.1534690E+00 Diamond 0.1293608E+01 Metallicity 0.5045002E+01 Ellipticity 0.2577119E-01 Gb(Abramov) 0.2313545E+00 Vb(Abramov) -0.3092401E+00 Hb(Abramov) -0.7788555E-01 Ex_ueg -0.6173262E-01 Ec_ueg -0.8793450E-02 Delta_ex -0.6646029E-01 Delta_ec 0.1535380E-01 Delta_et -0.2051818E+00 Pxc 0.7020295E+01 Qxc -0.4328588E+01 3,-1 138 3 -1 -1.800436 0.560986 -2.787787 Rho 0.1441620E+00 |GRAD(Rho)| 0.2175764E-14 GRAD(Rho)x -0.1492730E-14 GRAD(Rho)y -0.1544487E-14 GRAD(Rho)z 0.3467956E-15 Laplacian 0.6108477E+00 (-1/4)Del**2(Rho)) -0.1527119E+00 Diamond 0.1182956E+01 Metallicity 0.4471276E+01 Ellipticity 0.9749068E-02 Gb(Abramov) 0.2156108E+00 Vb(Abramov) -0.2785097E+00 Hb(Abramov) -0.6289889E-01 Ex_ueg -0.5582809E-01 Ec_ueg -0.8070851E-02 Delta_ex -0.6499244E-01 Delta_ec 0.1570220E-01 Delta_et -0.2079590E+00 Pxc 0.6917249E+01 Qxc -0.4139065E+01 3,-1 139 3 -1 -1.700015 0.493790 1.675413 Rho 0.3703472E-01 |GRAD(Rho)| 0.2272713E-16 GRAD(Rho)x -0.1576773E-16 GRAD(Rho)y 0.4328021E-17 GRAD(Rho)z 0.1578509E-16 Laplacian 0.1456350E+00 (-1/4)Del**2(Rho)) -0.3640875E-01 Diamond 0.4803808E-01 Metallicity 0.1946985E+01 Ellipticity 0.1414445E-01 Gb(Abramov) 0.3608704E-01 Vb(Abramov) -0.3576534E-01 Hb(Abramov) 0.3217033E-03 Ex_ueg -0.9117249E-02 Ec_ueg -0.1711857E-02 Delta_ex -0.1105667E-01 Delta_ec 0.4227724E-02 Delta_et -0.4114083E-01 Pxc 0.5325939E+01 Qxc -0.2615277E+01 3,-1 140 3 +1 -1.192783 1.179865 2.087289 Rho 0.2474054E-01 |GRAD(Rho)| 0.1411271E-15 GRAD(Rho)x -0.3078594E-16 GRAD(Rho)y 0.3955137E-16 GRAD(Rho)z 0.1319272E-15 Laplacian 0.9947175E-01 (-1/4)Del**2(Rho)) -0.2486794E-01 Diamond 0.1436385E-01 Metallicity 0.1455220E+01 Ellipticity -0.8304749E+01 Gb(Abramov) 0.2261001E-01 Vb(Abramov) -0.2035209E-01 Hb(Abramov) 0.2257924E-02 Ex_ueg -0.5324318E-02 Ec_ueg -0.1075660E-02 Delta_ex -0.6338941E-02 Delta_ec 0.1990669E-02 Delta_et -0.1745477E-01 Pxc 0.4949816E+01 Qxc -0.3184327E+01 3,+1 141 3 -1 -1.975775 0.831464 2.970661 Rho 0.1437782E+00 |GRAD(Rho)| 0.7331796E-14 GRAD(Rho)x -0.4712742E-14 GRAD(Rho)y -0.5009366E-14 GRAD(Rho)z -0.2539988E-14 Laplacian 0.5750590E+00 (-1/4)Del**2(Rho)) -0.1437647E+00 Diamond 0.1111010E+01 Metallicity 0.4728488E+01 Ellipticity 0.2683596E-01 Gb(Abramov) 0.2091415E+00 Vb(Abramov) -0.2745182E+00 Hb(Abramov) -0.6537673E-01 Ex_ueg -0.5562999E-01 Ec_ueg -0.8046424E-02 Delta_ex -0.6115449E-01 Delta_ec 0.1480924E-01 Delta_et -0.1960934E+00 Pxc 0.6913629E+01 Qxc -0.4129482E+01 3,-1 142 3 -1 -1.683047 1.681306 0.466552 Rho 0.4930097E-01 |GRAD(Rho)| 0.1538972E-15 GRAD(Rho)x -0.9155452E-16 GRAD(Rho)y 0.1212214E-15 GRAD(Rho)z -0.2464718E-16 Laplacian 0.1985392E+00 (-1/4)Del**2(Rho)) -0.4963479E-01 Diamond 0.9567735E-01 Metallicity 0.2300697E+01 Ellipticity 0.8100666E-02 Gb(Abramov) 0.5212230E-01 Vb(Abramov) -0.5460981E-01 Hb(Abramov) -0.2487506E-02 Ex_ueg -0.1335137E-01 Ec_ueg -0.2376271E-02 Delta_ex -0.1615008E-01 Delta_ec 0.5676403E-02 Delta_et -0.5957127E-01 Pxc 0.5618621E+01 Qxc -0.2845126E+01 3,-1 143 3 -1 -0.376577 0.375482 0.333278 Rho 0.1991100E+00 |GRAD(Rho)| 0.6788536E-13 GRAD(Rho)x 0.3353914E-13 GRAD(Rho)y -0.4421460E-13 GRAD(Rho)z -0.3909753E-13 Laplacian 0.6900010E+00 (-1/4)Del**2(Rho)) -0.1725003E+00 Diamond 0.2197350E+01 Metallicity 0.6780348E+01 Ellipticity 0.1145177E-01 Gb(Abramov) 0.3099355E+00 Vb(Abramov) -0.4473707E+00 Hb(Abramov) -0.1374352E+00 Ex_ueg -0.8587022E-01 Ec_ueg -0.1165848E-01 Delta_ex -0.8113241E-01 Delta_ec 0.1909857E-01 Delta_et -0.2721792E+00 Pxc 0.7365473E+01 Qxc -0.4248087E+01 3,-1 144 3 -1 0.352320 -0.352524 0.354223 Rho 0.2051964E+00 |GRAD(Rho)| 0.2422855E-11 GRAD(Rho)x -0.1371724E-11 GRAD(Rho)y 0.1368111E-11 GRAD(Rho)z -0.1454947E-11 Laplacian 0.7522430E+00 (-1/4)Del**2(Rho)) -0.1880608E+00 Diamond 0.2465221E+01 Metallicity 0.6539401E+01 Ellipticity 0.2338601E-02 Gb(Abramov) 0.3303413E+00 Vb(Abramov) -0.4726218E+00 Hb(Abramov) -0.1422805E+00 Ex_ueg -0.8938777E-01 Ec_ueg -0.1206652E-01 Delta_ex -0.8899146E-01 Delta_ec 0.2044533E-01 Delta_et -0.2918583E+00 Pxc 0.7407919E+01 Qxc -0.4352654E+01 3,-1 145 3 -1 0.855932 1.967231 -2.993810 Rho 0.1528998E+00 |GRAD(Rho)| 0.2282008E-15 GRAD(Rho)x 0.2900241E-17 GRAD(Rho)y -0.7708677E-16 GRAD(Rho)z -0.2147669E-15 Laplacian 0.6066668E+00 (-1/4)Del**2(Rho)) -0.1516667E+00 Diamond 0.1262866E+01 Metallicity 0.4966010E+01 Ellipticity 0.3691913E-01 Gb(Abramov) 0.2266409E+00 Vb(Abramov) -0.3016150E+00 Hb(Abramov) -0.7497416E-01 Ex_ueg -0.6038477E-01 Ec_ueg -0.8629398E-02 Delta_ex -0.6550519E-01 Delta_ec 0.1540346E-01 Delta_et -0.2057905E+00 Pxc 0.6997565E+01 Qxc -0.4252628E+01 3,-1 146 3 -1 0.846167 2.964981 -1.986628 Rho 0.1469868E+00 |GRAD(Rho)| 0.1389167E-15 GRAD(Rho)x 0.1354982E-15 GRAD(Rho)y -0.7291260E-17 GRAD(Rho)z 0.2974780E-16 Laplacian 0.5869741E+00 (-1/4)Del**2(Rho)) -0.1467435E+00 Diamond 0.1164421E+01 Metallicity 0.4806087E+01 Ellipticity 0.3222371E-01 Gb(Abramov) 0.2153727E+00 Vb(Abramov) -0.2840019E+00 Hb(Abramov) -0.6862917E-01 Ex_ueg -0.5729142E-01 Ec_ueg -0.8250907E-02 Delta_ex -0.6275869E-01 Delta_ec 0.1503298E-01 Delta_et -0.1996931E+00 Pxc 0.6943651E+01 Qxc -0.4174735E+01 3,-1 147 3 -1 0.579128 2.779453 1.815061 Rho 0.1450900E+00 |GRAD(Rho)| 0.4036752E-12 GRAD(Rho)x 0.2598273E-12 GRAD(Rho)y 0.9454621E-13 GRAD(Rho)z -0.2941164E-12 Laplacian 0.6127769E+00 (-1/4)Del**2(Rho)) -0.1531942E+00 Diamond 0.1193749E+01 Metallicity 0.4505124E+01 Ellipticity 0.8452567E-02 Gb(Abramov) 0.2171560E+00 Vb(Abramov) -0.2811177E+00 Hb(Abramov) -0.6396176E-01 Ex_ueg -0.5630780E-01 Ec_ueg -0.8129950E-02 Delta_ex -0.6527791E-01 Delta_ec 0.1568748E-01 Delta_et -0.2078724E+00 Pxc 0.6925970E+01 Qxc -0.4161146E+01 3,-1 148 3 -1 2.972228 0.834604 -1.977402 Rho 0.1441419E+00 |GRAD(Rho)| 0.7727072E-15 GRAD(Rho)x -0.3508207E-15 GRAD(Rho)y -0.3831299E-15 GRAD(Rho)z -0.5720251E-15 Laplacian 0.5750683E+00 (-1/4)Del**2(Rho)) -0.1437671E+00 Diamond 0.1114925E+01 Metallicity 0.4748364E+01 Ellipticity 0.2947975E-01 Gb(Abramov) 0.2096211E+00 Vb(Abramov) -0.2754752E+00 Hb(Abramov) -0.6585404E-01 Ex_ueg -0.5581770E-01 Ec_ueg -0.8069570E-02 Delta_ex -0.6119871E-01 Delta_ec 0.1481009E-01 Delta_et -0.1961987E+00 Pxc 0.6917060E+01 Qxc -0.4132231E+01 3,-1 149 3 -1 3.192488 3.201008 0.057745 Rho 0.2570544E+00 |GRAD(Rho)| 0.8946409E-14 GRAD(Rho)x 0.1168770E-15 GRAD(Rho)y 0.7702281E-14 GRAD(Rho)z -0.4549665E-14 Laplacian 0.9202191E+00 (-1/4)Del**2(Rho)) -0.2300548E+00 Diamond 0.3531109E+01 Metallicity 0.7782101E+01 Ellipticity 0.9491708E-03 Gb(Abramov) 0.4517548E+00 Vb(Abramov) -0.6734548E+00 Hb(Abramov) -0.2217000E+00 Ex_ueg -0.1207123E+00 Ec_ueg -0.1562599E-01 Delta_ex -0.1131817E+00 Delta_ec 0.1987830E-01 Delta_et -0.2756516E+00 Pxc 0.7725100E+01 Qxc -0.5693734E+01 3,-1 150 3 -1 -2.963314 0.831892 1.974136 Rho 0.1346726E+00 |GRAD(Rho)| 0.3759486E-13 GRAD(Rho)x 0.1307839E-13 GRAD(Rho)y -0.2706823E-13 GRAD(Rho)z 0.2257520E-13 Laplacian 0.5407997E+00 (-1/4)Del**2(Rho)) -0.1351999E+00 Diamond 0.9698195E+00 Metallicity 0.4508602E+01 Ellipticity 0.3632604E-01 Gb(Abramov) 0.1917271E+00 Vb(Abramov) -0.2482542E+00 Hb(Abramov) -0.5652714E-01 Ex_ueg -0.5098282E-01 Ec_ueg -0.7469680E-02 Delta_ex -0.5664934E-01 Delta_ec 0.1423149E-01 Delta_et -0.1867308E+00 Pxc 0.6825302E+01 Qxc -0.3980563E+01 3,-1 151 3 -1 -0.564838 1.800994 -2.786057 Rho 0.1431277E+00 |GRAD(Rho)| 0.5615376E-15 GRAD(Rho)x 0.4107907E-15 GRAD(Rho)y 0.3799993E-15 GRAD(Rho)z 0.4664780E-16 Laplacian 0.6061853E+00 (-1/4)Del**2(Rho)) -0.1515463E+00 Diamond 0.1164789E+01 Metallicity 0.4451920E+01 Ellipticity 0.9932113E-02 Gb(Abramov) 0.2134762E+00 Vb(Abramov) -0.2754062E+00 Hb(Abramov) -0.6192992E-01 Ex_ueg -0.5529469E-01 Ec_ueg -0.8005051E-02 Delta_ex -0.6439335E-01 Delta_ec 0.1562826E-01 Delta_et -0.2067999E+00 Pxc 0.6907475E+01 Qxc -0.4120316E+01 3,-1 152 3 -1 0.499749 1.680512 -1.704184 Rho 0.4093054E-01 |GRAD(Rho)| 0.2382827E-15 GRAD(Rho)x 0.6128717E-16 GRAD(Rho)y -0.1398905E-15 GRAD(Rho)z 0.1829022E-15 Laplacian 0.1640210E+00 (-1/4)Del**2(Rho)) -0.4100525E-01 Diamond 0.6255162E-01 Metallicity 0.2042332E+01 Ellipticity 0.1236070E-01 Gb(Abramov) 0.4129455E-01 Vb(Abramov) -0.4158385E-01 Hb(Abramov) -0.2893035E-03 Ex_ueg -0.1041794E-01 Ec_ueg -0.1920050E-02 Delta_ex -0.1279786E-01 Delta_ec 0.4815008E-02 Delta_et -0.4813971E-01 Pxc 0.5425868E+01 Qxc -0.2657911E+01 3,-1 153 3 +1 1.241894 1.121869 -2.125670 Rho 0.2544258E-01 |GRAD(Rho)| 0.8982605E-14 GRAD(Rho)x 0.5799372E-14 GRAD(Rho)y -0.1311601E-14 GRAD(Rho)z -0.6733066E-14 Laplacian 0.1018101E+00 (-1/4)Del**2(Rho)) -0.2545252E-01 Diamond 0.1458885E-01 Metallicity 0.1489674E+01 Ellipticity -0.5458108E+01 Gb(Abramov) 0.2328767E-01 Vb(Abramov) -0.2112282E-01 Hb(Abramov) 0.2164849E-02 Ex_ueg -0.5526710E-02 Ec_ueg -0.1111023E-02 Delta_ex -0.6462335E-02 Delta_ec 0.1907136E-02 Delta_et -0.1686757E-01 Pxc 0.4974432E+01 Qxc -0.3388503E+01 3,+1 154 3 -1 1.983551 0.832490 -2.980789 Rho 0.1367919E+00 |GRAD(Rho)| 0.1577968E-13 GRAD(Rho)x -0.1269934E-13 GRAD(Rho)y 0.6702118E-14 GRAD(Rho)z 0.6542686E-14 Laplacian 0.5471143E+00 (-1/4)Del**2(Rho)) -0.1367786E+00 Diamond 0.9976606E+00 Metallicity 0.4574063E+01 Ellipticity 0.2297276E-01 Gb(Abramov) 0.1954580E+00 Vb(Abramov) -0.2541375E+00 Hb(Abramov) -0.5867945E-01 Ex_ueg -0.5205535E-01 Ec_ueg -0.7603441E-02 Delta_ex -0.5750454E-01 Delta_ec 0.1430224E-01 Delta_et -0.1880396E+00 Pxc 0.6846288E+01 Qxc -0.4020666E+01 3,-1 155 3 -1 -0.056762 -3.202362 3.198921 Rho 0.2572107E+00 |GRAD(Rho)| 0.8303939E-14 GRAD(Rho)x 0.3314271E-14 GRAD(Rho)y 0.6175724E-14 GRAD(Rho)z 0.4453252E-14 Laplacian 0.9201365E+00 (-1/4)Del**2(Rho)) -0.2300341E+00 Diamond 0.3533963E+01 Metallicity 0.7790692E+01 Ellipticity 0.1137968E-02 Gb(Abramov) 0.4520436E+00 Vb(Abramov) -0.6740530E+00 Hb(Abramov) -0.2220094E+00 Ex_ueg -0.1208103E+00 Ec_ueg -0.1563695E-01 Delta_ex -0.1131925E+00 Delta_ec 0.1987787E-01 Delta_et -0.2756724E+00 Pxc 0.7725949E+01 Qxc -0.5694399E+01 3,-1 156 3 -1 0.359810 0.367397 -0.381289 Rho 0.2040327E+00 |GRAD(Rho)| 0.3770770E-15 GRAD(Rho)x -0.1146972E-15 GRAD(Rho)y -0.3261419E-15 GRAD(Rho)z 0.1505426E-15 Laplacian 0.7438359E+00 (-1/4)Del**2(Rho)) -0.1859590E+00 Diamond 0.2426863E+01 Metallicity 0.6550919E+01 Ellipticity 0.1154755E-02 Gb(Abramov) 0.3270063E+00 Vb(Abramov) -0.4680537E+00 Hb(Abramov) -0.1410474E+00 Ex_ueg -0.8871247E-01 Ec_ueg -0.1198834E-01 Delta_ex -0.8791079E-01 Delta_ec 0.2031467E-01 Delta_et -0.2899941E+00 Pxc 0.7399898E+01 Qxc -0.4327454E+01 3,-1 157 3 -1 1.691482 0.484806 -1.694618 Rho 0.3941073E-01 |GRAD(Rho)| 0.4401041E-14 GRAD(Rho)x 0.2984420E-14 GRAD(Rho)y -0.1400293E-14 GRAD(Rho)z -0.2915746E-14 Laplacian 0.1569079E+00 (-1/4)Del**2(Rho)) -0.3922698E-01 Diamond 0.5669862E-01 Metallicity 0.2004437E+01 Ellipticity 0.1310752E-01 Gb(Abramov) 0.3925599E-01 Vb(Abramov) -0.3928500E-01 Hb(Abramov) -0.2901040E-04 Ex_ueg -0.9905379E-02 Ec_ueg -0.1838496E-02 Delta_ex -0.1212001E-01 Delta_ec 0.4592668E-02 Delta_et -0.4545128E-01 Pxc 0.5387762E+01 Qxc -0.2638991E+01 3,-1 158 3 -1 1.816073 0.583800 2.791716 Rho 0.1380670E+00 |GRAD(Rho)| 0.2470993E-15 GRAD(Rho)x -0.1698945E-15 GRAD(Rho)y 0.1505957E-15 GRAD(Rho)z 0.9754431E-16 Laplacian 0.5845501E+00 (-1/4)Del**2(Rho)) -0.1461375E+00 Diamond 0.1077963E+01 Metallicity 0.4347848E+01 Ellipticity 0.8140533E-02 Gb(Abramov) 0.2033223E+00 Vb(Abramov) -0.2605071E+00 Hb(Abramov) -0.5718478E-01 Ex_ueg -0.5270333E-01 Ec_ueg -0.7684060E-02 Delta_ex -0.6157867E-01 Delta_ec 0.1524845E-01 Delta_et -0.2007726E+00 Pxc 0.6858787E+01 Qxc -0.4038356E+01 3,-1 159 3 -1 3.204124 -3.202415 -0.053081 Rho 0.2575255E+00 |GRAD(Rho)| 0.4919198E-12 GRAD(Rho)x -0.3371361E-12 GRAD(Rho)y 0.3492158E-12 GRAD(Rho)z 0.7982864E-13 Laplacian 0.9180067E+00 (-1/4)Del**2(Rho)) -0.2295017E+00 Diamond 0.3534310E+01 Metallicity 0.7824702E+01 Ellipticity 0.8422228E-03 Gb(Abramov) 0.4522982E+00 Vb(Abramov) -0.6750947E+00 Hb(Abramov) -0.2227965E+00 Ex_ueg -0.1210075E+00 Ec_ueg -0.1565901E-01 Delta_ex -0.1129830E+00 Delta_ec 0.1985320E-01 Delta_et -0.2754742E+00 Pxc 0.7727658E+01 Qxc -0.5690923E+01 3,-1 160 3 -1 -3.199960 -3.195991 0.057338 Rho 0.2570569E+00 |GRAD(Rho)| 0.2328099E-13 GRAD(Rho)x 0.2074458E-13 GRAD(Rho)y 0.1002117E-13 GRAD(Rho)z 0.3353031E-14 Laplacian 0.9199498E+00 (-1/4)Del**2(Rho)) -0.2299875E+00 Diamond 0.3530375E+01 Metallicity 0.7784508E+01 Ellipticity 0.9505828E-03 Gb(Abramov) 0.4517148E+00 Vb(Abramov) -0.6734422E+00 Hb(Abramov) -0.2217274E+00 Ex_ueg -0.1207139E+00 Ec_ueg -0.1562617E-01 Delta_ex -0.1131501E+00 Delta_ec 0.1987465E-01 Delta_et -0.2756119E+00 Pxc 0.7725114E+01 Qxc -0.5693189E+01 3,-1 161 3 -1 -0.833374 -2.974509 -1.977764 Rho 0.1443086E+00 |GRAD(Rho)| 0.1195532E-11 GRAD(Rho)x -0.8741486E-12 GRAD(Rho)y -0.4771697E-12 GRAD(Rho)z 0.6614156E-12 Laplacian 0.5757950E+00 (-1/4)Del**2(Rho)) -0.1439488E+00 Diamond 0.1117807E+01 Metallicity 0.4751515E+01 Ellipticity 0.2943123E-01 Gb(Abramov) 0.2099616E+00 Vb(Abramov) -0.2759745E+00 Hb(Abramov) -0.6601285E-01 Ex_ueg -0.5590378E-01 Ec_ueg -0.8080181E-02 Delta_ex -0.6129252E-01 Delta_ec 0.1482314E-01 Delta_et -0.1964018E+00 Pxc 0.6918630E+01 Qxc -0.4134921E+01 3,-1 162 3 -1 -0.579781 -2.781654 1.812438 Rho 0.1429975E+00 |GRAD(Rho)| 0.1046352E-15 GRAD(Rho)x 0.3148252E-16 GRAD(Rho)y -0.9534203E-16 GRAD(Rho)z -0.2944964E-16 Laplacian 0.6045597E+00 (-1/4)Del**2(Rho)) -0.1511399E+00 Diamond 0.1159540E+01 Metallicity 0.4457126E+01 Ellipticity 0.8311976E-02 Gb(Abramov) 0.2130349E+00 Vb(Abramov) -0.2749299E+00 Hb(Abramov) -0.6189497E-01 Ex_ueg -0.5522764E-01 Ec_ueg -0.7996773E-02 Delta_ex -0.6419731E-01 Delta_ec 0.1557357E-01 Delta_et -0.2060137E+00 Pxc 0.6906240E+01 Qxc -0.4122195E+01 3,-1 163 3 -1 -0.052346 3.188497 -3.207612 Rho 0.2572825E+00 |GRAD(Rho)| 0.4134290E-14 GRAD(Rho)x 0.2712836E-14 GRAD(Rho)y -0.3119358E-14 GRAD(Rho)z -0.4976488E-16 Laplacian 0.9250116E+00 (-1/4)Del**2(Rho)) -0.2312529E+00 Diamond 0.3549947E+01 Metallicity 0.7753236E+01 Ellipticity 0.2381247E-02 Gb(Abramov) 0.4529950E+00 Vb(Abramov) -0.6747371E+00 Hb(Abramov) -0.2217421E+00 Ex_ueg -0.1208552E+00 Ec_ueg -0.1564198E-01 Delta_ex -0.1137815E+00 Delta_ec 0.1994739E-01 Delta_et -0.2764731E+00 Pxc 0.7726339E+01 Qxc -0.5704080E+01 3,-1 164 3 -1 -1.965846 -0.861656 -2.997589 Rho 0.1546845E+00 |GRAD(Rho)| 0.3243972E-13 GRAD(Rho)x 0.7993186E-14 GRAD(Rho)y 0.3140690E-13 GRAD(Rho)z 0.1432163E-14 Laplacian 0.6130494E+00 (-1/4)Del**2(Rho)) -0.1532623E+00 Diamond 0.1293941E+01 Metallicity 0.5010287E+01 Ellipticity 0.3854471E-01 Gb(Abramov) 0.2301563E+00 Vb(Abramov) -0.3070502E+00 Hb(Abramov) -0.7689393E-01 Ex_ueg -0.6132642E-01 Ec_ueg -0.8744064E-02 Delta_ex -0.6638270E-01 Delta_ec 0.1551840E-01 Delta_et -0.2076489E+00 Pxc 0.7013492E+01 Qxc -0.4277678E+01 3,-1 165 3 -1 0.060057 3.202414 3.203128 Rho 0.2577290E+00 |GRAD(Rho)| 0.2863531E-14 GRAD(Rho)x -0.2124467E-14 GRAD(Rho)y -0.1834036E-14 GRAD(Rho)z 0.5681219E-15 Laplacian 0.9199786E+00 (-1/4)Del**2(Rho)) -0.2299947E+00 Diamond 0.3546104E+01 Metallicity 0.7818212E+01 Ellipticity 0.1844337E-02 Gb(Abramov) 0.4530209E+00 Vb(Abramov) -0.6760472E+00 Hb(Abramov) -0.2230263E+00 Ex_ueg -0.1211349E+00 Ec_ueg -0.1567327E-01 Delta_ex -0.1132533E+00 Delta_ec 0.1989821E-01 Delta_et -0.2761366E+00 Pxc 0.7728760E+01 Qxc -0.5691632E+01 3,-1 166 3 -1 2.973007 -1.975562 0.840673 Rho 0.1443544E+00 |GRAD(Rho)| 0.7201061E-13 GRAD(Rho)x 0.1715072E-14 GRAD(Rho)y -0.2072967E-13 GRAD(Rho)z 0.6894104E-13 Laplacian 0.5781856E+00 (-1/4)Del**2(Rho)) -0.1445464E+00 Diamond 0.1123739E+01 Metallicity 0.4734374E+01 Ellipticity 0.2724688E-01 Gb(Abramov) 0.2104204E+00 Vb(Abramov) -0.2762944E+00 Hb(Abramov) -0.6587398E-01 Ex_ueg -0.5592745E-01 Ec_ueg -0.8083099E-02 Delta_ex -0.6156081E-01 Delta_ec 0.1489967E-01 Delta_et -0.1974600E+00 Pxc 0.6919061E+01 Qxc -0.4131690E+01 3,-1 167 3 -1 2.776859 1.813802 0.579283 Rho 0.1435762E+00 |GRAD(Rho)| 0.5449356E-13 GRAD(Rho)x -0.1341256E-13 GRAD(Rho)y 0.4474787E-14 GRAD(Rho)z 0.5262725E-13 Laplacian 0.6070990E+00 (-1/4)Del**2(Rho)) -0.1517748E+00 Diamond 0.1170469E+01 Metallicity 0.4468458E+01 Ellipticity 0.9546830E-02 Gb(Abramov) 0.2142164E+00 Vb(Abramov) -0.2766580E+00 Hb(Abramov) -0.6244161E-01 Ex_ueg -0.5552582E-01 Ec_ueg -0.8033575E-02 Delta_ex -0.6453474E-01 Delta_ec 0.1563101E-01 Delta_et -0.2069130E+00 Pxc 0.6911720E+01 Qxc -0.4128635E+01 3,-1 168 3 -1 2.786026 -1.815343 -0.576637 Rho 0.1420842E+00 |GRAD(Rho)| 0.3411983E-15 GRAD(Rho)x 0.7124564E-16 GRAD(Rho)y 0.3031565E-15 GRAD(Rho)z -0.1394148E-15 Laplacian 0.6017830E+00 (-1/4)Del**2(Rho)) -0.1504457E+00 Diamond 0.1146331E+01 Metallicity 0.4430128E+01 Ellipticity 0.8916106E-02 Gb(Abramov) 0.2113795E+00 Vb(Abramov) -0.2723132E+00 Hb(Abramov) -0.6093373E-01 Ex_ueg -0.5475782E-01 Ec_ueg -0.7938730E-02 Delta_ex -0.6381299E-01 Delta_ec 0.1554483E-01 Delta_et -0.2054771E+00 Pxc 0.6897553E+01 Qxc -0.4105095E+01 3,-1 169 3 -1 -2.745839 1.783253 -0.566867 Rho 0.1638217E+00 |GRAD(Rho)| 0.5728020E-15 GRAD(Rho)x 0.1001396E-15 GRAD(Rho)y 0.7882150E-16 GRAD(Rho)z 0.5584454E-15 Laplacian 0.6931418E+00 (-1/4)Del**2(Rho)) -0.1732855E+00 Diamond 0.1548931E+01 Metallicity 0.4876146E+01 Ellipticity 0.1614317E-01 Gb(Abramov) 0.2563512E+00 Vb(Abramov) -0.3394169E+00 Hb(Abramov) -0.8306572E-01 Ex_ueg -0.6620339E-01 Ec_ueg -0.9334094E-02 Delta_ex -0.7596556E-01 Delta_ec 0.1700186E-01 Delta_et -0.2284432E+00 Pxc 0.7092643E+01 Qxc -0.4468072E+01 3,-1 170 3 -1 -1.976024 -2.968043 -0.841843 Rho 0.1431903E+00 |GRAD(Rho)| 0.2964618E-15 GRAD(Rho)x 0.6488950E-16 GRAD(Rho)y 0.5445405E-16 GRAD(Rho)z 0.2841016E-15 Laplacian 0.5712706E+00 (-1/4)Del**2(Rho)) -0.1428176E+00 Diamond 0.1099593E+01 Metallicity 0.4727454E+01 Ellipticity 0.2764088E-01 Gb(Abramov) 0.2077391E+00 Vb(Abramov) -0.2726605E+00 Hb(Abramov) -0.6492143E-01 Ex_ueg -0.5532693E-01 Ec_ueg -0.8009031E-02 Delta_ex -0.6070488E-01 Delta_ec 0.1475143E-01 Delta_et -0.1952634E+00 Pxc 0.6908068E+01 Qxc -0.4115185E+01 3,-1 171 3 -1 -1.812367 -2.779982 0.579227 Rho 0.1438516E+00 |GRAD(Rho)| 0.4288982E-13 GRAD(Rho)x -0.3210718E-13 GRAD(Rho)y 0.6396651E-14 GRAD(Rho)z -0.2770826E-13 Laplacian 0.6078380E+00 (-1/4)Del**2(Rho)) -0.1519595E+00 Diamond 0.1174451E+01 Metallicity 0.4477302E+01 Ellipticity 0.9661479E-02 Gb(Abramov) 0.2147011E+00 Vb(Abramov) -0.2774427E+00 Hb(Abramov) -0.6274161E-01 Ex_ueg -0.5566787E-01 Ec_ueg -0.8051097E-02 Delta_ex -0.6464203E-01 Delta_ec 0.1564000E-01 Delta_et -0.2070847E+00 Pxc 0.6914322E+01 Qxc -0.4133121E+01 3,-1 172 3 -1 -0.831445 -1.987958 -2.981672 Rho 0.1353381E+00 |GRAD(Rho)| 0.2884126E-15 GRAD(Rho)x -0.6883329E-16 GRAD(Rho)y 0.2212043E-15 GRAD(Rho)z 0.1717918E-15 Laplacian 0.5415872E+00 (-1/4)Del**2(Rho)) -0.1353968E+00 Diamond 0.9750910E+00 Metallicity 0.4539186E+01 Ellipticity 0.2181667E-01 Gb(Abramov) 0.1926964E+00 Vb(Abramov) -0.2499960E+00 Hb(Abramov) -0.5729961E-01 Ex_ueg -0.5131901E-01 Ec_ueg -0.7511652E-02 Delta_ex -0.5677768E-01 Delta_ec 0.1419640E-01 Delta_et -0.1863397E+00 Pxc 0.6831921E+01 Qxc -0.3999443E+01 3,-1 173 3 -1 -0.583225 -1.814464 2.790054 Rho 0.1393048E+00 |GRAD(Rho)| 0.1660938E-12 GRAD(Rho)x 0.1086665E-12 GRAD(Rho)y -0.1228643E-12 GRAD(Rho)z -0.2613675E-13 Laplacian 0.5897948E+00 (-1/4)Del**2(Rho)) -0.1474487E+00 Diamond 0.1098896E+01 Metallicity 0.4373767E+01 Ellipticity 0.7941405E-02 Gb(Abramov) 0.2057835E+00 Vb(Abramov) -0.2641183E+00 Hb(Abramov) -0.5833480E-01 Ex_ueg -0.5333428E-01 Ec_ueg -0.7762422E-02 Delta_ex -0.6226089E-01 Delta_ec 0.1534294E-01 Delta_et -0.2022756E+00 Pxc 0.6870830E+01 Qxc -0.4057951E+01 3,-1 174 3 -1 -0.483054 -1.694013 -1.694704 Rho 0.3930010E-01 |GRAD(Rho)| 0.4201796E-16 GRAD(Rho)x -0.5870044E-17 GRAD(Rho)y 0.1254181E-16 GRAD(Rho)z 0.3967058E-16 Laplacian 0.1563440E+00 (-1/4)Del**2(Rho)) -0.3908599E-01 Diamond 0.5627386E-01 Metallicity 0.2002265E+01 Ellipticity 0.1443615E-01 Gb(Abramov) 0.3910074E-01 Vb(Abramov) -0.3911550E-01 Hb(Abramov) -0.1475524E-04 Ex_ueg -0.9868322E-02 Ec_ueg -0.1832576E-02 Delta_ex -0.1206769E-01 Delta_ec 0.4575673E-02 Delta_et -0.4524882E-01 Pxc 0.5384946E+01 Qxc -0.2637359E+01 3,-1 175 3 -1 2.966263 1.976370 -0.841665 Rho 0.1433945E+00 |GRAD(Rho)| 0.3715327E-15 GRAD(Rho)x -0.1619527E-16 GRAD(Rho)y -0.3199752E-15 GRAD(Rho)z -0.1881226E-15 Laplacian 0.5716967E+00 (-1/4)Del**2(Rho)) -0.1429242E+00 Diamond 0.1102306E+01 Metallicity 0.4735162E+01 Ellipticity 0.2790900E-01 Gb(Abramov) 0.2080776E+00 Vb(Abramov) -0.2732311E+00 Hb(Abramov) -0.6515345E-01 Ex_ueg -0.5543213E-01 Ec_ueg -0.8022014E-02 Delta_ex -0.6077136E-01 Delta_ec 0.1475744E-01 Delta_et -0.1953846E+00 Pxc 0.6910001E+01 Qxc -0.4118014E+01 3,-1 176 3 -1 1.816284 -2.787663 -0.576546 Rho 0.1416020E+00 |GRAD(Rho)| 0.2428231E-15 GRAD(Rho)x -0.2212992E-15 GRAD(Rho)y 0.5698160E-16 GRAD(Rho)z 0.8211476E-16 Laplacian 0.5997233E+00 (-1/4)Del**2(Rho)) -0.1499308E+00 Diamond 0.1138105E+01 Metallicity 0.4420225E+01 Ellipticity 0.9095698E-02 Gb(Abramov) 0.2104086E+00 Vb(Abramov) -0.2708863E+00 Hb(Abramov) -0.6047772E-01 Ex_ueg -0.5451016E-01 Ec_ueg -0.7908105E-02 Delta_ex -0.6354571E-01 Delta_ec 0.1551127E-01 Delta_et -0.2049437E+00 Pxc 0.6892948E+01 Qxc -0.4096744E+01 3,-1 177 3 -1 3.209225 -0.071315 -3.195101 Rho 0.2571874E+00 |GRAD(Rho)| 0.6015529E-14 GRAD(Rho)x -0.2871835E-14 GRAD(Rho)y -0.6885768E-15 GRAD(Rho)z 0.5240708E-14 Laplacian 0.9208757E+00 (-1/4)Del**2(Rho)) -0.2302189E+00 Diamond 0.3535502E+01 Metallicity 0.7783259E+01 Ellipticity 0.1273672E-02 Gb(Abramov) 0.4521216E+00 Vb(Abramov) -0.6740242E+00 Hb(Abramov) -0.2219026E+00 Ex_ueg -0.1207956E+00 Ec_ueg -0.1563531E-01 Delta_ex -0.1132763E+00 Delta_ec 0.1988647E-01 Delta_et -0.2757532E+00 Pxc 0.7725822E+01 Qxc -0.5696149E+01 3,-1 178 3 -1 3.204962 0.056968 3.198365 Rho 0.2572538E+00 |GRAD(Rho)| 0.3505352E-10 GRAD(Rho)x -0.2448874E-10 GRAD(Rho)y -0.5797495E-11 GRAD(Rho)z -0.2440163E-10 Laplacian 0.9201286E+00 (-1/4)Del**2(Rho)) -0.2300322E+00 Diamond 0.3534756E+01 Metallicity 0.7792934E+01 Ellipticity 0.1369256E-02 Gb(Abramov) 0.4521257E+00 Vb(Abramov) -0.6742192E+00 Hb(Abramov) -0.2220935E+00 Ex_ueg -0.1208372E+00 Ec_ueg -0.1563997E-01 Delta_ex -0.1131971E+00 Delta_ec 0.1987763E-01 Delta_et -0.2756744E+00 Pxc 0.7726183E+01 Qxc -0.5694698E+01 3,-1 179 3 -1 1.977140 -2.971367 0.841019 Rho 0.1446815E+00 |GRAD(Rho)| 0.5079701E-15 GRAD(Rho)x 0.3820728E-15 GRAD(Rho)y 0.3271309E-15 GRAD(Rho)z -0.7098814E-16 Laplacian 0.5794038E+00 (-1/4)Del**2(Rho)) -0.1448510E+00 Diamond 0.1128983E+01 Metallicity 0.4742277E+01 Ellipticity 0.2757785E-01 Gb(Abramov) 0.2110545E+00 Vb(Abramov) -0.2772581E+00 Hb(Abramov) -0.6620358E-01 Ex_ueg -0.5609651E-01 Ec_ueg -0.8103929E-02 Delta_ex -0.6172267E-01 Delta_ec 0.1491926E-01 Delta_et -0.1977777E+00 Pxc 0.6922137E+01 Qxc -0.4137114E+01 3,-1 180 3 -1 0.074308 -3.213202 -3.194083 Rho 0.2572239E+00 |GRAD(Rho)| 0.5104209E-12 GRAD(Rho)x -0.8843214E-13 GRAD(Rho)y 0.3563192E-12 GRAD(Rho)z 0.3546066E-12 Laplacian 0.9208415E+00 (-1/4)Del**2(Rho)) -0.2302104E+00 Diamond 0.3536099E+01 Metallicity 0.7785394E+01 Ellipticity 0.1490394E-02 Gb(Abramov) 0.4521867E+00 Vb(Abramov) -0.6741629E+00 Hb(Abramov) -0.2219763E+00 Ex_ueg -0.1208185E+00 Ec_ueg -0.1563787E-01 Delta_ex -0.1132769E+00 Delta_ec 0.1988593E-01 Delta_et -0.2757513E+00 Pxc 0.7726021E+01 Qxc -0.5696337E+01 3,-1 181 3 -1 -4.099858 3.948685 -0.884249 Rho 0.3262949E+00 |GRAD(Rho)| 0.7657176E-14 GRAD(Rho)x 0.4825520E-14 GRAD(Rho)y 0.2093118E-14 GRAD(Rho)z 0.5564670E-14 Laplacian -0.1822528E+01 (-1/4)Del**2(Rho)) 0.4556321E+00 Diamond 0.6380788E+01 Metallicity -0.5847308E+01 Ellipticity 0.1803832E-02 Gb(Abramov) 0.1402822E+00 Vb(Abramov) -0.7361964E+00 Hb(Abramov) -0.5959143E+00 Ex_ueg -0.1659073E+00 Ec_ueg -0.2060902E-01 Delta_ex 0.1833778E+00 Delta_ec 0.6270772E-01 Delta_et -0.1503742E+01 Pxc 0.8050225E+01 Qxc 0.2924325E+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 90 173 162 130 127 155 174 87 85 172 161 180 152 151 78 145 146 163 83 124 147 122 81 165 134 168 176 166 179 159 107 167 106 175 105 149 142 169 113 137 119 136 61 60 171 58 170 160 71 118 138 114 164 116 139 115 70 150 141 117 133 110 158 109 131 178 157 108 132 148 154 177 144 125 156 143 181 1 1 1 1 1 1 2 2 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 13 14 15 16 47 13 24 26 33 39 41 14 21 28 36 37 42 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 52 53 53 53 53 54 2.476777 1.939896 1.929979 1.937827 1.934670 1.717990 2.470865 1.929732 1.919674 1.961779 1.937032 1.717977 2.452787 1.929587 1.977234 1.914283 1.929807 1.717770 2.497981 1.909070 1.924655 1.936456 1.971742 1.717243 2.501687 1.932177 1.933472 1.936150 1.935328 1.717573 2.470250 1.928392 1.934162 1.939553 1.943471 1.718222 2.367172 1.878120 1.886254 1.909600 1.902353 1.849814 2.472144 1.932705 1.927699 1.944804 1.940073 1.718225 2.451318 1.989180 1.926724 1.928969 1.909711 1.717688 2.499061 1.925334 1.912902 1.963211 1.938084 1.717319 2.478058 1.929119 1.943357 1.933058 1.936604 1.717928 2.469553 1.921674 1.931233 1.937473 1.957669 1.718027 1.550638 1.553263 1.553030 1.564784 0.982232 2.477785 1.940304 1.930358 1.938520 1.935310 1.717997 2.471830 1.930150 1.920084 1.962482 1.937693 1.717978 2.453846 1.929971 1.977627 1.914884 1.930458 1.717776 2.498925 1.909439 1.925022 1.937107 1.972168 1.717245 2.502626 1.932547 1.933843 1.936798 1.935976 1.717578 2.471247 1.928760 1.934583 1.940202 1.944166 1.718226 2.368207 1.878695 1.886795 1.910455 1.903183 1.851528 2.473136 1.933124 1.928071 1.945500 1.940727 1.718226 2.452390 1.989555 1.927167 1.929625 1.910303 1.717692 2.499999 1.925702 1.913313 1.963650 1.938773 1.717322 2.479067 1.929497 1.943765 1.933736 1.937298 1.717934 2.470521 1.922083 1.931652 1.938133 1.958371 1.718029 1.550641 1.553273 1.553041 1.564836 0.982536 29 25 23 27 23 23 29 25 25 27 23 21 29 23 26 23 23 21 29 23 23 23 26 20 29 23 23 23 23 21 29 23 26 23 26 22 27 23 23 25 23 25 29 25 23 26 23 21 29 23 25 23 23 22 29 23 26 23 26 20 29 23 27 27 26 23 29 25 26 23 27 20 19 20 22 22 19 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 W W W W W W W W W W W W O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O P H 2.5366 2.5346 2.5384 2.5372 2.5316 2.5368 2.6569 2.5368 2.5382 2.5386 2.5364 2.5349 -1.0417 -1.0508 -1.0507 -1.0545 -0.9453 -0.9455 -0.9241 -0.9464 -0.9457 -0.9447 -0.9477 -0.9453 -0.9256 -0.9463 -0.9453 -0.9452 -0.9406 -0.9393 -0.9416 -0.9268 -0.9410 -0.9377 -0.9434 -0.9368 -0.9420 -0.9248 -0.9408 -0.9393 -0.7161 -0.7158 -0.7124 -0.7125 -0.7156 -0.7169 -0.6667 -0.7169 -0.7114 -0.7134 -0.7158 -0.7160 2.4259 0.3052 2.0787 2.0792 2.0765 2.0767 2.0793 2.0791 2.0654 2.0791 2.0770 2.0756 2.0786 2.0793 1.8916 1.8911 1.8911 1.8930 1.9354 1.9354 1.9407 1.9354 1.9354 1.9358 1.9352 1.9357 1.9397 1.9354 1.9354 1.9354 1.9480 1.9483 1.9481 1.9498 1.9480 1.9489 1.9477 1.9490 1.9481 1.9506 1.9480 1.9483 1.9786 1.9787 1.9789 1.9797 1.9790 1.9784 1.8794 1.9785 1.9791 1.9795 1.9786 1.9786 2.4820 0.5966 6.0790 6.0797 6.0780 6.0790 6.0809 6.0788 6.0775 6.0788 6.0778 6.0783 6.0790 6.0796 5.1090 5.1181 5.1180 5.1198 4.9792 4.9792 4.9520 4.9804 4.9798 4.9778 4.9820 4.9785 4.9546 4.9802 4.9792 4.9788 4.9588 4.9574 4.9601 4.9431 4.9597 4.9548 4.9623 4.9537 4.9605 4.9404 4.9591 4.9573 4.6979 4.6975 4.6938 4.6930 4.6970 4.6989 4.7546 4.6989 4.6925 4.6941 4.6975 4.6978 7.2552 0.0982 3.2769 3.2777 3.2783 3.2783 3.2793 3.2765 3.1692 3.2765 3.2783 3.2786 3.2772 3.2775 0.0411 0.0416 0.0416 0.0416 0.0307 0.0309 0.0314 0.0306 0.0305 0.0311 0.0306 0.0310 0.0313 0.0307 0.0307 0.0309 0.0338 0.0336 0.0334 0.0339 0.0334 0.0339 0.0334 0.0341 0.0333 0.0338 0.0337 0.0336 0.0396 0.0396 0.0397 0.0398 0.0397 0.0395 0.0327 0.0395 0.0398 0.0398 0.0396 0.0396 0.8369 0.0000 14.0289 14.0288 14.0288 14.0288 14.0289 14.0289 14.0309 14.0288 14.0287 14.0289 14.0289 14.0288 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 W W W W W W W W W W W W O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O P H 2.531619 2.530150 2.530932 2.529308 2.530117 2.530486 2.581393 2.530410 2.530441 2.529345 2.531620 2.530287 -1.033032 -1.034722 -1.034733 -1.029171 -0.929974 -0.929074 -0.908062 -0.929853 -0.930699 -0.927506 -0.930570 -0.928286 -0.912792 -0.929770 -0.930002 -0.928681 -0.901560 -0.901312 -0.902407 -0.889601 -0.902190 -0.898287 -0.904420 -0.897412 -0.902691 -0.885601 -0.901790 -0.901141 -0.735341 -0.735119 -0.730380 -0.730339 -0.734370 -0.736540 -0.491331 -0.736504 -0.729140 -0.731406 -0.734983 -0.735422 2.007155 0.172950 1.955781 1.955291 1.957312 1.956827 1.954841 1.954264 1.841734 1.954177 1.957342 1.956037 1.956057 1.955104 -0.777416 -0.776412 -0.776100 -0.756445 -0.696283 -0.696062 -0.662096 -0.695722 -0.696712 -0.698900 -0.693308 -0.698514 -0.665017 -0.696134 -0.696236 -0.696260 -0.724300 -0.725846 -0.726424 -0.689936 -0.725360 -0.726519 -0.724467 -0.726226 -0.726514 -0.685895 -0.724373 -0.725697 -0.614888 -0.613693 -0.606422 -0.606727 -0.613280 -0.616260 -0.619288 -0.616202 -0.604611 -0.608302 -0.614319 -0.614269 1.550649 0.452018 2.053328 2.052078 2.051963 2.049697 2.051767 2.052003 2.069941 2.052078 2.051353 2.049586 2.053445 2.052098 -0.830291 -0.824957 -0.825174 -0.814148 -0.770386 -0.769676 -0.763975 -0.770726 -0.770969 -0.771359 -0.767841 -0.771383 -0.765360 -0.770657 -0.770646 -0.769447 -0.760714 -0.762389 -0.763237 -0.737633 -0.761469 -0.759033 -0.765768 -0.758087 -0.763631 -0.733531 -0.760970 -0.761425 -0.582304 -0.581611 -0.574480 -0.574726 -0.580812 -0.584020 -0.617589 -0.583867 -0.572675 -0.576050 -0.581756 -0.582171 1.515182 0.452423 -7.97447632 7.55823416 -2.23605949 11.21245460 11.52762580 -34.96877970 10.89814395 7.53116126 -9.77285121 -19.05878706 -428.0871 406.1533 -44.4486 -391.9360 -5.1149 -463.4333 Mar16-2024 15:12:04 Nodes: 1 Procs: 1 Mar16-2024 15:12:04 Nodes: 1 Procs: 1 0 Mar16-2024 15:12:05 Nodes: 1 Procs: 1 Mar16-2024 15:12:05 Nodes: 1 Procs: 1 Phosphorus (TZP, 1s frozen) 0 Mar16-2024 15:12:06 Nodes: 1 Procs: 1 Mar16-2024 15:12:06 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Mar16-2024 15:12:07 Nodes: 1 Procs: 1 Mar16-2024 15:12:08 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Mar16-2024 15:12:10 Nodes: 1 Procs: 24 *** (NO TITLE) *** -2 -16.32063714 -16.83870419 -16.31420870 -16.98265596 -17.01931451 -17.02650520 -17.02825301 -17.02983103 -17.03045359 -17.03061503 -17.03078243 -17.03083341 -17.03086027 GEOMETRY CONVERGED