ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr27-2024 21:13:09 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.34 0.03 0.40 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 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr27-2024 21:13:09 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.59 0.04 0.67 1 2 3 4 5 1 2 3 4 5 1 2.000 2.000 0.000 0.000 0.000 6.000 2.000 0.000 0.000 0.000 0.000 -139.491 -10.820 3.478 40.665 286.501 -95.429 -4.086 1.767 16.978 215.955 10.038 S S S S S P P P P P D S P S P P S D P S P S 1 1 2 2 3 3 1 4 4 5 5 2.00 6.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -139.4907 -95.4288 -10.8205 -4.0856 1.7668 3.4780 10.0377 16.9776 40.6653 215.9554 286.5008 1 Si -0.0000 4.0000 8.0000 0.0000 0.0000 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 0 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:10 Nodes: 1 Procs: 1 Silicon (TZP, 1s frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr27-2024 21:13:10 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.32 0.05 1.42 1 2 3 4 5 6 1 2 3 4 1 2 3 1 2 3 2.000 2.000 0.000 0.000 0.000 0.000 6.000 0.000 0.000 0.000 3.000 0.000 0.000 14.000 0.000 0.000 -72.755 -5.438 1.149 14.442 84.369 82466.595 -39.462 -0.588 19.371 119.253 -3.592 3.193 26.757 -25.167 53.137 407.274 S S S S S S P P P P D D D F F F S P F S D P S D S P D F S P F S 1 1 1 2 1 2 3 2 4 3 3 2 5 4 3 6 2.00 6.00 14.00 2.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -72.7547 -39.4619 -25.1674 -5.4383 -3.5916 -0.5880 1.1490 3.1925 14.4417 19.3711 26.7574 53.1371 84.3692 119.2525 407.2741 82466.5953 1 Ta -0.0000 4.0000 6.0000 3.0000 14.0000 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 0 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:10 Nodes: 1 Procs: 1 Silicon (TZP, 1s frozen) 0 Apr27-2024 21:13:10 Nodes: 1 Procs: 1 Apr27-2024 21:13:12 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr27-2024 21:13:13 Hydrogen (TZP) DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 0.44 0.04 0.51 1 2 3 1 2 3 1 2.000 0.000 0.000 4.000 0.000 0.000 0.000 -24.020 24.654 804.880 -9.089 9.585 104.336 29.005 S S S P P P D S P P S D P S 1 1 2 2 1 3 3 2.00 4.00 0.00 0.00 0.00 0.00 0.00 -24.0201 -9.0888 9.5852 24.6539 29.0045 104.3364 804.8804 1 O -0.0000 2.0000 4.0000 0.0000 0.0000 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 0 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:10 Nodes: 1 Procs: 1 Silicon (TZP, 1s frozen) 0 Apr27-2024 21:13:10 Nodes: 1 Procs: 1 Apr27-2024 21:13:12 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Apr27-2024 21:13:13 Nodes: 1 Procs: 1 Apr27-2024 21:13:13 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr27-2024 21:13:14 Hydrogen (TZP) kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 kimik2200 DFT PBEc PBEx PW92 == Not Default == Restricted Point Charge Nuclei Frozen Orbital(s) 1.35 0.04 1.44 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 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 0 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:10 Nodes: 1 Procs: 1 Silicon (TZP, 1s frozen) 0 Apr27-2024 21:13:10 Nodes: 1 Procs: 1 Apr27-2024 21:13:12 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Apr27-2024 21:13:13 Nodes: 1 Procs: 1 Apr27-2024 21:13:13 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Apr27-2024 21:13:14 Nodes: 1 Procs: 1 Apr27-2024 21:13:15 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 ADF 2019 2019-04-25 x86_64_linux_intel / intelmpi Apr27-2024 21:13:17 Hydrogen (TZP) GEOMETRY OPTIMIZATION DFT PBEc PBEx TZP TZP TZP TZP TZP 2865.465200000006 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108.169116 75.704121 421.647860 1.000000 298.150000 93454.7320 93736.3649 94579.8283 1 NOSYM 298.15 49.721 41.934 232.944 324.599 0.889 0.889 130.469 132.247 2.981 2.981 225.124 231.085 2865.465200000006 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287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 -6.260 -6.241 -6.234 -6.215 -6.214 -6.205 -6.186 -6.137 -5.945 -5.893 -3.005 -2.867 -2.802 -2.686 -2.619 -2.512 -2.426 -2.122 -2.053 -2.030 A A A A A A A A A A A A A A A A A A A A 0.00000000072598 0.00046723693154 0.00032006854981 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 74 74 74 74 74 74 74 74 74 73 73 73 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 14 1 0.099307 -2.533688 2.531686 -0.110101 -2.553695 -2.553783 0.120647 2.489608 -2.593503 -0.149956 2.544592 2.552826 2.538564 -2.531358 0.100579 2.496984 2.549709 -0.144381 -2.489053 2.424286 0.114929 -2.550654 -2.554307 -0.123648 2.502666 -0.105171 2.508058 -2.554387 -0.190770 -2.584447 -2.572057 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3.789679 0.233761 -3.765565 3.804066 -0.215920 -3.689597 -3.828788 0.221238 -3.811283 0.156568 -3.795513 -3.821006 -0.218508 3.806089 3.711396 0.233864 3.715950 3.806467 -0.195932 -3.789022 -0.022416 0.002379 -0.038850 -3.599374 4.403161 -0.971807 1 3 -3 0.099307 -2.533688 2.531686 Rho 0.4361414E+07 3,-3 2 3 -3 -0.110101 -2.553695 -2.553783 Rho 0.4361414E+07 3,-3 3 3 -3 0.120647 2.489608 -2.593503 Rho 0.4361414E+07 3,-3 4 3 -3 -0.149956 2.544592 2.552826 Rho 0.4361414E+07 3,-3 5 3 -3 2.538564 -2.531358 0.100579 Rho 0.4361414E+07 3,-3 6 3 -3 2.496984 2.549709 -0.144381 Rho 0.4361414E+07 3,-3 7 3 -3 -2.489053 2.424286 0.114929 Rho 0.4361414E+07 3,-3 8 3 -3 -2.550654 -2.554307 -0.123648 Rho 0.4361414E+07 3,-3 9 3 -3 2.502666 -0.105171 2.508058 Rho 0.4361414E+07 3,-3 10 3 -3 -2.554387 -0.190770 -2.584447 Rho 0.3882646E+07 3,-3 11 3 -3 -2.572057 0.085608 2.578253 Rho 0.3882646E+07 3,-3 12 3 -3 2.562627 0.112310 -2.553240 Rho 0.3882646E+07 3,-3 13 3 -3 0.922483 -0.913941 0.953109 Rho 0.3186704E+03 3,-3 14 3 -3 -0.962098 -0.972279 -0.972826 Rho 0.3186587E+03 3,-3 15 3 -3 0.922945 0.961219 -0.987967 Rho 0.3186548E+03 3,-3 16 3 -3 -1.012253 0.972059 0.885377 Rho 0.3186496E+03 3,-3 17 3 -3 -3.041760 -1.226866 1.145716 Rho 0.3188570E+03 3,-3 18 3 -3 3.062451 -1.187877 -1.131206 Rho 0.3188631E+03 3,-3 19 3 -3 -3.046380 1.149521 -1.116589 Rho 0.3189333E+03 3,-3 20 3 -3 2.980278 1.160979 1.137545 Rho 0.3188684E+03 3,-3 21 3 -3 1.145154 -1.214607 -3.040243 Rho 0.3188606E+03 3,-3 22 3 -3 1.126229 1.155470 3.008799 Rho 0.3188672E+03 3,-3 23 3 -3 -1.163579 1.186679 -3.049864 Rho 0.3188635E+03 3,-3 24 3 -3 -1.147940 -1.207334 3.072225 Rho 0.3188615E+03 3,-3 25 3 -3 -1.163325 2.963757 -1.102716 Rho 0.3189508E+03 3,-3 26 3 -3 -1.122652 -3.028280 1.152804 Rho 0.3188691E+03 3,-3 27 3 -3 1.110129 2.982885 1.147258 Rho 0.3188730E+03 3,-3 28 3 -3 1.164805 -3.026136 -1.129674 Rho 0.3188669E+03 3,-3 29 3 -3 3.418315 -1.499671 1.522579 Rho 0.3189500E+03 3,-3 30 3 -3 -3.470921 -1.626026 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3.804066 -0.215920 Rho 0.3186951E+03 3,-3 48 3 -3 -3.689597 -3.828788 0.221238 Rho 0.3192936E+03 3,-3 49 3 -3 -3.811283 0.156568 -3.795513 Rho 0.3191737E+03 3,-3 50 3 -3 -3.821006 -0.218508 3.806089 Rho 0.3191735E+03 3,-3 51 3 -3 3.711396 0.233864 3.715950 Rho 0.3193082E+03 3,-3 52 3 -3 3.806467 -0.195932 -3.789022 Rho 0.3191639E+03 3,-3 53 3 -3 -0.022416 0.002379 -0.038850 Rho 0.1943303E+04 3,-3 54 3 -3 -3.599374 4.403161 -0.971807 Rho 0.4578601E+00 3,-3 55 3 +1 -2.197625 -1.158272 -1.363311 Rho 0.2647763E-01 |GRAD(Rho)| 0.2792508E-13 GRAD(Rho)x -0.5808089E-14 GRAD(Rho)y -0.2055665E-13 GRAD(Rho)z 0.1798611E-13 Laplacian 0.9814298E-01 (-1/4)Del**2(Rho)) -0.2453575E-01 Diamond 0.1258677E-01 Metallicity 0.1651528E+01 Ellipticity -0.3091371E+01 Gb(Abramov) 0.2311074E-01 Vb(Abramov) -0.2168574E-01 Hb(Abramov) 0.1425005E-02 Ex_ueg -0.5828506E-02 Ec_ueg -0.1163395E-02 Delta_ex -0.6067157E-02 Delta_ec 0.1430945E-02 Delta_et -0.1285361E-01 Pxc 0.5009913E+01 Qxc -0.4239966E+01 3,+1 56 3 -1 -3.165996 -3.243250 0.061736 Rho 0.2398243E+00 |GRAD(Rho)| 0.7628812E-14 GRAD(Rho)x 0.6711211E-14 GRAD(Rho)y 0.6107311E-15 GRAD(Rho)z 0.3575672E-14 Laplacian 0.8870616E+00 (-1/4)Del**2(Rho)) -0.2217654E+00 Diamond 0.3121342E+01 Metallicity 0.7191419E+01 Ellipticity 0.1945943E-02 Gb(Abramov) 0.4136449E+00 Vb(Abramov) -0.6055244E+00 Hb(Abramov) -0.1918795E+00 Ex_ueg -0.1100464E+00 Ec_ueg -0.1442697E-01 Delta_ex -0.1070844E+00 Delta_ec 0.1947485E-01 Delta_et -0.2692008E+00 Pxc 0.7627828E+01 Qxc -0.5498598E+01 3,-1 57 3 -1 -1.724207 -1.731106 -0.542481 Rho 0.4828152E-01 |GRAD(Rho)| 0.1310266E-15 GRAD(Rho)x -0.1132911E-15 GRAD(Rho)y -0.6538247E-16 GRAD(Rho)z 0.7631343E-17 Laplacian 0.1846358E+00 (-1/4)Del**2(Rho)) -0.4615894E-01 Diamond 0.8657818E-01 Metallicity 0.2389272E+01 Ellipticity 0.8066368E-02 Gb(Abramov) 0.4915367E-01 Vb(Abramov) -0.5214840E-01 Hb(Abramov) -0.2994732E-02 Ex_ueg -0.1298453E-01 Ec_ueg -0.2320105E-02 Delta_ex -0.1494406E-01 Delta_ec 0.5287358E-02 Delta_et 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Delta_ex -0.7328032E-02 Delta_ec 0.1989213E-02 Delta_et -0.1811388E-01 Pxc 0.5076267E+01 Qxc -0.3683885E+01 3,+1 60 3 +3 -1.117347 -1.072967 1.116941 Rho 0.4734447E-02 |GRAD(Rho)| 0.6132513E-17 GRAD(Rho)x -0.2512303E-17 GRAD(Rho)y 0.5569771E-17 GRAD(Rho)z 0.5231617E-18 Laplacian 0.1812512E-01 (-1/4)Del**2(Rho)) -0.4531279E-02 Diamond 0.1169954E-03 Metallicity 0.5075137E+00 Ellipticity -0.1540773E+00 Gb(Abramov) 0.3404134E-02 Vb(Abramov) -0.2276989E-02 Hb(Abramov) 0.1127145E-02 Ex_ueg -0.5871433E-03 Ec_ueg -0.1355029E-03 Delta_ex -0.6163460E-03 Delta_ec 0.7901216E-04 Delta_et -0.6220539E-03 Pxc 0.4333067E+01 Qxc -0.7800647E+01 3,+3 61 3 +1 -1.755219 -1.773750 1.771770 Rho 0.1175958E-01 |GRAD(Rho)| 0.3189616E-13 GRAD(Rho)x 0.2019524E-13 GRAD(Rho)y 0.2395228E-14 GRAD(Rho)z 0.2457193E-13 Laplacian 0.5704718E-01 (-1/4)Del**2(Rho)) -0.1426179E-01 Diamond 0.2172757E-02 Metallicity 0.7345679E+00 Ellipticity -0.1254681E+01 Gb(Abramov) 0.1125391E-01 Vb(Abramov) -0.8246016E-02 Hb(Abramov) 0.3007889E-02 Ex_ueg -0.1975032E-02 Ec_ueg -0.4484817E-03 Delta_ex -0.2774189E-02 Delta_ec 0.7136672E-03 Delta_et -0.5345684E-02 Pxc 0.4403818E+01 Qxc -0.3887230E+01 3,+1 62 3 -1 -2.798544 -1.841828 0.553316 Rho 0.1554270E+00 |GRAD(Rho)| 0.5100600E-15 GRAD(Rho)x -0.5937362E-16 GRAD(Rho)y 0.4096387E-15 GRAD(Rho)z 0.2980472E-15 Laplacian 0.6456061E+00 (-1/4)Del**2(Rho)) -0.1614015E+00 Diamond 0.1362629E+01 Metallicity 0.4795749E+01 Ellipticity 0.1022288E-01 Gb(Abramov) 0.2366079E+00 Vb(Abramov) -0.3118142E+00 Hb(Abramov) -0.7520635E-01 Ex_ueg -0.6171922E-01 Ec_ueg -0.8791822E-02 Delta_ex -0.6991572E-01 Delta_ec 0.1618916E-01 Delta_et -0.2164409E+00 Pxc 0.7020072E+01 Qxc -0.4318674E+01 3,-1 63 3 +1 -0.563757 0.504211 -1.715363 Rho 0.8681631E-02 |GRAD(Rho)| 0.1332799E-12 GRAD(Rho)x -0.2849132E-13 GRAD(Rho)y 0.8906509E-13 GRAD(Rho)z -0.9496943E-13 Laplacian 0.3384341E-01 (-1/4)Del**2(Rho)) -0.8460852E-02 Diamond 0.8921017E-03 Metallicity 0.7466916E+00 Ellipticity -0.1420675E+01 Gb(Abramov) 0.6693509E-02 Vb(Abramov) -0.4926166E-02 Hb(Abramov) 0.1767343E-02 Ex_ueg -0.1317812E-02 Ec_ueg -0.3086340E-03 Delta_ex -0.1538533E-02 Delta_ec 0.4561106E-03 Delta_et -0.3141375E-02 Pxc 0.4269822E+01 Qxc -0.3373157E+01 3,+1 64 3 +1 -1.718373 -0.528437 0.509636 Rho 0.8321191E-02 |GRAD(Rho)| 0.1009661E-14 GRAD(Rho)x 0.5814962E-15 GRAD(Rho)y 0.8102337E-15 GRAD(Rho)z 0.1574775E-15 Laplacian 0.3238862E-01 (-1/4)Del**2(Rho)) -0.8097156E-02 Diamond 0.8131325E-03 Metallicity 0.7269923E+00 Ellipticity -0.1415531E+01 Gb(Abramov) 0.6379199E-02 Vb(Abramov) -0.4661242E-02 Hb(Abramov) 0.1717957E-02 Ex_ueg -0.1245372E-02 Ec_ueg -0.2925227E-03 Delta_ex -0.1460034E-02 Delta_ec 0.4426745E-03 Delta_et -0.3010839E-02 Pxc 0.4257350E+01 Qxc -0.3298212E+01 3,+1 65 3 +1 -0.526891 -1.683766 0.506928 Rho 0.8656693E-02 |GRAD(Rho)| 0.2258571E-15 GRAD(Rho)x -0.2264993E-16 GRAD(Rho)y 0.1306477E-15 GRAD(Rho)z -0.1828376E-15 Laplacian 0.3446277E-01 (-1/4)Del**2(Rho)) -0.8615692E-02 Diamond 0.9144594E-03 Metallicity 0.7297650E+00 Ellipticity -0.1408446E+01 Gb(Abramov) 0.6791700E-02 Vb(Abramov) -0.4967708E-02 Hb(Abramov) 0.1823992E-02 Ex_ueg -0.1312767E-02 Ec_ueg -0.3075174E-03 Delta_ex -0.1569822E-02 Delta_ec 0.4721043E-03 Delta_et -0.3242680E-02 Pxc 0.4268920E+01 Qxc -0.3325159E+01 3,+1 66 3 -1 -1.970415 -3.017402 -0.850321 Rho 0.1376540E+00 |GRAD(Rho)| 0.3155835E-15 GRAD(Rho)x -0.2401101E-15 GRAD(Rho)y 0.1715072E-15 GRAD(Rho)z 0.1119168E-15 Laplacian 0.5422512E+00 (-1/4)Del**2(Rho)) -0.1355628E+00 Diamond 0.9966226E+00 Metallicity 0.4663662E+01 Ellipticity 0.3355610E-01 Gb(Abramov) 0.1957451E+00 Vb(Abramov) -0.2559273E+00 Hb(Abramov) -0.6018225E-01 Ex_ueg -0.5249323E-01 Ec_ueg -0.7657936E-02 Delta_ex -0.5708409E-01 Delta_ec 0.1416038E-01 Delta_et -0.1863700E+00 Pxc 0.6854749E+01 Qxc -0.4031254E+01 3,-1 67 3 -1 -1.788770 -2.790608 0.553357 Rho 0.1286644E+00 |GRAD(Rho)| 0.1236812E-13 GRAD(Rho)x -0.9351000E-14 GRAD(Rho)y 0.1810712E-14 GRAD(Rho)z -0.7889902E-14 Laplacian 0.5415237E+00 (-1/4)Del**2(Rho)) -0.1353809E+00 Diamond 0.9184849E+00 Metallicity 0.4172787E+01 Ellipticity 0.9299063E-02 Gb(Abramov) 0.1844066E+00 Vb(Abramov) -0.2334322E+00 Hb(Abramov) -0.4902565E-01 Ex_ueg -0.4797292E-01 Ec_ueg -0.7092062E-02 Delta_ex -0.5609481E-01 Delta_ec 0.1438878E-01 Delta_et -0.1873670E+00 Pxc 0.6764312E+01 Qxc -0.3898511E+01 3,-1 68 3 +1 -0.168577 -2.958061 -0.178010 Rho 0.5631401E-02 |GRAD(Rho)| 0.6597293E-15 GRAD(Rho)x -0.4706158E-15 GRAD(Rho)y -0.6607347E-16 GRAD(Rho)z -0.4576001E-15 Laplacian 0.2358345E-01 (-1/4)Del**2(Rho)) -0.5895862E-02 Diamond 0.5930732E-03 Metallicity 0.5208348E+00 Ellipticity -0.2227979E+01 Gb(Abramov) 0.4442370E-02 Vb(Abramov) -0.2988877E-02 Hb(Abramov) 0.1453492E-02 Ex_ueg -0.7399579E-03 Ec_ueg -0.1741849E-03 Delta_ex -0.1158586E-02 Delta_ec 0.6686726E-03 Delta_et -0.3792775E-02 Pxc 0.4248116E+01 Qxc -0.1732665E+01 3,+1 69 3 +1 -0.600370 -0.481634 1.687946 Rho 0.7708300E-02 |GRAD(Rho)| 0.5151564E-13 GRAD(Rho)x -0.1255687E-13 GRAD(Rho)y 0.4814072E-13 GRAD(Rho)z -0.1336629E-13 Laplacian 0.2967052E-01 (-1/4)Del**2(Rho)) -0.7417631E-02 Diamond 0.6689028E-03 Metallicity 0.6985845E+00 Ellipticity -0.1394186E+01 Gb(Abramov) 0.5808728E-02 Vb(Abramov) -0.4199824E-02 Hb(Abramov) 0.1608903E-02 Ex_ueg -0.1124596E-02 Ec_ueg -0.2652613E-03 Delta_ex -0.1310703E-02 Delta_ec 0.4034067E-03 Delta_et -0.2692291E-02 Pxc 0.4239577E+01 Qxc -0.3249085E+01 3,+1 70 3 +1 -0.505909 1.657002 -0.563385 Rho 0.9861015E-02 |GRAD(Rho)| 0.2377913E-14 GRAD(Rho)x -0.3047425E-15 GRAD(Rho)y -0.1362178E-14 GRAD(Rho)z 0.1925117E-14 Laplacian 0.4113120E-01 (-1/4)Del**2(Rho)) -0.1028280E-01 Diamond 0.1289384E-02 Metallicity 0.7597042E+00 Ellipticity -0.1397628E+01 Gb(Abramov) 0.8157181E-02 Vb(Abramov) -0.6031562E-02 Hb(Abramov) 0.2125619E-02 Ex_ueg -0.1561759E-02 Ec_ueg -0.3617489E-03 Delta_ex -0.1931697E-02 Delta_ec 0.5538275E-03 Delta_et -0.3939632E-02 Pxc 0.4317245E+01 Qxc -0.3487904E+01 3,+1 71 3 +3 0.017926 2.303821 -0.026241 Rho 0.5109574E-02 |GRAD(Rho)| 0.1099087E-15 GRAD(Rho)x 0.4317545E-16 GRAD(Rho)y -0.7041031E-17 GRAD(Rho)z 0.1008277E-15 Laplacian 0.2188908E-01 (-1/4)Del**2(Rho)) -0.5472270E-02 Diamond 0.2213537E-03 Metallicity 0.4771923E+00 Ellipticity -0.3441690E+00 Gb(Abramov) 0.4083401E-02 Vb(Abramov) -0.2694532E-02 Hb(Abramov) 0.1388869E-02 Ex_ueg -0.6499769E-03 Ec_ueg -0.1516312E-03 Delta_ex -0.8184535E-03 Delta_ec 0.1993212E-03 Delta_et -0.1287152E-02 Pxc 0.4286563E+01 Qxc -0.4106204E+01 3,+3 72 3 +1 -0.137406 2.893209 0.132815 Rho 0.6056165E-02 |GRAD(Rho)| 0.1410924E-17 GRAD(Rho)x -0.6955199E-18 GRAD(Rho)y 0.6986037E-18 GRAD(Rho)z 0.1009412E-17 Laplacian 0.2530715E-01 (-1/4)Del**2(Rho)) -0.6326788E-02 Diamond 0.8075850E-03 Metallicity 0.5478976E+00 Ellipticity -0.1730422E+02 Gb(Abramov) 0.4795597E-02 Vb(Abramov) -0.3264406E-02 Hb(Abramov) 0.1531191E-02 Ex_ueg -0.8152960E-03 Ec_ueg -0.1926432E-03 Delta_ex -0.1337895E-02 Delta_ec 0.8532458E-03 Delta_et -0.4885602E-02 Pxc 0.4232155E+01 Qxc -0.1568007E+01 3,+1 73 3 +1 -1.085011 2.160375 1.367844 Rho 0.2938591E-01 |GRAD(Rho)| 0.1098982E-13 GRAD(Rho)x 0.9124738E-15 GRAD(Rho)y 0.2559750E-14 GRAD(Rho)z -0.1064853E-13 Laplacian 0.1112148E+00 (-1/4)Del**2(Rho)) -0.2780371E-01 Diamond 0.1532278E-01 Metallicity 0.1733866E+01 Ellipticity -0.2590486E+01 Gb(Abramov) 0.2657046E-01 Vb(Abramov) -0.2533721E-01 Hb(Abramov) 0.1233252E-02 Ex_ueg -0.6697363E-02 Ec_ueg -0.1311975E-02 Delta_ex -0.6974178E-02 Delta_ec 0.1441673E-02 Delta_et -0.1327966E-01 Pxc 0.5104794E+01 Qxc -0.4837558E+01 3,+1 74 3 +1 1.196029 2.181662 -1.238500 Rho 0.2883624E-01 |GRAD(Rho)| 0.7222698E-14 GRAD(Rho)x 0.7180935E-15 GRAD(Rho)y 0.6383664E-14 GRAD(Rho)z -0.3301597E-14 Laplacian 0.1130853E+00 (-1/4)Del**2(Rho)) -0.2827132E-01 Diamond 0.1785743E-01 Metallicity 0.1652361E+01 Ellipticity -0.4680332E+01 Gb(Abramov) 0.2663328E-01 Vb(Abramov) -0.2499525E-01 Hb(Abramov) 0.1638038E-02 Ex_ueg -0.6530853E-02 Ec_ueg -0.1283737E-02 Delta_ex -0.7294741E-02 Delta_ec 0.1895445E-02 Delta_et -0.1732159E-01 Pxc 0.5087377E+01 Qxc -0.3848564E+01 3,+1 75 3 +1 0.187854 2.910668 -0.206216 Rho 0.5873603E-02 |GRAD(Rho)| 0.3499898E-17 GRAD(Rho)x -0.2206256E-18 GRAD(Rho)y 0.3917197E-19 GRAD(Rho)z 0.3492717E-17 Laplacian 0.2499083E-01 (-1/4)Del**2(Rho)) -0.6247707E-02 Diamond 0.6277964E-03 Metallicity 0.5272381E+00 Ellipticity -0.1912741E+01 Gb(Abramov) 0.4714143E-02 Vb(Abramov) -0.3180579E-02 Hb(Abramov) 0.1533564E-02 Ex_ueg -0.7826925E-03 Ec_ueg -0.1846991E-03 Delta_ex -0.1210349E-02 Delta_ec 0.6586373E-03 Delta_et -0.3804658E-02 Pxc 0.4237663E+01 Qxc -0.1837657E+01 3,+1 76 3 -1 -0.556733 2.728226 -1.802555 Rho 0.1142643E+00 |GRAD(Rho)| 0.2366105E-15 GRAD(Rho)x 0.1226775E-15 GRAD(Rho)y 0.1592761E-16 GRAD(Rho)z -0.2016955E-15 Laplacian 0.4704836E+00 (-1/4)Del**2(Rho)) -0.1176209E+00 Diamond 0.6971184E+00 Metallicity 0.3940815E+01 Ellipticity 0.1668375E-01 Gb(Abramov) 0.1556676E+00 Vb(Abramov) -0.1937144E+00 Hb(Abramov) -0.3804673E-01 Ex_ueg -0.4095110E-01 Ec_ueg -0.6196951E-02 Delta_ex -0.4745183E-01 Delta_ec 0.1298653E-01 Delta_et -0.1658465E+00 Pxc 0.6608266E+01 Qxc -0.3653926E+01 3,-1 77 3 -1 -0.880753 2.999544 1.993822 Rho 0.1472490E+00 |GRAD(Rho)| 0.1286392E-15 GRAD(Rho)x -0.1951564E-16 GRAD(Rho)y -0.9352599E-16 GRAD(Rho)z 0.8613986E-16 Laplacian 0.5780927E+00 (-1/4)Del**2(Rho)) -0.1445232E+00 Diamond 0.1151979E+01 Metallicity 0.4894437E+01 Ellipticity 0.4718193E-01 Gb(Abramov) 0.2142421E+00 Vb(Abramov) -0.2839610E+00 Hb(Abramov) -0.6971889E-01 Ex_ueg -0.5742770E-01 Ec_ueg -0.8267642E-02 Delta_ex -0.6186385E-01 Delta_ec 0.1484857E-01 Delta_et -0.1974048E+00 Pxc 0.6946080E+01 Qxc -0.4166316E+01 3,-1 78 3 +1 0.472477 1.678162 0.486813 Rho 0.8854518E-02 |GRAD(Rho)| 0.1298070E-13 GRAD(Rho)x 0.2165631E-14 GRAD(Rho)y -0.6814967E-14 GRAD(Rho)z -0.1083351E-13 Laplacian 0.3535700E-01 (-1/4)Del**2(Rho)) -0.8839249E-02 Diamond 0.9752044E-03 Metallicity 0.7386057E+00 Ellipticity -0.1422381E+01 Gb(Abramov) 0.6980952E-02 Vb(Abramov) -0.5122656E-02 Hb(Abramov) 0.1858296E-02 Ex_ueg -0.1352918E-02 Ec_ueg -0.3163823E-03 Delta_ex -0.1623170E-02 Delta_ec 0.4902798E-03 Delta_et -0.3382078E-02 Pxc 0.4276214E+01 Qxc -0.3310702E+01 3,+1 79 3 -1 -0.578029 1.728660 1.689109 Rho 0.4299820E-01 |GRAD(Rho)| 0.3844245E-16 GRAD(Rho)x -0.3101835E-16 GRAD(Rho)y -0.7224556E-17 GRAD(Rho)z 0.2152882E-16 Laplacian 0.1632996E+00 (-1/4)Del**2(Rho)) -0.4082490E-01 Diamond 0.6497520E-01 Metallicity 0.2226957E+01 Ellipticity 0.1301718E-01 Gb(Abramov) 0.4236915E-01 Vb(Abramov) -0.4391340E-01 Hb(Abramov) -0.1544251E-02 Ex_ueg -0.1112548E-01 Ec_ueg -0.2031662E-02 Delta_ex -0.1281388E-01 Delta_ec 0.4639947E-02 Delta_et -0.4697790E-01 Pxc 0.5476049E+01 Qxc -0.2761643E+01 3,-1 80 3 +1 -0.181977 0.144089 2.959377 Rho 0.5327609E-02 |GRAD(Rho)| 0.4473389E-15 GRAD(Rho)x -0.3284012E-15 GRAD(Rho)y 0.3034278E-15 GRAD(Rho)z -0.1401300E-16 Laplacian 0.2147530E-01 (-1/4)Del**2(Rho)) -0.5368824E-02 Diamond 0.5252369E-03 Metallicity 0.5214683E+00 Ellipticity -0.2815677E+01 Gb(Abramov) 0.4045828E-02 Vb(Abramov) -0.2722832E-02 Hb(Abramov) 0.1322996E-02 Ex_ueg -0.6872185E-03 Ec_ueg -0.1610383E-03 Delta_ex -0.1063730E-02 Delta_ec 0.6455003E-03 Delta_et -0.3585353E-02 Pxc 0.4267423E+01 Qxc -0.1647915E+01 3,+1 81 3 +3 -0.103120 0.050253 2.305776 Rho 0.4439090E-02 |GRAD(Rho)| 0.2844496E-16 GRAD(Rho)x 0.1494895E-16 GRAD(Rho)y -0.2079831E-16 GRAD(Rho)z 0.1237234E-16 Laplacian 0.1799945E-01 (-1/4)Del**2(Rho)) -0.4499862E-02 Diamond 0.1407604E-03 Metallicity 0.4590330E+00 Ellipticity -0.2435190E+00 Gb(Abramov) 0.3344172E-02 Vb(Abramov) -0.2188482E-02 Hb(Abramov) 0.1155690E-02 Ex_ueg -0.5388199E-03 Ec_ueg -0.1228550E-03 Delta_ex -0.6386849E-03 Delta_ec 0.1452492E-03 Delta_et -0.9334684E-03 Pxc 0.4385821E+01 Qxc -0.4397167E+01 3,+3 82 3 -1 -0.565443 1.789733 -2.822618 Rho 0.1617487E+00 |GRAD(Rho)| 0.2600422E-15 GRAD(Rho)x 0.1524388E-15 GRAD(Rho)y 0.2063779E-15 GRAD(Rho)z 0.4233809E-16 Laplacian 0.6715325E+00 (-1/4)Del**2(Rho)) -0.1678831E+00 Diamond 0.1486401E+01 Metallicity 0.4927358E+01 Ellipticity 0.1031861E-01 Gb(Abramov) 0.2497921E+00 Vb(Abramov) -0.3317011E+00 Hb(Abramov) -0.8190899E-01 Ex_ueg -0.6508877E-01 Ec_ueg -0.9199792E-02 Delta_ex -0.7344112E-01 Delta_ec 0.1666290E-01 Delta_et -0.2239002E+00 Pxc 0.7075026E+01 Qxc -0.4407462E+01 3,-1 83 3 +3 -1.125080 1.047158 -1.170167 Rho 0.5199047E-02 |GRAD(Rho)| 0.6281774E-17 GRAD(Rho)x -0.4652350E-18 GRAD(Rho)y 0.4702895E-17 GRAD(Rho)z -0.4138481E-17 Laplacian 0.2051287E-01 (-1/4)Del**2(Rho)) -0.5128217E-02 Diamond 0.1474416E-03 Metallicity 0.5241550E+00 Ellipticity -0.1951092E+00 Gb(Abramov) 0.3866808E-02 Vb(Abramov) -0.2605399E-02 Hb(Abramov) 0.1261409E-02 Ex_ueg -0.6651966E-03 Ec_ueg -0.1554886E-03 Delta_ex -0.7131954E-03 Delta_ec 0.8457148E-04 Delta_et -0.6906470E-03 Pxc 0.4278105E+01 Qxc -0.8433049E+01 3,+3 84 3 +1 1.772384 -1.760819 -1.752591 Rho 0.1174259E-01 |GRAD(Rho)| 0.8499989E-17 GRAD(Rho)x -0.6280760E-17 GRAD(Rho)y -0.1794041E-17 GRAD(Rho)z -0.5439052E-17 Laplacian 0.5696597E-01 (-1/4)Del**2(Rho)) -0.1424149E-01 Diamond 0.2166219E-02 Metallicity 0.7338447E+00 Ellipticity -0.1254762E+01 Gb(Abramov) 0.1123617E-01 Vb(Abramov) -0.8230845E-02 Hb(Abramov) 0.3005324E-02 Ex_ueg -0.1971228E-02 Ec_ueg -0.4476991E-03 Delta_ex -0.2769434E-02 Delta_ec 0.7131047E-03 Delta_et -0.5339235E-02 Pxc 0.4403020E+01 Qxc -0.3883628E+01 3,+1 85 3 +1 -1.337741 -1.169544 -2.212735 Rho 0.2641029E-01 |GRAD(Rho)| 0.6434842E-13 GRAD(Rho)x -0.2505385E-13 GRAD(Rho)y -0.2903946E-13 GRAD(Rho)z 0.5166947E-13 Laplacian 0.9752939E-01 (-1/4)Del**2(Rho)) -0.2438235E-01 Diamond 0.1251079E-01 Metallicity 0.1654879E+01 Ellipticity -0.3166162E+01 Gb(Abramov) 0.2297987E-01 Vb(Abramov) -0.2157739E-01 Hb(Abramov) 0.1402477E-02 Ex_ueg -0.5808749E-02 Ec_ueg -0.1159979E-02 Delta_ex -0.6029730E-02 Delta_ec 0.1430405E-02 Delta_et -0.1283944E-01 Pxc 0.5007633E+01 Qxc -0.4215399E+01 3,+1 86 3 +1 -1.398234 1.091768 2.151920 Rho 0.2443424E-01 |GRAD(Rho)| 0.4619605E-16 GRAD(Rho)x 0.4345014E-19 GRAD(Rho)y 0.1020680E-16 GRAD(Rho)z 0.4505435E-16 Laplacian 0.8905200E-01 (-1/4)Del**2(Rho)) -0.2226300E-01 Diamond 0.1022822E-01 Metallicity 0.1592090E+01 Ellipticity -0.2935731E+01 Gb(Abramov) 0.2074945E-01 Vb(Abramov) -0.1923590E-01 Hb(Abramov) 0.1513551E-02 Ex_ueg -0.5236609E-02 Ec_ueg -0.1060271E-02 Delta_ex -0.5386405E-02 Delta_ec 0.1299728E-02 Delta_et -0.1146117E-01 Pxc 0.4938933E+01 Qxc -0.4144257E+01 3,+1 87 3 +1 0.079859 0.069793 -2.932650 Rho 0.5056335E-02 |GRAD(Rho)| 0.3747326E-16 GRAD(Rho)x 0.1380441E-16 GRAD(Rho)y 0.3453885E-16 GRAD(Rho)z 0.4555352E-17 Laplacian 0.1992878E-01 (-1/4)Del**2(Rho)) -0.4982195E-02 Diamond 0.4927884E-03 Metallicity 0.5150613E+00 Ellipticity -0.1183777E+02 Gb(Abramov) 0.3749152E-02 Vb(Abramov) -0.2516110E-02 Hb(Abramov) 0.1233042E-02 Ex_ueg -0.6409628E-03 Ec_ueg -0.1493379E-03 Delta_ex -0.1012191E-02 Delta_ec 0.6618328E-03 Delta_et -0.3592574E-02 Pxc 0.4292030E+01 Qxc -0.1529375E+01 3,+1 88 3 +3 -0.017319 -0.021717 -2.397731 Rho 0.4529037E-02 |GRAD(Rho)| 0.7881927E-17 GRAD(Rho)x 0.5184568E-18 GRAD(Rho)y 0.4594490E-17 GRAD(Rho)z 0.6383310E-17 Laplacian 0.1824863E-01 (-1/4)Del**2(Rho)) -0.4562157E-02 Diamond 0.1630268E-03 Metallicity 0.4681583E+00 Ellipticity -0.1893034E+00 Gb(Abramov) 0.3397407E-02 Vb(Abramov) -0.2232656E-02 Hb(Abramov) 0.1164751E-02 Ex_ueg -0.5534260E-03 Ec_ueg -0.1267020E-03 Delta_ex -0.6682570E-03 Delta_ec 0.1782341E-03 Delta_et -0.1101417E-02 Pxc 0.4367935E+01 Qxc -0.3749322E+01 3,+3 89 3 -1 0.367499 0.399982 -0.431216 Rho 0.1405459E+00 |GRAD(Rho)| 0.1887571E-15 GRAD(Rho)x -0.1392593E-15 GRAD(Rho)y -0.1085339E-15 GRAD(Rho)z 0.6675694E-16 Laplacian 0.7518781E+00 (-1/4)Del**2(Rho)) -0.1879695E+00 Diamond 0.1707162E+01 Metallicity 0.3482005E+01 Ellipticity 0.7158036E-02 Gb(Abramov) 0.2343981E+00 Vb(Abramov) -0.2808268E+00 Hb(Abramov) -0.4642862E-01 Ex_ueg -0.5396878E-01 Ec_ueg -0.7841090E-02 Delta_ex -0.8270691E-01 Delta_ec 0.2516728E-01 Delta_et -0.3440071E+00 Pxc 0.6882817E+01 Qxc -0.3286287E+01 3,-1 90 3 +1 1.387109 1.076408 -2.220877 Rho 0.2592827E-01 |GRAD(Rho)| 0.1336203E-13 GRAD(Rho)x 0.1006192E-13 GRAD(Rho)y -0.7470464E-14 GRAD(Rho)z -0.4636134E-14 Laplacian 0.9537365E-01 (-1/4)Del**2(Rho)) -0.2384341E-01 Diamond 0.1085282E-01 Metallicity 0.1641122E+01 Ellipticity -0.2346301E+01 Gb(Abramov) 0.2241727E-01 Vb(Abramov) -0.2099112E-01 Hb(Abramov) 0.1426148E-02 Ex_ueg -0.5667826E-02 Ec_ueg -0.1135564E-02 Delta_ex -0.5755712E-02 Delta_ec 0.1200407E-02 Delta_et -0.1077683E-01 Pxc 0.4991199E+01 Qxc -0.4794798E+01 3,+1 91 3 +3 1.045074 1.097135 1.086181 Rho 0.4955863E-02 |GRAD(Rho)| 0.3877545E-17 GRAD(Rho)x -0.2076452E-17 GRAD(Rho)y -0.3147502E-17 GRAD(Rho)z -0.9038452E-18 Laplacian 0.1962804E-01 (-1/4)Del**2(Rho)) -0.4907011E-02 Diamond 0.1379963E-03 Metallicity 0.5057490E+00 Ellipticity -0.1841475E+00 Gb(Abramov) 0.3684960E-02 Vb(Abramov) -0.2462909E-02 Hb(Abramov) 0.1222051E-02 Ex_ueg -0.6240377E-03 Ec_ueg -0.1450139E-03 Delta_ex -0.6788943E-03 Delta_ec 0.9079441E-04 Delta_et -0.7051639E-03 Pxc 0.4303295E+01 Qxc -0.7477269E+01 3,+3 92 3 +1 0.440582 0.576799 1.658061 Rho 0.8308711E-02 |GRAD(Rho)| 0.2875388E-15 GRAD(Rho)x 0.1938280E-15 GRAD(Rho)y -0.1326497E-16 GRAD(Rho)z 0.2119748E-15 Laplacian 0.3301538E-01 (-1/4)Del**2(Rho)) -0.8253845E-02 Diamond 0.8271004E-03 Metallicity 0.7114094E+00 Ellipticity -0.1392953E+01 Gb(Abramov) 0.6481207E-02 Vb(Abramov) -0.4708569E-02 Hb(Abramov) 0.1772638E-02 Ex_ueg -0.1242882E-02 Ec_ueg -0.2919659E-03 Delta_ex -0.1487686E-02 Delta_ec 0.4511789E-03 Delta_et -0.3067556E-02 Pxc 0.4256942E+01 Qxc -0.3297332E+01 3,+1 93 3 -1 0.514867 1.694017 -1.755034 Rho 0.5301689E-01 |GRAD(Rho)| 0.2066715E-15 GRAD(Rho)x -0.1156892E-15 GRAD(Rho)y 0.1638899E-15 GRAD(Rho)z -0.4969119E-16 Laplacian 0.2045725E+00 (-1/4)Del**2(Rho)) -0.5114311E-01 Diamond 0.1093832E+00 Metallicity 0.2520324E+01 Ellipticity 0.7628925E-02 Gb(Abramov) 0.5557828E-01 Vb(Abramov) -0.6001344E-01 Hb(Abramov) -0.4435164E-02 Ex_ueg -0.1470971E-01 Ec_ueg -0.2582302E-02 Delta_ex -0.1697334E-01 Delta_ec 0.5885106E-02 Delta_et -0.6293951E-01 Pxc 0.5696353E+01 Qxc -0.2884119E+01 3,-1 94 3 -1 1.679343 -0.502766 1.696927 Rho 0.5265072E-01 |GRAD(Rho)| 0.8602398E-14 GRAD(Rho)x 0.6099965E-14 GRAD(Rho)y 0.2223561E-14 GRAD(Rho)z 0.5643355E-14 Laplacian 0.2031698E+00 (-1/4)Del**2(Rho)) -0.5079245E-01 Diamond 0.1080298E+00 Metallicity 0.2508580E+01 Ellipticity 0.7420743E-02 Gb(Abramov) 0.5509779E-01 Vb(Abramov) -0.5940312E-01 Hb(Abramov) -0.4305336E-02 Ex_ueg -0.1457441E-01 Ec_ueg -0.2561912E-02 Delta_ex -0.1684398E-01 Delta_ec 0.5874937E-02 Delta_et -0.6272956E-01 Pxc 0.5688879E+01 Qxc -0.2867091E+01 3,-1 95 3 +1 1.145584 -1.261882 2.166469 Rho 0.2819318E-01 |GRAD(Rho)| 0.1952872E-16 GRAD(Rho)x -0.2810524E-17 GRAD(Rho)y 0.1857475E-16 GRAD(Rho)z -0.5333911E-17 Laplacian 0.1094107E+00 (-1/4)Del**2(Rho)) -0.2735267E-01 Diamond 0.1649120E-01 Metallicity 0.1644853E+01 Ellipticity -0.4142595E+01 Gb(Abramov) 0.2573363E-01 Vb(Abramov) -0.2411459E-01 Hb(Abramov) 0.1619038E-02 Ex_ueg -0.6337391E-02 Ec_ueg -0.1250792E-02 Delta_ex -0.6991097E-02 Delta_ec 0.1791376E-02 Delta_et -0.1628903E-01 Pxc 0.5066704E+01 Qxc -0.3902641E+01 3,+1 96 3 +1 0.526433 -0.529680 -1.710250 Rho 0.8542345E-02 |GRAD(Rho)| 0.4994603E-14 GRAD(Rho)x 0.3885469E-14 GRAD(Rho)y 0.5237134E-15 GRAD(Rho)z -0.3094335E-14 Laplacian 0.3319018E-01 (-1/4)Del**2(Rho)) -0.8297545E-02 Diamond 0.8583897E-03 Metallicity 0.7411374E+00 Ellipticity -0.1421047E+01 Gb(Abramov) 0.6556633E-02 Vb(Abramov) -0.4815722E-02 Hb(Abramov) 0.1740911E-02 Ex_ueg -0.1289697E-02 Ec_ueg -0.3024012E-03 Delta_ex -0.1503804E-02 Delta_ec 0.4494117E-03 Delta_et -0.3080751E-02 Pxc 0.4264856E+01 Qxc -0.3346162E+01 3,+1 97 3 +3 1.117287 -1.091776 -1.110334 Rho 0.4863455E-02 |GRAD(Rho)| 0.4662900E-17 GRAD(Rho)x -0.2053972E-18 GRAD(Rho)y -0.3187060E-17 GRAD(Rho)z -0.3397513E-17 Laplacian 0.1855312E-01 (-1/4)Del**2(Rho)) -0.4638280E-02 Diamond 0.1218299E-03 Metallicity 0.5185266E+00 Ellipticity -0.7596575E-01 Gb(Abramov) 0.3493032E-02 Vb(Abramov) -0.2347784E-02 Hb(Abramov) 0.1145248E-02 Ex_ueg -0.6085714E-03 Ec_ueg -0.1410414E-03 Delta_ex -0.6332878E-03 Delta_ec 0.7671929E-04 Delta_et -0.6189901E-03 Pxc 0.4314841E+01 Qxc -0.8254611E+01 3,+3 98 3 +1 1.687520 -0.513933 -0.550343 Rho 0.8136465E-02 |GRAD(Rho)| 0.5788057E-17 GRAD(Rho)x 0.5263118E-17 GRAD(Rho)y -0.2302897E-17 GRAD(Rho)z -0.7055904E-18 Laplacian 0.3121317E-01 (-1/4)Del**2(Rho)) -0.7803293E-02 Diamond 0.7549642E-03 Metallicity 0.7266661E+00 Ellipticity -0.1414873E+01 Gb(Abramov) 0.6147260E-02 Vb(Abramov) -0.4491227E-02 Hb(Abramov) 0.1656033E-02 Ex_ueg -0.1208647E-02 Ec_ueg -0.2842883E-03 Delta_ex -0.1396615E-02 Delta_ec 0.4222342E-03 Delta_et -0.2859082E-02 Pxc 0.4251484E+01 Qxc -0.3307679E+01 3,+1 99 3 +1 1.650514 0.547413 0.483921 Rho 0.8792945E-02 |GRAD(Rho)| 0.1433153E-16 GRAD(Rho)x 0.8926028E-17 GRAD(Rho)y 0.1111346E-16 GRAD(Rho)z -0.1486451E-17 Laplacian 0.3507902E-01 (-1/4)Del**2(Rho)) -0.8769756E-02 Diamond 0.9427568E-03 Metallicity 0.7358505E+00 Ellipticity -0.1403296E+01 Gb(Abramov) 0.6922042E-02 Vb(Abramov) -0.5074329E-02 Hb(Abramov) 0.1847714E-02 Ex_ueg -0.1340389E-02 Ec_ueg -0.3136213E-03 Delta_ex -0.1600721E-02 Delta_ec 0.4742276E-03 Delta_et -0.3275501E-02 Pxc 0.4273910E+01 Qxc -0.3375428E+01 3,+1 100 3 +3 2.308801 0.013287 -0.044070 Rho 0.4627413E-02 |GRAD(Rho)| 0.6553109E-18 GRAD(Rho)x 0.6053075E-18 GRAD(Rho)y -0.1376873E-18 GRAD(Rho)z -0.2099462E-18 Laplacian 0.1887929E-01 (-1/4)Del**2(Rho)) -0.4719823E-02 Diamond 0.1606143E-03 Metallicity 0.4690199E+00 Ellipticity -0.2742613E+00 Gb(Abramov) 0.3515497E-02 Vb(Abramov) -0.2311171E-02 Hb(Abramov) 0.1204326E-02 Ex_ueg -0.5695119E-03 Ec_ueg -0.1309143E-03 Delta_ex -0.6817051E-03 Delta_ec 0.1604313E-03 Delta_et -0.1028092E-02 Pxc 0.4350266E+01 Qxc -0.4249202E+01 3,+3 101 3 +1 2.148175 -1.283615 1.134765 Rho 0.2736165E-01 |GRAD(Rho)| 0.6522904E-16 GRAD(Rho)x 0.5742711E-16 GRAD(Rho)y -0.3001815E-16 GRAD(Rho)z 0.7474298E-17 Laplacian 0.1042939E+00 (-1/4)Del**2(Rho)) -0.2607348E-01 Diamond 0.1475095E-01 Metallicity 0.1641565E+01 Ellipticity -0.3723602E+01 Gb(Abramov) 0.2451588E-01 Vb(Abramov) -0.2295827E-01 Hb(Abramov) 0.1557610E-02 Ex_ueg -0.6089405E-02 Ec_ueg -0.1208339E-02 Delta_ex -0.6578344E-02 Delta_ec 0.1650294E-02 Delta_et -0.1490992E-01 Pxc 0.5039482E+01 Qxc -0.3986165E+01 3,+1 102 3 +1 0.523762 -1.681469 -0.520999 Rho 0.8588580E-02 |GRAD(Rho)| 0.2084243E-16 GRAD(Rho)x 0.5610987E-17 GRAD(Rho)y -0.1712971E-16 GRAD(Rho)z -0.1046406E-16 Laplacian 0.3386575E-01 (-1/4)Del**2(Rho)) -0.8466437E-02 Diamond 0.8901554E-03 Metallicity 0.7329170E+00 Ellipticity -0.1416656E+01 Gb(Abramov) 0.6678491E-02 Vb(Abramov) -0.4890544E-02 Hb(Abramov) 0.1787946E-02 Ex_ueg -0.1299013E-02 Ec_ueg -0.3044692E-03 Delta_ex -0.1540056E-02 Delta_ec 0.4648640E-03 Delta_et -0.3185735E-02 Pxc 0.4266485E+01 Qxc -0.3312918E+01 3,+1 103 3 +1 2.165110 1.101084 -1.389868 Rho 0.2619432E-01 |GRAD(Rho)| 0.7399720E-16 GRAD(Rho)x 0.1971985E-16 GRAD(Rho)y -0.5491191E-16 GRAD(Rho)z -0.4551258E-16 Laplacian 0.9707172E-01 (-1/4)Del**2(Rho)) -0.2426793E-01 Diamond 0.1192249E-01 Metallicity 0.1640082E+01 Ellipticity -0.2754094E+01 Gb(Abramov) 0.2281219E-01 Vb(Abramov) -0.2135645E-01 Hb(Abramov) 0.1455742E-02 Ex_ueg -0.5745501E-02 Ec_ueg -0.1149032E-02 Delta_ex -0.5948257E-02 Delta_ec 0.1352790E-02 Delta_et -0.1213623E-01 Pxc 0.5000295E+01 Qxc -0.4397030E+01 3,+1 104 3 -1 1.678067 1.722387 -0.559938 Rho 0.4915376E-01 |GRAD(Rho)| 0.1091822E-15 GRAD(Rho)x -0.5017230E-16 GRAD(Rho)y -0.7325819E-16 GRAD(Rho)z -0.6353531E-16 Laplacian 0.1886076E+00 (-1/4)Del**2(Rho)) -0.4715189E-01 Diamond 0.9062792E-01 Metallicity 0.2409806E+01 Ellipticity 0.1055540E-01 Gb(Abramov) 0.5037241E-01 Vb(Abramov) -0.5359293E-01 Hb(Abramov) -0.3220519E-02 Ex_ueg -0.1329824E-01 Ec_ueg -0.2368151E-02 Delta_ex -0.1533523E-01 Delta_ec 0.5400894E-02 Delta_et -0.5663844E-01 Pxc 0.5615452E+01 Qxc -0.2839387E+01 3,-1 105 3 -1 1.755588 2.764128 0.542724 Rho 0.1384799E+00 |GRAD(Rho)| 0.3019852E-13 GRAD(Rho)x 0.2258483E-13 GRAD(Rho)y -0.3342558E-14 GRAD(Rho)z -0.1976623E-13 Laplacian 0.5871891E+00 (-1/4)Del**2(Rho)) -0.1467973E+00 Diamond 0.1083835E+01 Metallicity 0.4349907E+01 Ellipticity 0.9114661E-02 Gb(Abramov) 0.2042906E+00 Vb(Abramov) -0.2617839E+00 Hb(Abramov) -0.5749333E-01 Ex_ueg -0.5291363E-01 Ec_ueg -0.7710194E-02 Delta_ex -0.6186955E-01 Delta_ec 0.1524912E-01 Delta_et -0.2007577E+00 Pxc 0.6862815E+01 Qxc -0.4057255E+01 3,-1 106 3 -1 1.936798 3.010962 -0.869774 Rho 0.1476691E+00 |GRAD(Rho)| 0.1947338E-15 GRAD(Rho)x -0.1624948E-16 GRAD(Rho)y 0.2978845E-16 GRAD(Rho)z -0.1917547E-15 Laplacian 0.5765068E+00 (-1/4)Del**2(Rho)) -0.1441267E+00 Diamond 0.1154833E+01 Metallicity 0.4931262E+01 Ellipticity 0.4247730E-01 Gb(Abramov) 0.2145389E+00 Vb(Abramov) -0.2849511E+00 Hb(Abramov) -0.7041219E-01 Ex_ueg -0.5764627E-01 Ec_ueg -0.8294470E-02 Delta_ex -0.6175831E-01 Delta_ec 0.1483516E-01 Delta_et -0.1973917E+00 Pxc 0.6949964E+01 Qxc -0.4162969E+01 3,-1 107 3 -1 2.985191 2.027645 -0.864812 Rho 0.1576847E+00 |GRAD(Rho)| 0.3359695E-15 GRAD(Rho)x 0.1511378E-15 GRAD(Rho)y -0.2304607E-15 GRAD(Rho)z -0.1921477E-15 Laplacian 0.6193951E+00 (-1/4)Del**2(Rho)) -0.1548488E+00 Diamond 0.1332692E+01 Metallicity 0.5120293E+01 Ellipticity 0.3368917E-01 Gb(Abramov) 0.2353777E+00 Vb(Abramov) -0.3159066E+00 Hb(Abramov) -0.8052893E-01 Ex_ueg -0.6291747E-01 Ec_ueg -0.8937249E-02 Delta_ex -0.6734062E-01 Delta_ec 0.1551791E-01 Delta_et -0.2079638E+00 Pxc 0.7039915E+01 Qxc -0.4339541E+01 3,-1 108 3 -1 2.816135 -0.577014 -1.795553 Rho 0.1212688E+00 |GRAD(Rho)| 0.4025117E-14 GRAD(Rho)x -0.7517112E-15 GRAD(Rho)y 0.2820959E-14 GRAD(Rho)z -0.2771045E-14 Laplacian 0.5258879E+00 (-1/4)Del**2(Rho)) -0.1314720E+00 Diamond 0.8579852E+00 Metallicity 0.3893154E+01 Ellipticity 0.1614841E-01 Gb(Abramov) 0.1729548E+00 Vb(Abramov) -0.2144376E+00 Hb(Abramov) -0.4148279E-01 Ex_ueg -0.4433197E-01 Ec_ueg -0.6630559E-02 Delta_ex -0.5406972E-01 Delta_ec 0.1481355E-01 Delta_et -0.1920343E+00 Pxc 0.6686008E+01 Qxc -0.3650017E+01 3,-1 109 3 -1 2.972984 -0.847204 1.972492 Rho 0.1449071E+00 |GRAD(Rho)| 0.1788195E-14 GRAD(Rho)x -0.2504507E-15 GRAD(Rho)y 0.1016101E-14 GRAD(Rho)z 0.1449985E-14 Laplacian 0.5737563E+00 (-1/4)Del**2(Rho)) -0.1434391E+00 Diamond 0.1119240E+01 Metallicity 0.4801404E+01 Ellipticity 0.4698051E-01 Gb(Abramov) 0.2104109E+00 Vb(Abramov) -0.2773827E+00 Hb(Abramov) -0.6697181E-01 Ex_ueg -0.5621314E-01 Ec_ueg -0.8118294E-02 Delta_ex -0.6113563E-01 Delta_ec 0.1475268E-01 Delta_et -0.1955802E+00 Pxc 0.6924255E+01 Qxc -0.4144036E+01 3,-1 110 3 +1 2.930616 0.182028 -0.194505 Rho 0.5425068E-02 |GRAD(Rho)| 0.1979946E-15 GRAD(Rho)x 0.1288453E-16 GRAD(Rho)y 0.1404434E-15 GRAD(Rho)z -0.1389659E-15 Laplacian 0.2192651E-01 (-1/4)Del**2(Rho)) -0.5481629E-02 Diamond 0.5238317E-03 Metallicity 0.5264036E+00 Ellipticity -0.2399572E+01 Gb(Abramov) 0.4135344E-02 Vb(Abramov) -0.2789059E-02 Hb(Abramov) 0.1346285E-02 Ex_ueg -0.7040313E-03 Ec_ueg -0.1652508E-03 Delta_ex -0.1068601E-02 Delta_ec 0.6208765E-03 Delta_et -0.3483303E-02 Pxc 0.4260380E+01 Qxc -0.1721117E+01 3,+1 111 3 -1 3.155762 0.076889 3.160745 Rho 0.2406451E+00 |GRAD(Rho)| 0.3315637E-15 GRAD(Rho)x -0.3664603E-16 GRAD(Rho)y -0.3520947E-16 GRAD(Rho)z -0.3276459E-15 Laplacian 0.8980914E+00 (-1/4)Del**2(Rho)) -0.2245229E+00 Diamond 0.3167403E+01 Metallicity 0.7143665E+01 Ellipticity 0.1311773E-02 Gb(Abramov) 0.4170013E+00 Vb(Abramov) -0.6094796E+00 Hb(Abramov) -0.1924784E+00 Ex_ueg -0.1105489E+00 Ec_ueg -0.1448372E-01 Delta_ex -0.1084821E+00 Delta_ec 0.1964227E-01 Delta_et -0.2712999E+00 Pxc 0.7632632E+01 Qxc -0.5522892E+01 3,-1 112 3 -1 1.706383 0.529188 -1.735984 Rho 0.4489396E-01 |GRAD(Rho)| 0.5282758E-12 GRAD(Rho)x 0.3332822E-12 GRAD(Rho)y -0.3857054E-12 GRAD(Rho)z 0.1386707E-12 Laplacian 0.1832268E+00 (-1/4)Del**2(Rho)) -0.4580670E-01 Diamond 0.8388370E-01 Metallicity 0.2132737E+01 Ellipticity 0.9921339E-02 Gb(Abramov) 0.4682008E-01 Vb(Abramov) -0.4783345E-01 Hb(Abramov) -0.1013374E-02 Ex_ueg -0.1178426E-01 Ec_ueg -0.2134638E-02 Delta_ex -0.1486167E-01 Delta_ec 0.5788344E-02 Delta_et -0.5939432E-01 Pxc 0.5520496E+01 Qxc -0.2567516E+01 3,-1 113 3 -1 3.231791 -0.052469 -3.218159 Rho 0.2183195E+00 |GRAD(Rho)| 0.4746210E-10 GRAD(Rho)x 0.3315838E-10 GRAD(Rho)y -0.8182272E-11 GRAD(Rho)z -0.3295789E-10 Laplacian 0.8222099E+00 (-1/4)Del**2(Rho)) -0.2055525E+00 Diamond 0.2582368E+01 Metallicity 0.6634142E+01 Ellipticity 0.2094776E-02 Gb(Abramov) 0.3643124E+00 Vb(Abramov) -0.5230723E+00 Hb(Abramov) -0.1587599E+00 Ex_ueg -0.9709015E-01 Ec_ueg -0.1295329E-01 Delta_ex -0.9685101E-01 Delta_ec 0.1853469E-01 Delta_et -0.2550867E+00 Pxc 0.7495402E+01 Qxc -0.5225391E+01 3,-1 114 3 +1 -1.709914 0.463300 -0.589208 Rho 0.9174497E-02 |GRAD(Rho)| 0.8279508E-17 GRAD(Rho)x 0.6707940E-17 GRAD(Rho)y -0.1507580E-17 GRAD(Rho)z 0.4613133E-17 Laplacian 0.3694385E-01 (-1/4)Del**2(Rho)) -0.9235963E-02 Diamond 0.1050482E-02 Metallicity 0.7499657E+00 Ellipticity -0.1407751E+01 Gb(Abramov) 0.7311751E-02 Vb(Abramov) -0.5387539E-02 Hb(Abramov) 0.1924212E-02 Ex_ueg -0.1418496E-02 Ec_ueg -0.3307574E-03 Delta_ex -0.1703560E-02 Delta_ec 0.4982264E-03 Delta_et -0.3479536E-02 Pxc 0.4288629E+01 Qxc -0.3419249E+01 3,+1 115 3 +1 1.969003 -1.956094 1.971319 Rho 0.1277137E-01 |GRAD(Rho)| 0.2229924E-16 GRAD(Rho)x 0.2151990E-16 GRAD(Rho)y 0.2682293E-17 GRAD(Rho)z -0.5191869E-17 Laplacian 0.5907644E-01 (-1/4)Del**2(Rho)) -0.1476911E-01 Diamond 0.1801020E-02 Metallicity 0.8139439E+00 Ellipticity -0.1030609E+01 Gb(Abramov) 0.1184961E-01 Vb(Abramov) -0.8930113E-02 Hb(Abramov) 0.2919499E-02 Ex_ueg -0.2204795E-02 Ec_ueg -0.4952941E-03 Delta_ex -0.2745348E-02 Delta_ec 0.3976761E-03 Delta_et -0.3301463E-02 Pxc 0.4451487E+01 Qxc -0.6903477E+01 3,+1 116 3 -1 -3.026761 -0.948975 -2.007307 Rho 0.1181383E+00 |GRAD(Rho)| 0.4293343E-13 GRAD(Rho)x -0.3686142E-13 GRAD(Rho)y 0.2195732E-13 GRAD(Rho)z 0.1546452E-14 Laplacian 0.4873341E+00 (-1/4)Del**2(Rho)) -0.1218335E+00 Diamond 0.7659350E+00 Metallicity 0.4021958E+01 Ellipticity 0.1332537E-01 Gb(Abramov) 0.1628905E+00 Vb(Abramov) -0.2039476E+00 Hb(Abramov) -0.4105703E-01 Ex_ueg -0.4281270E-01 Ec_ueg -0.6436341E-02 Delta_ex -0.4973608E-01 Delta_ec 0.1369879E-01 Delta_et -0.1765599E+00 Pxc 0.6651714E+01 Qxc -0.3630690E+01 3,-1 117 3 -1 -1.812834 -0.599955 2.828502 Rho 0.1228243E+00 |GRAD(Rho)| 0.6241267E-12 GRAD(Rho)x -0.4610989E-12 GRAD(Rho)y 0.4011630E-12 GRAD(Rho)z -0.1264524E-12 Laplacian 0.5313744E+00 (-1/4)Del**2(Rho)) -0.1328436E+00 Diamond 0.8789461E+00 Metallicity 0.3935677E+01 Ellipticity 0.1802843E-01 Gb(Abramov) 0.1757006E+00 Vb(Abramov) -0.2185577E+00 Hb(Abramov) -0.4285704E-01 Ex_ueg -0.4509176E-01 Ec_ueg -0.6727315E-02 Delta_ex -0.5478056E-01 Delta_ec 0.1489247E-01 Delta_et -0.1934537E+00 Pxc 0.6702788E+01 Qxc -0.3678405E+01 3,-1 118 3 +1 -0.123834 -0.125435 -2.933333 Rho 0.5047182E-02 |GRAD(Rho)| 0.1540407E-14 GRAD(Rho)x -0.1076150E-14 GRAD(Rho)y -0.1098683E-14 GRAD(Rho)z 0.8747396E-16 Laplacian 0.1996372E-01 (-1/4)Del**2(Rho)) -0.4990930E-02 Diamond 0.4750071E-03 Metallicity 0.5126095E+00 Ellipticity -0.4821608E+01 Gb(Abramov) 0.3753686E-02 Vb(Abramov) -0.2516443E-02 Hb(Abramov) 0.1237244E-02 Ex_ueg -0.6394162E-03 Ec_ueg -0.1489438E-03 Delta_ex -0.9976204E-03 Delta_ec 0.6344321E-03 Delta_et -0.3452892E-02 Pxc 0.4293004E+01 Qxc -0.1572462E+01 3,+1 119 3 -1 -1.721668 -0.572009 -1.741926 Rho 0.4751039E-01 |GRAD(Rho)| 0.1844192E-12 GRAD(Rho)x -0.1247973E-12 GRAD(Rho)y 0.4531605E-13 GRAD(Rho)z -0.1279942E-12 Laplacian 0.1950482E+00 (-1/4)Del**2(Rho)) -0.4876205E-01 Diamond 0.9624266E-01 Metallicity 0.2201839E+01 Ellipticity 0.8620949E-02 Gb(Abramov) 0.5040239E-01 Vb(Abramov) -0.5204274E-01 Hb(Abramov) -0.1640348E-02 Ex_ueg -0.1270876E-01 Ec_ueg -0.2277727E-02 Delta_ex -0.1603467E-01 Delta_ec 0.6143344E-02 Delta_et -0.6399849E-01 Pxc 0.5579581E+01 Qxc -0.2610089E+01 3,-1 120 3 +1 -2.947816 -0.216342 -0.183318 Rho 0.5303420E-02 |GRAD(Rho)| 0.3107725E-17 GRAD(Rho)x 0.5482408E-19 GRAD(Rho)y -0.3107221E-17 GRAD(Rho)z -0.1113763E-19 Laplacian 0.2155535E-01 (-1/4)Del**2(Rho)) -0.5388837E-02 Diamond 0.5006494E-03 Metallicity 0.5156062E+00 Ellipticity -0.2348215E+01 Gb(Abramov) 0.4055645E-02 Vb(Abramov) -0.2722452E-02 Hb(Abramov) 0.1333193E-02 Ex_ueg -0.6830614E-03 Ec_ueg -0.1599935E-03 Delta_ex -0.1046709E-02 Delta_ec 0.6121537E-03 Delta_et -0.3410557E-02 Pxc 0.4269308E+01 Qxc -0.1709880E+01 3,+1 121 3 -1 -1.758388 0.521828 1.697981 Rho 0.4040277E-01 |GRAD(Rho)| 0.4590162E-13 GRAD(Rho)x -0.2127844E-13 GRAD(Rho)y -0.2229028E-13 GRAD(Rho)z 0.3401956E-13 Laplacian 0.1635459E+00 (-1/4)Del**2(Rho)) -0.4088647E-01 Diamond 0.6508152E-01 Metallicity 0.2004436E+01 Ellipticity 0.1383403E-01 Gb(Abramov) 0.4091670E-01 Vb(Abramov) -0.4094693E-01 Hb(Abramov) -0.3022907E-04 Ex_ueg -0.1023921E-01 Ec_ueg -0.1891682E-02 Delta_ex -0.1293738E-01 Delta_ec 0.5190228E-02 Delta_et -0.5175900E-01 Pxc 0.5412756E+01 Qxc -0.2492643E+01 3,-1 122 3 -1 -1.814505 0.538281 -2.819897 Rho 0.1147169E+00 |GRAD(Rho)| 0.7978684E-10 GRAD(Rho)x -0.5165992E-10 GRAD(Rho)y -0.5435388E-10 GRAD(Rho)z 0.2725525E-10 Laplacian 0.5007577E+00 (-1/4)Del**2(Rho)) -0.1251894E+00 Diamond 0.7652961E+00 Metallicity 0.3727046E+01 Ellipticity 0.1745560E-01 Gb(Abramov) 0.1612241E+00 Vb(Abramov) -0.1972587E+00 Hb(Abramov) -0.3603465E-01 Ex_ueg -0.4116756E-01 Ec_ueg -0.6224869E-02 Delta_ex -0.5083410E-01 Delta_ec 0.1431275E-01 Delta_et -0.1836725E+00 Pxc 0.6613402E+01 Qxc -0.3551665E+01 3,-1 123 3 +1 -1.767734 1.711226 -1.756660 Rho 0.1184034E-01 |GRAD(Rho)| 0.2526462E-16 GRAD(Rho)x -0.8908669E-17 GRAD(Rho)y 0.8347463E-17 GRAD(Rho)z 0.2211915E-16 Laplacian 0.5764573E-01 (-1/4)Del**2(Rho)) -0.1441143E-01 Diamond 0.2240544E-02 Metallicity 0.7352805E+00 Ellipticity -0.1270932E+01 Gb(Abramov) 0.1137370E-01 Vb(Abramov) -0.8335959E-02 Hb(Abramov) 0.3037736E-02 Ex_ueg -0.1993138E-02 Ec_ueg -0.4522036E-03 Delta_ex -0.2815525E-02 Delta_ec 0.7339062E-03 Delta_et -0.5496157E-02 Pxc 0.4407612E+01 Qxc -0.3836355E+01 3,+1 124 3 -1 -0.871123 2.004688 3.020238 Rho 0.1575848E+00 |GRAD(Rho)| 0.2520538E-15 GRAD(Rho)x -0.2314230E-15 GRAD(Rho)y 0.2207707E-16 GRAD(Rho)z 0.9740201E-16 Laplacian 0.6199786E+00 (-1/4)Del**2(Rho)) -0.1549946E+00 Diamond 0.1330851E+01 Metallicity 0.5110071E+01 Ellipticity 0.2966980E-01 Gb(Abramov) 0.2353354E+00 Vb(Abramov) -0.3156761E+00 Hb(Abramov) -0.8034074E-01 Ex_ueg -0.6286431E-01 Ec_ueg -0.8930804E-02 Delta_ex -0.6737406E-01 Delta_ec 0.1550034E-01 Delta_et -0.2076253E+00 Pxc 0.7039042E+01 Qxc -0.4346618E+01 3,-1 125 3 -1 -2.991157 1.959476 0.853023 Rho 0.1656183E+00 |GRAD(Rho)| 0.2756999E-12 GRAD(Rho)x 0.1238537E-12 GRAD(Rho)y 0.1406004E-12 GRAD(Rho)z -0.2022430E-12 Laplacian 0.6635723E+00 (-1/4)Del**2(Rho)) -0.1658931E+00 Diamond 0.1501159E+01 Metallicity 0.5186872E+01 Ellipticity 0.1781929E-01 Gb(Abramov) 0.2540064E+00 Vb(Abramov) -0.3421198E+00 Hb(Abramov) -0.8811334E-01 Ex_ueg -0.6717323E-01 Ec_ueg -0.9450696E-02 Delta_ex -0.7291209E-01 Delta_ec 0.1621156E-01 Delta_et -0.2180554E+00 Pxc 0.7107755E+01 Qxc -0.4497536E+01 3,-1 126 3 -1 -0.432091 0.404959 0.338292 Rho 0.1341718E+00 |GRAD(Rho)| 0.1388266E-15 GRAD(Rho)x -0.5858199E-16 GRAD(Rho)y 0.1179373E-15 GRAD(Rho)z 0.4395173E-16 Laplacian 0.6956795E+00 (-1/4)Del**2(Rho)) -0.1739199E+00 Diamond 0.1494164E+01 Metallicity 0.3483156E+01 Ellipticity 0.1603909E-01 Gb(Abramov) 0.2169116E+00 Vb(Abramov) -0.2599033E+00 Hb(Abramov) -0.4299172E-01 Ex_ueg -0.5073024E-01 Ec_ueg -0.7438119E-02 Delta_ex -0.7572221E-01 Delta_ec 0.2352739E-01 Delta_et -0.3185909E+00 Pxc 0.6820305E+01 Qxc -0.3218470E+01 3,-1 127 3 -1 -0.411195 -0.400838 -0.425094 Rho 0.1415210E+00 |GRAD(Rho)| 0.4209054E-15 GRAD(Rho)x 0.3217397E-15 GRAD(Rho)y -0.6357035E-17 GRAD(Rho)z 0.2713014E-15 Laplacian 0.7601038E+00 (-1/4)Del**2(Rho)) -0.1900259E+00 Diamond 0.1739824E+01 Metallicity 0.3484244E+01 Ellipticity 0.6006865E-02 Gb(Abramov) 0.2370334E+00 Vb(Abramov) -0.2840409E+00 Hb(Abramov) -0.4700746E-01 Ex_ueg -0.5446861E-01 Ec_ueg -0.7902966E-02 Delta_ex -0.8373988E-01 Delta_ec 0.2539638E-01 Delta_et -0.3476057E+00 Pxc 0.6892174E+01 Qxc -0.3297316E+01 3,-1 128 3 -1 0.368140 -0.374909 0.372845 Rho 0.1405570E+00 |GRAD(Rho)| 0.1348640E-12 GRAD(Rho)x -0.7642562E-13 GRAD(Rho)y 0.7552548E-13 GRAD(Rho)z -0.8150657E-13 Laplacian 0.7472806E+00 (-1/4)Del**2(Rho)) -0.1868202E+00 Diamond 0.1694796E+01 Metallicity 0.3503890E+01 Ellipticity 0.3228909E-02 Gb(Abramov) 0.2336463E+00 Vb(Abramov) -0.2804725E+00 Hb(Abramov) -0.4682617E-01 Ex_ueg -0.5397449E-01 Ec_ueg -0.7841797E-02 Delta_ex -0.8217998E-01 Delta_ec 0.2497243E-01 Delta_et -0.3412838E+00 Pxc 0.6882924E+01 Qxc -0.3290828E+01 3,-1 129 3 +3 -2.376460 -0.070441 -0.029271 Rho 0.4681096E-02 |GRAD(Rho)| 0.2423194E-17 GRAD(Rho)x 0.9272883E-18 GRAD(Rho)y -0.7201927E-18 GRAD(Rho)z 0.2119747E-17 Laplacian 0.1937302E-01 (-1/4)Del**2(Rho)) -0.4843256E-02 Diamond 0.1767953E-03 Metallicity 0.4659382E+00 Ellipticity -0.2678656E+00 Gb(Abramov) 0.3604947E-02 Vb(Abramov) -0.2366638E-02 Hb(Abramov) 0.1238309E-02 Ex_ueg -0.5783380E-03 Ec_ueg -0.1332150E-03 Delta_ex -0.7111311E-03 Delta_ec 0.1816009E-03 Delta_et -0.1141288E-02 Pxc 0.4341389E+01 Qxc -0.3915900E+01 3,+3 130 3 -1 1.766320 0.566575 2.758466 Rho 0.1425444E+00 |GRAD(Rho)| 0.5080146E-13 GRAD(Rho)x 0.2753643E-14 GRAD(Rho)y 0.4870121E-13 GRAD(Rho)z -0.1419149E-13 Laplacian 0.6018906E+00 (-1/4)Del**2(Rho)) -0.1504726E+00 Diamond 0.1150169E+01 Metallicity 0.4453270E+01 Ellipticity 0.1274563E-01 Gb(Abramov) 0.2119977E+00 Vb(Abramov) -0.2735227E+00 Hb(Abramov) -0.6152501E-01 Ex_ueg -0.5499440E-01 Ec_ueg -0.7967967E-02 Delta_ex -0.6386591E-01 Delta_ec 0.1551955E-01 Delta_et -0.2052084E+00 Pxc 0.6901936E+01 Qxc -0.4115189E+01 3,-1 131 3 -1 1.995384 -2.976255 0.860837 Rho 0.1404090E+00 |GRAD(Rho)| 0.5375228E-13 GRAD(Rho)x -0.4295960E-13 GRAD(Rho)y 0.2159262E-13 GRAD(Rho)z 0.2403203E-13 Laplacian 0.5594220E+00 (-1/4)Del**2(Rho)) -0.1398555E+00 Diamond 0.1051618E+01 Metallicity 0.4672314E+01 Ellipticity 0.3424807E-01 Gb(Abramov) 0.2021451E+00 Vb(Abramov) -0.2644347E+00 Hb(Abramov) -0.6228962E-01 Ex_ueg -0.5389871E-01 Ec_ueg -0.7832409E-02 Delta_ex -0.5916136E-01 Delta_ec 0.1451289E-01 Delta_et -0.1915378E+00 Pxc 0.6881499E+01 Qxc -0.4076469E+01 3,-1 132 3 -1 2.988294 -1.972979 0.855532 Rho 0.1354559E+00 |GRAD(Rho)| 0.7622049E-15 GRAD(Rho)x -0.1707889E-15 GRAD(Rho)y -0.2309215E-15 GRAD(Rho)z -0.7060189E-15 Laplacian 0.5329228E+00 (-1/4)Del**2(Rho)) -0.1332307E+00 Diamond 0.9625641E+00 Metallicity 0.4619681E+01 Ellipticity 0.2860026E-01 Gb(Abramov) 0.1914010E+00 Vb(Abramov) -0.2495714E+00 Hb(Abramov) -0.5817033E-01 Ex_ueg -0.5137860E-01 Ec_ueg -0.7519086E-02 Delta_ex -0.5590473E-01 Delta_ec 0.1400851E-01 Delta_et -0.1839818E+00 Pxc 0.6833090E+01 Qxc -0.3990769E+01 3,-1 133 3 -1 1.802043 -2.779000 -0.555929 Rho 0.1513989E+00 |GRAD(Rho)| 0.5178795E-13 GRAD(Rho)x -0.4731057E-13 GRAD(Rho)y 0.8932579E-14 GRAD(Rho)z -0.1907643E-13 Laplacian 0.6344254E+00 (-1/4)Del**2(Rho)) -0.1586063E+00 Diamond 0.1300441E+01 Metallicity 0.4671291E+01 Ellipticity 0.1296955E-01 Gb(Abramov) 0.2292203E+00 Vb(Abramov) -0.2998343E+00 Hb(Abramov) -0.7061396E-01 Ex_ueg -0.5959574E-01 Ec_ueg -0.8533121E-02 Delta_ex -0.6829062E-01 Delta_ec 0.1606611E-01 Delta_et -0.2141613E+00 Pxc 0.6984049E+01 Qxc -0.4250602E+01 3,-1 134 3 -1 1.700092 -1.692552 0.521850 Rho 0.4398155E-01 |GRAD(Rho)| 0.7516395E-16 GRAD(Rho)x 0.4826775E-16 GRAD(Rho)y -0.3344912E-16 GRAD(Rho)z -0.4691483E-16 Laplacian 0.1649184E+00 (-1/4)Del**2(Rho)) -0.4122961E-01 Diamond 0.6767080E-01 Metallicity 0.2289786E+01 Ellipticity 0.7317844E-02 Gb(Abramov) 0.4322090E-01 Vb(Abramov) -0.4521220E-01 Hb(Abramov) -0.1991292E-02 Ex_ueg -0.1146601E-01 Ec_ueg -0.2085001E-02 Delta_ex -0.1301485E-01 Delta_ec 0.4685294E-02 Delta_et -0.4772021E-01 Pxc 0.5499284E+01 Qxc -0.2777808E+01 3,-1 135 3 -1 0.062421 -2.950682 0.053262 Rho 0.5724644E-02 |GRAD(Rho)| 0.3397231E-12 GRAD(Rho)x -0.3026390E-12 GRAD(Rho)y 0.8190750E-13 GRAD(Rho)z 0.1308149E-12 Laplacian 0.2325673E-01 (-1/4)Del**2(Rho)) -0.5814183E-02 Diamond 0.7468710E-03 Metallicity 0.5428068E+00 Ellipticity 0.3547764E+01 Gb(Abramov) 0.4402118E-02 Vb(Abramov) -0.2990054E-02 Hb(Abramov) 0.1412065E-02 Ex_ueg -0.7563388E-03 Ec_ueg -0.1782293E-03 Delta_ex -0.1261826E-02 Delta_ec 0.8655587E-03 Delta_et -0.4842499E-02 Pxc 0.4243629E+01 Qxc -0.1457817E+01 3,-1 136 3 +3 1.944538 -1.932692 1.946770 Rho 0.1277042E-01 |GRAD(Rho)| 0.1909752E-16 GRAD(Rho)x 0.1317202E-16 GRAD(Rho)y 0.1362946E-16 GRAD(Rho)z -0.2334727E-17 Laplacian 0.5875987E-01 (-1/4)Del**2(Rho)) -0.1468997E-01 Diamond 0.1675402E-02 Metallicity 0.8182280E+00 Ellipticity -0.9661975E+00 Gb(Abramov) 0.1179660E-01 Vb(Abramov) -0.8903237E-02 Hb(Abramov) 0.2893366E-02 Ex_ueg -0.2204577E-02 Ec_ueg -0.4952501E-03 Delta_ex -0.2699785E-02 Delta_ec 0.3405644E-03 Delta_et -0.2905962E-02 Pxc 0.4451442E+01 Qxc -0.7927384E+01 3,+3 137 3 +1 0.168597 -2.942823 0.159666 Rho 0.5713089E-02 |GRAD(Rho)| 0.1970973E-15 GRAD(Rho)x 0.4706554E-16 GRAD(Rho)y 0.1841220E-15 GRAD(Rho)z 0.5226183E-16 Laplacian 0.2371237E-01 (-1/4)Del**2(Rho)) -0.5928094E-02 Diamond 0.6673218E-03 Metallicity 0.5305868E+00 Ellipticity -0.3903510E+01 Gb(Abramov) 0.4476290E-02 Vb(Abramov) -0.3024487E-02 Hb(Abramov) 0.1451803E-02 Ex_ueg -0.7543040E-03 Ec_ueg -0.1777278E-03 Delta_ex -0.1214460E-02 Delta_ec 0.7546705E-03 Delta_et -0.4262511E-02 Pxc 0.4244152E+01 Qxc -0.1609259E+01 3,+1 138 3 -1 3.013641 0.895033 -1.985267 Rho 0.1159105E+00 |GRAD(Rho)| 0.2553322E-13 GRAD(Rho)x -0.1064860E-13 GRAD(Rho)y 0.1105115E-13 GRAD(Rho)z 0.2040649E-13 Laplacian 0.4777198E+00 (-1/4)Del**2(Rho)) -0.1194300E+00 Diamond 0.7348583E+00 Metallicity 0.3974762E+01 Ellipticity 0.7218936E-02 Gb(Abramov) 0.1587376E+00 Vb(Abramov) -0.1980452E+00 Hb(Abramov) -0.3930763E-01 Ex_ueg -0.4173964E-01 Ec_ueg -0.6298547E-02 Delta_ex -0.4855158E-01 Delta_ec 0.1351266E-01 Delta_et -0.1735839E+00 Pxc 0.6626868E+01 Qxc -0.3593045E+01 3,-1 139 3 -1 -3.034254 0.871813 2.000695 Rho 0.1074844E+00 |GRAD(Rho)| 0.2025048E-13 GRAD(Rho)x -0.4363013E-14 GRAD(Rho)y 0.1867578E-13 GRAD(Rho)z -0.6500876E-14 Laplacian 0.4516117E+00 (-1/4)Del**2(Rho)) -0.1129029E+00 Diamond 0.6352157E+00 Metallicity 0.3707577E+01 Ellipticity 0.1312136E-01 Gb(Abramov) 0.1450347E+00 Vb(Abramov) -0.1771664E+00 Hb(Abramov) -0.3213174E-01 Ex_ueg -0.3774379E-01 Ec_ueg -0.5780617E-02 Delta_ex -0.4510944E-01 Delta_ec 0.1301546E-01 Delta_et -0.1648178E+00 Pxc 0.6529370E+01 Qxc -0.3465836E+01 3,-1 140 3 -1 -0.531110 -1.730502 -1.731454 Rho 0.4879381E-01 |GRAD(Rho)| 0.1653779E-15 GRAD(Rho)x -0.5952884E-16 GRAD(Rho)y 0.2494004E-16 GRAD(Rho)z 0.1522635E-15 Laplacian 0.1867569E+00 (-1/4)Del**2(Rho)) -0.4668924E-01 Diamond 0.8886794E-01 Metallicity 0.2404054E+01 Ellipticity 0.8360282E-02 Gb(Abramov) 0.4983340E-01 Vb(Abramov) -0.5297757E-01 Hb(Abramov) -0.3144165E-02 Ex_ueg -0.1316855E-01 Ec_ueg -0.2348309E-02 Delta_ex -0.1515748E-01 Delta_ec 0.5349952E-02 Delta_et -0.5599801E-01 Pxc 0.5607673E+01 Qxc -0.2833199E+01 3,-1 141 3 +3 0.002879 -2.312028 -0.005686 Rho 0.4730343E-02 |GRAD(Rho)| 0.3184146E-17 GRAD(Rho)x 0.2725694E-17 GRAD(Rho)y -0.1645725E-17 GRAD(Rho)z 0.3107277E-19 Laplacian 0.1970636E-01 (-1/4)Del**2(Rho)) -0.4926589E-02 Diamond 0.1740517E-03 Metallicity 0.4661166E+00 Ellipticity -0.3112245E+00 Gb(Abramov) 0.3667120E-02 Vb(Abramov) -0.2407651E-02 Hb(Abramov) 0.1259469E-02 Ex_ueg -0.5864648E-03 Ec_ueg -0.1353269E-03 Delta_ex -0.7169466E-03 Delta_ec 0.1698039E-03 Delta_et -0.1090219E-02 Pxc 0.4333690E+01 Qxc -0.4222203E+01 3,+3 142 3 +1 1.719259 1.739811 1.743102 Rho 0.1239262E-01 |GRAD(Rho)| 0.2084359E-14 GRAD(Rho)x 0.1553481E-14 GRAD(Rho)y -0.1388806E-14 GRAD(Rho)z -0.4970931E-16 Laplacian 0.6228817E-01 (-1/4)Del**2(Rho)) -0.1557204E-01 Diamond 0.2580816E-02 Metallicity 0.7341970E+00 Ellipticity -0.1245710E+01 Gb(Abramov) 0.1228685E-01 Vb(Abramov) -0.9001663E-02 Hb(Abramov) 0.3285190E-02 Ex_ueg -0.2118048E-02 Ec_ueg -0.4777237E-03 Delta_ex -0.3080193E-02 Delta_ec 0.7947715E-03 Delta_et -0.6016865E-02 Pxc 0.4433624E+01 Qxc -0.3875571E+01 3,+1 143 3 -1 0.528932 1.801800 2.779214 Rho 0.1397703E+00 |GRAD(Rho)| 0.4284540E-15 GRAD(Rho)x 0.2192663E-15 GRAD(Rho)y -0.3553066E-15 GRAD(Rho)z 0.9618906E-16 Laplacian 0.5854127E+00 (-1/4)Del**2(Rho)) -0.1463532E+00 Diamond 0.1094957E+01 Metallicity 0.4431075E+01 Ellipticity 0.1216871E-01 Gb(Abramov) 0.2056524E+00 Vb(Abramov) -0.2649517E+00 Hb(Abramov) -0.5929925E-01 Ex_ueg -0.5357204E-01 Ec_ueg -0.7791915E-02 Delta_ex -0.6184675E-01 Delta_ec 0.1521362E-01 Delta_et -0.2006666E+00 Pxc 0.6875336E+01 Qxc -0.4065223E+01 3,-1 144 3 -1 0.861240 2.000263 -3.061475 Rho 0.1681567E+00 |GRAD(Rho)| 0.3940335E-15 GRAD(Rho)x -0.3744021E-15 GRAD(Rho)y 0.5250249E-16 GRAD(Rho)z 0.1110359E-15 Laplacian 0.6516707E+00 (-1/4)Del**2(Rho)) -0.1629177E+00 Diamond 0.1519416E+01 Metallicity 0.5417208E+01 Ellipticity 0.3812861E-01 Gb(Abramov) 0.2557049E+00 Vb(Abramov) -0.3484922E+00 Hb(Abramov) -0.9278725E-01 Ex_ueg -0.6854947E-01 Ec_ueg -0.9615765E-02 Delta_ex -0.7203103E-01 Delta_ec 0.1613332E-01 Delta_et -0.2181433E+00 Pxc 0.7128863E+01 Qxc -0.4464736E+01 3,-1 145 3 -1 0.863444 -2.977267 1.989017 Rho 0.1387548E+00 |GRAD(Rho)| 0.1035629E-12 GRAD(Rho)x 0.2263345E-13 GRAD(Rho)y 0.7070219E-13 GRAD(Rho)z 0.7220942E-13 Laplacian 0.5526595E+00 (-1/4)Del**2(Rho)) -0.1381649E+00 Diamond 0.1024831E+01 Metallicity 0.4636985E+01 Ellipticity 0.3398537E-01 Gb(Abramov) 0.1988880E+00 Vb(Abramov) -0.2596111E+00 Hb(Abramov) -0.6072311E-01 Ex_ueg -0.5305372E-01 Ec_ueg -0.7727594E-02 Delta_ex -0.5828479E-01 Delta_ec 0.1439083E-01 Delta_et -0.1896085E+00 Pxc 0.6865490E+01 Qxc -0.4050134E+01 3,-1 146 3 +1 1.244502 -2.138349 1.195362 Rho 0.2705657E-01 |GRAD(Rho)| 0.3537584E-16 GRAD(Rho)x -0.5866192E-17 GRAD(Rho)y 0.2775227E-16 GRAD(Rho)z -0.2113881E-16 Laplacian 0.1050939E+00 (-1/4)Del**2(Rho)) -0.2627347E-01 Diamond 0.1550724E-01 Metallicity 0.1598909E+01 Ellipticity -0.4887433E+01 Gb(Abramov) 0.2451713E-01 Vb(Abramov) -0.2276078E-01 Hb(Abramov) 0.1756343E-02 Ex_ueg -0.5999044E-02 Ec_ueg -0.1192807E-02 Delta_ex -0.6693830E-02 Delta_ec 0.1815003E-02 Delta_et -0.1632663E-01 Pxc 0.5029352E+01 Qxc -0.3688055E+01 3,+1 147 3 -1 1.967018 -0.849535 2.977640 Rho 0.1439929E+00 |GRAD(Rho)| 0.3243625E-15 GRAD(Rho)x 0.2632172E-15 GRAD(Rho)y 0.1573042E-15 GRAD(Rho)z -0.1057504E-15 Laplacian 0.5684226E+00 (-1/4)Del**2(Rho)) -0.1421056E+00 Diamond 0.1100432E+01 Metallicity 0.4795607E+01 Ellipticity 0.4622636E-01 Gb(Abramov) 0.2083176E+00 Vb(Abramov) -0.2745295E+00 Hb(Abramov) -0.6621193E-01 Ex_ueg -0.5574079E-01 Ec_ueg -0.8060088E-02 Delta_ex -0.6047366E-01 Delta_ec 0.1463813E-01 Delta_et -0.1938814E+00 Pxc 0.6915655E+01 Qxc -0.4131242E+01 3,-1 148 3 -1 2.737887 1.807560 0.537000 Rho 0.1363258E+00 |GRAD(Rho)| 0.1335924E-15 GRAD(Rho)x 0.7345470E-17 GRAD(Rho)y 0.1947498E-16 GRAD(Rho)z -0.1319610E-15 Laplacian 0.5698733E+00 (-1/4)Del**2(Rho)) -0.1424683E+00 Diamond 0.1035710E+01 Metallicity 0.4366479E+01 Ellipticity 0.1132942E-01 Gb(Abramov) 0.1986597E+00 Vb(Abramov) -0.2548511E+00 Hb(Abramov) -0.5619138E-01 Ex_ueg -0.5181899E-01 Ec_ueg -0.7573998E-02 Delta_ex -0.5985617E-01 Delta_ec 0.1492563E-01 Delta_et -0.1961632E+00 Pxc 0.6841696E+01 Qxc -0.4010293E+01 3,-1 149 3 -1 -3.244238 -0.077273 3.239018 Rho 0.2199100E+00 |GRAD(Rho)| 0.9642076E-16 GRAD(Rho)x -0.8294147E-16 GRAD(Rho)y 0.1390489E-16 GRAD(Rho)z -0.4716279E-16 Laplacian 0.8217688E+00 (-1/4)Del**2(Rho)) -0.2054422E+00 Diamond 0.2608328E+01 Metallicity 0.6718494E+01 Ellipticity 0.2316192E-02 Gb(Abramov) 0.3670052E+00 Vb(Abramov) -0.5285681E+00 Hb(Abramov) -0.1615630E+00 Ex_ueg -0.9803439E-01 Ec_ueg -0.1306142E-01 Delta_ex -0.9700921E-01 Delta_ec 0.1853671E-01 Delta_et -0.2554157E+00 Pxc 0.7505647E+01 Qxc -0.5233356E+01 3,-1 150 3 -1 -3.230589 -0.004921 -3.235821 Rho 0.2185336E+00 |GRAD(Rho)| 0.1213022E-14 GRAD(Rho)x -0.9414127E-15 GRAD(Rho)y 0.1627387E-15 GRAD(Rho)z -0.7474490E-15 Laplacian 0.8288785E+00 (-1/4)Del**2(Rho)) -0.2072196E+00 Diamond 0.2602669E+01 Metallicity 0.6591525E+01 Ellipticity 0.2307462E-02 Gb(Abramov) 0.3657953E+00 Vb(Abramov) -0.5243710E+00 Hb(Abramov) -0.1585757E+00 Ex_ueg -0.9721709E-01 Ec_ueg -0.1296784E-01 Delta_ex -0.9763888E-01 Delta_ec 0.1863981E-01 Delta_et -0.2563896E+00 Pxc 0.7496785E+01 Qxc -0.5238191E+01 3,-1 151 3 -1 -0.852826 -2.048132 -3.037672 Rho 0.1525143E+00 |GRAD(Rho)| 0.4201365E-15 GRAD(Rho)x -0.3768145E-15 GRAD(Rho)y -0.1447545E-15 GRAD(Rho)z -0.1164975E-15 Laplacian 0.5953286E+00 (-1/4)Del**2(Rho)) -0.1488321E+00 Diamond 0.1234566E+01 Metallicity 0.5039345E+01 Ellipticity 0.2651759E-01 Gb(Abramov) 0.2242242E+00 Vb(Abramov) -0.2996162E+00 Hb(Abramov) -0.7539203E-01 Ex_ueg -0.6018189E-01 Ec_ueg -0.8604660E-02 Delta_ex -0.6423180E-01 Delta_ec 0.1510862E-01 Delta_et -0.2017427E+00 Pxc 0.6994105E+01 Qxc -0.4251335E+01 3,-1 152 3 -1 0.505318 -1.692574 1.710709 Rho 0.4726302E-01 |GRAD(Rho)| 0.2716600E-15 GRAD(Rho)x -0.1140778E-15 GRAD(Rho)y -0.1825153E-15 GRAD(Rho)z 0.1657516E-15 Laplacian 0.1797359E+00 (-1/4)Del**2(Rho)) -0.4493397E-01 Diamond 0.8203080E-01 Metallicity 0.2368722E+01 Ellipticity 0.7354760E-02 Gb(Abramov) 0.4769533E-01 Vb(Abramov) -0.5045669E-01 Hb(Abramov) -0.2761360E-02 Ex_ueg -0.1262061E-01 Ec_ueg -0.2264152E-02 Delta_ex -0.1447662E-01 Delta_ec 0.5161108E-02 Delta_et -0.5357854E-01 Pxc 0.5574101E+01 Qxc -0.2804945E+01 3,-1 153 3 -1 0.079268 -3.239685 -3.171116 Rho 0.2398628E+00 |GRAD(Rho)| 0.3513304E-10 GRAD(Rho)x 0.7084204E-11 GRAD(Rho)y -0.2558697E-10 GRAD(Rho)z -0.2300981E-10 Laplacian 0.8879455E+00 (-1/4)Del**2(Rho)) -0.2219864E+00 Diamond 0.3124157E+01 Metallicity 0.7186182E+01 Ellipticity 0.2500587E-02 Gb(Abramov) 0.4138634E+00 Vb(Abramov) -0.6057403E+00 Hb(Abramov) -0.1918770E+00 Ex_ueg -0.1100700E+00 Ec_ueg -0.1442963E-01 Delta_ex -0.1071908E+00 Delta_ec 0.1948477E-01 Delta_et -0.2693013E+00 Pxc 0.7628053E+01 Qxc -0.5501260E+01 3,-1 154 3 -1 -0.837949 -3.016998 -1.978725 Rho 0.1391844E+00 |GRAD(Rho)| 0.5209735E-15 GRAD(Rho)x -0.4896257E-15 GRAD(Rho)y -0.7415943E-16 GRAD(Rho)z 0.1618036E-15 Laplacian 0.5496170E+00 (-1/4)Del**2(Rho)) -0.1374042E+00 Diamond 0.1022599E+01 Metallicity 0.4686735E+01 Ellipticity 0.3659160E-01 Gb(Abramov) 0.1989324E+00 Vb(Abramov) -0.2604605E+00 Hb(Abramov) -0.6152814E-01 Ex_ueg -0.5327281E-01 Ec_ueg -0.7754794E-02 Delta_ex -0.5800326E-01 Delta_ec 0.1429340E-01 Delta_et -0.1883988E+00 Pxc 0.6869662E+01 Qxc -0.4058045E+01 3,-1 155 3 -1 -0.552879 -2.781243 1.792301 Rho 0.1521339E+00 |GRAD(Rho)| 0.2157495E-15 GRAD(Rho)x 0.5773377E-16 GRAD(Rho)y 0.6238228E-16 GRAD(Rho)z 0.1983006E-15 Laplacian 0.6368848E+00 (-1/4)Del**2(Rho)) -0.1592212E+00 Diamond 0.1312700E+01 Metallicity 0.4690967E+01 Ellipticity 0.1319302E-01 Gb(Abramov) 0.2306310E+00 Vb(Abramov) -0.3020409E+00 Hb(Abramov) -0.7140983E-01 Ex_ueg -0.5998184E-01 Ec_ueg -0.8580256E-02 Delta_ex -0.6863325E-01 Delta_ec 0.1610197E-01 Delta_et -0.2147657E+00 Pxc 0.6990683E+01 Qxc -0.4262413E+01 3,-1 156 3 -1 0.048048 3.208919 3.189263 Rho 0.2416698E+00 |GRAD(Rho)| 0.1499243E-13 GRAD(Rho)x -0.1024620E-13 GRAD(Rho)y -0.1085503E-13 GRAD(Rho)z 0.1398838E-14 Laplacian 0.8849192E+00 (-1/4)Del**2(Rho)) -0.2212298E+00 Diamond 0.3150292E+01 Metallicity 0.7301522E+01 Ellipticity 0.3167561E-02 Gb(Abramov) 0.4167056E+00 Vb(Abramov) -0.6121813E+00 Hb(Abramov) -0.1954758E+00 Ex_ueg -0.1111770E+00 Ec_ueg -0.1455462E-01 Delta_ex -0.1070803E+00 Delta_ec 0.1945528E-01 Delta_et -0.2693147E+00 Pxc 0.7638605E+01 Qxc -0.5503922E+01 3,-1 157 3 +1 -2.206470 0.986243 1.451710 Rho 0.2658426E-01 |GRAD(Rho)| 0.1143691E-12 GRAD(Rho)x -0.1034583E-12 GRAD(Rho)y -0.2010717E-13 GRAD(Rho)z 0.4441137E-13 Laplacian 0.1024998E+00 (-1/4)Del**2(Rho)) -0.2562496E-01 Diamond 0.1050761E-01 Metallicity 0.1591955E+01 Ellipticity -0.1776505E+01 Gb(Abramov) 0.2388227E-01 Vb(Abramov) -0.2213958E-01 Hb(Abramov) 0.1742689E-02 Ex_ueg -0.5859822E-02 Ec_ueg -0.1168805E-02 Delta_ex -0.6072192E-02 Delta_ec 0.1010117E-02 Delta_et -0.9187239E-02 Pxc 0.5013515E+01 Qxc -0.6011373E+01 3,+1 158 3 -1 -0.045633 -3.202980 3.178414 Rho 0.2401762E+00 |GRAD(Rho)| 0.6355970E-15 GRAD(Rho)x 0.1318390E-15 GRAD(Rho)y 0.5669293E-15 GRAD(Rho)z -0.2553296E-15 Laplacian 0.8868291E+00 (-1/4)Del**2(Rho)) -0.2217073E+00 Diamond 0.3127016E+01 Metallicity 0.7210906E+01 Ellipticity 0.1724897E-02 Gb(Abramov) 0.4142566E+00 Vb(Abramov) -0.6068059E+00 Hb(Abramov) -0.1925493E+00 Ex_ueg -0.1102618E+00 Ec_ueg -0.1445129E-01 Delta_ex -0.1071026E+00 Delta_ec 0.1947054E-01 Delta_et -0.2691950E+00 Pxc 0.7629890E+01 Qxc -0.5500748E+01 3,-1 159 3 -1 0.520255 2.761888 1.800885 Rho 0.1408937E+00 |GRAD(Rho)| 0.3908318E-09 GRAD(Rho)x -0.2541173E-09 GRAD(Rho)y -0.8200354E-10 GRAD(Rho)z 0.2853932E-09 Laplacian 0.5939976E+00 (-1/4)Del**2(Rho)) -0.1484994E+00 Diamond 0.1117987E+01 Metallicity 0.4425691E+01 Ellipticity 0.1023919E-01 Gb(Abramov) 0.2085350E+00 Vb(Abramov) -0.2685706E+00 Hb(Abramov) -0.6003562E-01 Ex_ueg -0.5414693E-01 Ec_ueg -0.7863153E-02 Delta_ex -0.6283531E-01 Delta_ec 0.1533396E-01 Delta_et -0.2023478E+00 Pxc 0.6886160E+01 Qxc -0.4097787E+01 3,-1 160 3 -1 0.832371 2.981335 -2.004546 Rho 0.1317598E+00 |GRAD(Rho)| 0.2160427E-15 GRAD(Rho)x 0.2088851E-15 GRAD(Rho)y 0.1076748E-16 GRAD(Rho)z 0.5408814E-16 Laplacian 0.5204615E+00 (-1/4)Del**2(Rho)) -0.1301154E+00 Diamond 0.9069569E+00 Metallicity 0.4517129E+01 Ellipticity 0.3327569E-01 Gb(Abramov) 0.1847016E+00 Vb(Abramov) -0.2392878E+00 Hb(Abramov) -0.5458621E-01 Ex_ueg -0.4951789E-01 Ec_ueg -0.7286312E-02 Delta_ex -0.5420600E-01 Delta_ec 0.1372185E-01 Delta_et -0.1793250E+00 Pxc 0.6796015E+01 Qxc -0.3950342E+01 3,-1 161 3 -1 -0.117429 2.895630 0.112064 Rho 0.6056257E-02 |GRAD(Rho)| 0.6980798E-17 GRAD(Rho)x -0.5737404E-17 GRAD(Rho)y -0.2404647E-18 GRAD(Rho)z -0.3969372E-17 Laplacian 0.2519131E-01 (-1/4)Del**2(Rho)) -0.6297827E-02 Diamond 0.8268599E-03 Metallicity 0.5504312E+00 Ellipticity 0.1674085E+02 Gb(Abramov) 0.4776305E-02 Vb(Abramov) -0.3254782E-02 Hb(Abramov) 0.1521522E-02 Ex_ueg -0.8153126E-03 Ec_ueg -0.1926473E-03 Delta_ex -0.1348284E-02 Delta_ec 0.8788147E-03 Delta_et -0.5021189E-02 Pxc 0.4232152E+01 Qxc -0.1534207E+01 3,-1 162 3 -1 -0.086861 3.188250 -3.189776 Rho 0.2399173E+00 |GRAD(Rho)| 0.1086653E-14 GRAD(Rho)x -0.2409368E-15 GRAD(Rho)y 0.7388838E-15 GRAD(Rho)z -0.7594836E-15 Laplacian 0.8968728E+00 (-1/4)Del**2(Rho)) -0.2242182E+00 Diamond 0.3149584E+01 Metallicity 0.7117349E+01 Ellipticity 0.3308763E-02 Gb(Abramov) 0.4154520E+00 Vb(Abramov) -0.6066858E+00 Hb(Abramov) -0.1912338E+00 Ex_ueg -0.1101033E+00 Ec_ueg -0.1443340E-01 Delta_ex -0.1082384E+00 Delta_ec 0.1961424E-01 Delta_et -0.2708034E+00 Pxc 0.7628373E+01 Qxc -0.5518360E+01 3,-1 163 3 -1 1.994402 0.892238 -3.038395 Rho 0.1073704E+00 |GRAD(Rho)| 0.1349910E-13 GRAD(Rho)x 0.7765923E-14 GRAD(Rho)y -0.9767469E-14 GRAD(Rho)z 0.5149059E-14 Laplacian 0.4471842E+00 (-1/4)Del**2(Rho)) -0.1117961E+00 Diamond 0.6285338E+00 Metallicity 0.3737672E+01 Ellipticity 0.5428570E-02 Gb(Abramov) 0.1441735E+00 Vb(Abramov) -0.1765510E+00 Hb(Abramov) -0.3237749E-01 Ex_ueg -0.3769045E-01 Ec_ueg -0.5773650E-02 Delta_ex -0.4466163E-01 Delta_ec 0.1290056E-01 Delta_et -0.1633413E+00 Pxc 0.6528012E+01 Qxc -0.3461991E+01 3,-1 164 3 -1 3.190431 -3.194524 -0.048575 Rho 0.2406651E+00 |GRAD(Rho)| 0.2617905E-15 GRAD(Rho)x -0.5507747E-16 GRAD(Rho)y -0.2555465E-15 GRAD(Rho)z -0.1402687E-16 Laplacian 0.8835866E+00 (-1/4)Del**2(Rho)) -0.2208967E+00 Diamond 0.3126982E+01 Metallicity 0.7261938E+01 Ellipticity 0.2115255E-02 Gb(Abramov) 0.4146207E+00 Vb(Abramov) -0.6083448E+00 Hb(Abramov) -0.1937241E+00 Ex_ueg -0.1105611E+00 Ec_ueg -0.1448510E-01 Delta_ex -0.1067877E+00 Delta_ec 0.1942326E-01 Delta_et -0.2687170E+00 Pxc 0.7632749E+01 Qxc -0.5497928E+01 3,-1 165 3 -1 -1.988125 -0.949461 -3.051991 Rho 0.1232115E+00 |GRAD(Rho)| 0.2492609E-15 GRAD(Rho)x -0.9195390E-16 GRAD(Rho)y 0.2121242E-15 GRAD(Rho)z 0.9316007E-16 Laplacian 0.5058431E+00 (-1/4)Del**2(Rho)) -0.1264608E+00 Diamond 0.8353765E+00 Metallicity 0.4156068E+01 Ellipticity 0.1756125E-01 Gb(Abramov) 0.1719038E+00 Vb(Abramov) -0.2173468E+00 Hb(Abramov) -0.4544301E-01 Ex_ueg -0.4528142E-01 Ec_ueg -0.6751428E-02 Delta_ex -0.5212891E-01 Delta_ec 0.1406238E-01 Delta_et -0.1826046E+00 Pxc 0.6706939E+01 Qxc -0.3706975E+01 3,-1 166 3 -1 -1.997519 0.862196 3.030141 Rho 0.1161914E+00 |GRAD(Rho)| 0.2220284E-15 GRAD(Rho)x -0.1062789E-15 GRAD(Rho)y 0.1847616E-15 GRAD(Rho)z -0.6216544E-16 Laplacian 0.4804315E+00 (-1/4)Del**2(Rho)) -0.1201079E+00 Diamond 0.7397837E+00 Metallicity 0.3968303E+01 Ellipticity 0.5750326E-02 Gb(Abramov) 0.1595093E+00 Vb(Abramov) -0.1989108E+00 Hb(Abramov) -0.3940144E-01 Ex_ueg -0.4187456E-01 Ec_ueg -0.6315901E-02 Delta_ex -0.4883532E-01 Delta_ec 0.1354689E-01 Delta_et -0.1740503E+00 Pxc 0.6630021E+01 Qxc -0.3604909E+01 3,-1 167 3 -1 -1.716581 1.666393 0.496008 Rho 0.7507720E-01 |GRAD(Rho)| 0.1668200E-15 GRAD(Rho)x 0.1526286E-15 GRAD(Rho)y 0.4531287E-16 GRAD(Rho)z -0.4980130E-16 Laplacian 0.2850774E+00 (-1/4)Del**2(Rho)) -0.7126934E-01 Diamond 0.2414913E+00 Metallicity 0.3229713E+01 Ellipticity 0.1837974E-01 Gb(Abramov) 0.8587614E-01 Vb(Abramov) -0.1004829E+00 Hb(Abramov) -0.1460680E-01 Ex_ueg -0.2339174E-01 Ec_ueg -0.3841972E-02 Delta_ex -0.2579141E-01 Delta_ec 0.8035549E-02 Delta_et -0.9356001E-01 Pxc 0.6088472E+01 Qxc -0.3209664E+01 3,-1 168 3 -1 -1.773725 2.695108 -0.536537 Rho 0.1637150E+00 |GRAD(Rho)| 0.4849352E-13 GRAD(Rho)x -0.4568988E-13 GRAD(Rho)y 0.1144157E-13 GRAD(Rho)z 0.1153892E-13 Laplacian 0.7080587E+00 (-1/4)Del**2(Rho)) -0.1770147E+00 Diamond 0.1574609E+01 Metallicity 0.4768242E+01 Ellipticity 0.2192104E-01 Gb(Abramov) 0.2586846E+00 Vb(Abramov) -0.3403545E+00 Hb(Abramov) -0.8166990E-01 Ex_ueg -0.6614594E-01 Ec_ueg -0.9327179E-02 Delta_ex -0.7753089E-01 Delta_ec 0.1726906E-01 Delta_et -0.2317465E+00 Pxc 0.7091741E+01 Qxc -0.4489583E+01 3,-1 169 3 -1 -0.565406 -1.821119 2.806973 Rho 0.1560220E+00 |GRAD(Rho)| 0.4211695E-12 GRAD(Rho)x 0.3044575E-12 GRAD(Rho)y -0.2861799E-12 GRAD(Rho)z -0.5282491E-13 Laplacian 0.6523774E+00 (-1/4)Del**2(Rho)) -0.1630943E+00 Diamond 0.1384675E+01 Metallicity 0.4776292E+01 Ellipticity 0.7942074E-02 Gb(Abramov) 0.2385606E+00 Vb(Abramov) -0.3140268E+00 Hb(Abramov) -0.7546625E-01 Ex_ueg -0.6203446E-01 Ec_ueg -0.8830119E-02 Delta_ex -0.7072920E-01 Delta_ec 0.1636723E-01 Delta_et -0.2189905E+00 Pxc 0.7025325E+01 Qxc -0.4321392E+01 3,-1 170 3 -1 3.126561 3.219843 0.059026 Rho 0.2402374E+00 |GRAD(Rho)| 0.3529964E-14 GRAD(Rho)x -0.2479787E-14 GRAD(Rho)y -0.2339383E-14 GRAD(Rho)z -0.9157443E-15 Laplacian 0.8901706E+00 (-1/4)Del**2(Rho)) -0.2225427E+00 Diamond 0.3137238E+01 Metallicity 0.7186888E+01 Ellipticity 0.3082596E-02 Gb(Abramov) 0.4149266E+00 Vb(Abramov) -0.6073106E+00 Hb(Abramov) -0.1923840E+00 Ex_ueg -0.1102992E+00 Ec_ueg -0.1445552E-01 Delta_ex -0.1074999E+00 Delta_ec 0.1951848E-01 Delta_et -0.2697534E+00 Pxc 0.7630248E+01 Qxc -0.5507594E+01 3,-1 171 3 -1 -3.148882 3.166714 -0.081979 Rho 0.1562059E+00 |GRAD(Rho)| 0.2623094E-14 GRAD(Rho)x 0.2029545E-14 GRAD(Rho)y -0.1500726E-14 GRAD(Rho)z 0.7137167E-15 Laplacian 0.6030019E+00 (-1/4)Del**2(Rho)) -0.1507505E+00 Diamond 0.1312127E+01 Metallicity 0.5177539E+01 Ellipticity 0.1176285E+00 Gb(Abramov) 0.2305864E+00 Vb(Abramov) -0.3104223E+00 Hb(Abramov) -0.7983593E-01 Ex_ueg -0.6213193E-01 Ec_ueg -0.8841956E-02 Delta_ex -0.6568233E-01 Delta_ec 0.1563687E-01 Delta_et -0.2105071E+00 Pxc 0.7026945E+01 Qxc -0.4200477E+01 3,-1 172 3 -1 0.559148 -1.834584 -2.799261 Rho 0.1564684E+00 |GRAD(Rho)| 0.9311804E-15 GRAD(Rho)x 0.7888113E-15 GRAD(Rho)y 0.4789734E-15 GRAD(Rho)z -0.1243309E-15 Laplacian 0.6494209E+00 (-1/4)Del**2(Rho)) -0.1623552E+00 Diamond 0.1381219E+01 Metallicity 0.4820936E+01 Ellipticity 0.1011686E-01 Gb(Abramov) 0.2386875E+00 Vb(Abramov) -0.3150198E+00 Hb(Abramov) -0.7633228E-01 Ex_ueg -0.6227121E-01 Ec_ueg -0.8858863E-02 Delta_ex -0.7044034E-01 Delta_ec 0.1624908E-01 Delta_et -0.2174123E+00 Pxc 0.7029255E+01 Qxc -0.4335034E+01 3,-1 173 3 -1 0.852146 -1.976743 2.987274 Rho 0.1353977E+00 |GRAD(Rho)| 0.4120990E-14 GRAD(Rho)x -0.3196065E-14 GRAD(Rho)y -0.2179639E-14 GRAD(Rho)z -0.1420176E-14 Laplacian 0.5319160E+00 (-1/4)Del**2(Rho)) -0.1329790E+00 Diamond 0.9599795E+00 Metallicity 0.4625114E+01 Ellipticity 0.3096489E-01 Gb(Abramov) 0.1911598E+00 Vb(Abramov) -0.2493407E+00 Hb(Abramov) -0.5818084E-01 Ex_ueg -0.5134919E-01 Ec_ueg -0.7515417E-02 Delta_ex -0.5579022E-01 Delta_ec 0.1397797E-01 Delta_et -0.1835574E+00 Pxc 0.6832514E+01 Qxc -0.3991295E+01 3,-1 174 3 -1 1.807852 -0.590343 -2.800237 Rho 0.1179710E+00 |GRAD(Rho)| 0.1678757E-15 GRAD(Rho)x 0.1181509E-15 GRAD(Rho)y 0.1191674E-15 GRAD(Rho)z 0.4662069E-17 Laplacian 0.5128093E+00 (-1/4)Del**2(Rho)) -0.1282023E+00 Diamond 0.8077111E+00 Metallicity 0.3813138E+01 Ellipticity 0.1674446E-01 Gb(Abramov) 0.1669437E+00 Vb(Abramov) -0.2056852E+00 Hb(Abramov) -0.3874142E-01 Ex_ueg -0.4273187E-01 Ec_ueg -0.6425980E-02 Delta_ex -0.5236122E-01 Delta_ec 0.1449574E-01 Delta_et -0.1868992E+00 Pxc 0.6649861E+01 Qxc -0.3612181E+01 3,-1 175 3 -1 2.740490 0.569679 1.774373 Rho 0.1449830E+00 |GRAD(Rho)| 0.1356785E-13 GRAD(Rho)x -0.2083870E-14 GRAD(Rho)y -0.8783732E-14 GRAD(Rho)z 0.1012867E-13 Laplacian 0.6117318E+00 (-1/4)Del**2(Rho)) -0.1529330E+00 Diamond 0.1190644E+01 Metallicity 0.4507273E+01 Ellipticity 0.1371008E-01 Gb(Abramov) 0.2168404E+00 Vb(Abramov) -0.2807478E+00 Hb(Abramov) -0.6390743E-01 Ex_ueg -0.5625241E-01 Ec_ueg -0.8123130E-02 Delta_ex -0.6515467E-01 Delta_ec 0.1566333E-01 Delta_et -0.2075295E+00 Pxc 0.6924967E+01 Qxc -0.4159695E+01 3,-1 176 3 -1 -2.809785 -0.609626 1.815603 Rho 0.1188924E+00 |GRAD(Rho)| 0.5614922E-13 GRAD(Rho)x 0.9699137E-14 GRAD(Rho)y 0.3621910E-13 GRAD(Rho)z 0.4179519E-13 Laplacian 0.5164809E+00 (-1/4)Del**2(Rho)) -0.1291202E+00 Diamond 0.8196617E+00 Metallicity 0.3835447E+01 Ellipticity 0.1698714E-01 Gb(Abramov) 0.1686191E+00 Vb(Abramov) -0.2081180E+00 Hb(Abramov) -0.3949888E-01 Ex_ueg -0.4317749E-01 Ec_ueg -0.6483067E-02 Delta_ex -0.5281264E-01 Delta_ec 0.1453780E-01 Delta_et -0.1876567E+00 Pxc 0.6660041E+01 Qxc -0.3632781E+01 3,-1 177 3 -1 -1.965023 2.938499 0.861352 Rho 0.1324062E+00 |GRAD(Rho)| 0.2462492E-13 GRAD(Rho)x -0.1142384E-13 GRAD(Rho)y -0.1064120E-13 GRAD(Rho)z -0.1904331E-13 Laplacian 0.5235688E+00 (-1/4)Del**2(Rho)) -0.1308922E+00 Diamond 0.9113153E+00 Metallicity 0.4527100E+01 Ellipticity 0.3350165E-01 Gb(Abramov) 0.1860218E+00 Vb(Abramov) -0.2411514E+00 Hb(Abramov) -0.5512961E-01 Ex_ueg -0.4984209E-01 Ec_ueg -0.7326960E-02 Delta_ex -0.5451832E-01 Delta_ec 0.1365242E-01 Delta_et -0.1783012E+00 Pxc 0.6802560E+01 Qxc -0.3993309E+01 3,-1 178 3 -1 0.566345 -2.789222 -1.793902 Rho 0.1299840E+00 |GRAD(Rho)| 0.1159599E-15 GRAD(Rho)x 0.1088403E-15 GRAD(Rho)y 0.2294782E-16 GRAD(Rho)z -0.3277001E-16 Laplacian 0.5471142E+00 (-1/4)Del**2(Rho)) -0.1367785E+00 Diamond 0.9396140E+00 Metallicity 0.4200993E+01 Ellipticity 0.8694235E-02 Gb(Abramov) 0.1869533E+00 Vb(Abramov) -0.2371281E+00 Hb(Abramov) -0.5017477E-01 Ex_ueg -0.4863010E-01 Ec_ueg -0.7174800E-02 Delta_ex -0.5681553E-01 Delta_ec 0.1450639E-01 Delta_et -0.1892247E+00 Pxc 0.6777903E+01 Qxc -0.3916587E+01 3,-1 179 3 -1 -3.633685 4.267066 -0.802952 Rho 0.3337758E+00 |GRAD(Rho)| 0.9640732E-15 GRAD(Rho)x 0.4767264E-15 GRAD(Rho)y -0.6465424E-15 GRAD(Rho)z 0.5330590E-15 Laplacian -0.1768920E+01 (-1/4)Del**2(Rho)) 0.4422299E+00 Diamond 0.6363609E+01 Metallicity -0.6256478E+01 Ellipticity 0.4515614E-03 Gb(Abramov) 0.1663136E+00 Vb(Abramov) -0.7748571E+00 Hb(Abramov) -0.6085435E+00 Ex_ueg -0.1709982E+00 Ec_ueg -0.2116338E-01 Delta_ex 0.1795667E+00 Delta_ec 0.6086807E-01 Delta_et -0.1473252E+01 Pxc 0.8079910E+01 Qxc 0.2950097E+01 3,-1 180 3 -1 -2.804324 0.518370 -1.807896 Rho 0.1049197E+00 |GRAD(Rho)| 0.1627939E-14 GRAD(Rho)x 0.3942904E-15 GRAD(Rho)y -0.8755339E-15 GRAD(Rho)z -0.1314595E-14 Laplacian 0.4564490E+00 (-1/4)Del**2(Rho)) -0.1141122E+00 Diamond 0.6321596E+00 Metallicity 0.3523568E+01 Ellipticity 0.1635997E-02 Gb(Abramov) 0.1430885E+00 Vb(Abramov) -0.1720648E+00 Hb(Abramov) -0.2897630E-01 Ex_ueg -0.3654779E-01 Ec_ueg -0.5624022E-02 Delta_ex -0.4547523E-01 Delta_ec 0.1347000E-01 Delta_et -0.1700655E+00 Pxc 0.6498515E+01 Qxc -0.3376039E+01 3,-1 181 3 -1 -2.772649 1.736001 -0.544162 Rho 0.1739859E+00 |GRAD(Rho)| 0.9696189E-14 GRAD(Rho)x 0.8680543E-14 GRAD(Rho)y -0.4273247E-14 GRAD(Rho)z 0.6353154E-15 Laplacian 0.7268436E+00 (-1/4)Del**2(Rho)) -0.1817109E+00 Diamond 0.1742511E+01 Metallicity 0.5140780E+01 Ellipticity 0.2487603E-01 Gb(Abramov) 0.2768299E+00 Vb(Abramov) -0.3719489E+00 Hb(Abramov) -0.9511898E-01 Ex_ueg -0.7173600E-01 Ec_ueg -0.9996252E-02 Delta_ex -0.8083931E-01 Delta_ec 0.1750149E-01 Delta_et -0.2366330E+00 Pxc 0.7176290E+01 Qxc -0.4618995E+01 3,-1 182 3 -1 2.804908 -1.809384 -0.555788 Rho 0.1571831E+00 |GRAD(Rho)| 0.1172251E-14 GRAD(Rho)x -0.1025655E-15 GRAD(Rho)y -0.5893181E-15 GRAD(Rho)z 0.1008145E-14 Laplacian 0.6565368E+00 (-1/4)Del**2(Rho)) -0.1641342E+00 Diamond 0.1404607E+01 Metallicity 0.4805044E+01 Ellipticity 0.8962991E-02 Gb(Abramov) 0.2408681E+00 Vb(Abramov) -0.3176021E+00 Hb(Abramov) -0.7673393E-01 Ex_ueg -0.6265076E-01 Ec_ueg -0.8904913E-02 Delta_ex -0.7129805E-01 Delta_ec 0.1641813E-01 Delta_et -0.2198292E+00 Pxc 0.7035528E+01 Qxc -0.4342641E+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 79 152 169 155 173 145 158 140 172 178 151 154 153 93 82 76 144 160 162 79 143 159 124 77 156 134 182 133 132 131 164 104 148 105 107 106 170 167 181 168 125 177 171 57 62 67 58 66 56 119 180 122 116 165 150 121 176 117 139 166 149 94 175 130 109 147 111 112 108 174 138 163 113 128 127 89 126 161 135 179 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 25 26 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 27 28 54 2.406887 1.899216 1.907647 1.965351 1.954957 1.743121 2.392948 1.898806 1.968927 1.918668 1.954595 1.743611 2.357414 1.885504 2.023820 1.880561 1.976194 1.743255 2.448837 1.940676 1.937921 1.905210 1.931610 1.740874 2.440197 1.896495 1.909330 1.964796 1.950265 1.742451 2.390090 1.950763 1.944052 1.905536 1.931349 1.742973 2.209862 1.858030 1.879160 1.886650 1.976372 1.908595 2.397379 1.901202 1.973112 1.907121 1.959163 1.743686 2.396552 2.047692 2.012045 2.012304 1.995818 1.779638 2.466700 1.998842 1.985904 2.045928 2.018391 1.777623 2.359863 1.926021 1.932494 1.937579 1.940640 1.742118 2.420595 1.990600 2.001777 2.020093 2.048655 1.780255 1.648168 1.644771 1.647395 1.665609 3.198647 3.231435 0.978723 2.407587 1.899481 1.908020 1.965915 1.955487 1.743127 2.393613 1.899105 1.969296 1.919110 1.955191 1.743620 2.358110 1.885829 2.024047 1.880938 1.976798 1.743263 2.449313 1.941091 1.938342 1.905710 1.932009 1.740883 2.440753 1.896799 1.909701 1.965334 1.950805 1.742457 2.390807 1.951132 1.944468 1.905989 1.931906 1.742984 2.210400 1.858392 1.879703 1.887231 1.976945 1.909869 2.398090 1.901498 1.973471 1.907585 1.959722 1.743695 2.397470 2.047842 2.012296 2.012700 1.996189 1.779646 2.467445 1.999095 1.986156 2.046131 2.018790 1.777625 2.360578 1.926458 1.932863 1.938098 1.941166 1.742129 2.421364 1.990849 2.002031 2.020418 2.048980 1.780259 1.648177 1.644771 1.647402 1.665684 3.215656 3.238595 0.978933 27 23 23 25 23 21 27 23 25 23 25 21 27 25 26 23 29 23 27 25 28 24 25 23 28 25 23 23 23 21 27 23 26 23 25 23 25 23 24 24 25 23 27 23 23 25 23 23 28 24 24 24 24 22 29 25 25 24 25 22 27 25 23 23 23 26 27 23 25 29 24 22 21 20 21 22 35 35 20 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 W W W W W W W W Ta Ta W Ta O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O Si H 2.4742 2.4652 2.4725 2.4642 2.4652 2.4707 2.6095 2.4667 2.2543 2.2500 2.4794 2.2498 -1.1608 -1.1646 -1.1684 -1.1686 -0.9788 -0.9758 -0.9411 -0.9622 -0.9777 -0.9630 -0.9748 -0.9773 -0.9435 -0.9644 -0.9642 -0.9644 -0.9732 -0.9866 -0.9862 -0.9681 -0.9736 -0.9778 -0.9869 -0.9909 -0.9787 -0.9697 -0.9808 -0.9737 -0.8066 -0.8078 -0.8019 -0.8013 -0.8062 -0.8040 -0.7524 -0.8084 -0.8984 -0.8991 -0.7983 -0.9043 2.4761 0.2867 2.0994 2.1079 2.1051 2.0976 2.1010 2.1033 2.0928 2.1078 2.1052 2.1063 2.0981 2.1088 1.8940 1.8931 1.8933 1.8974 1.9304 1.9310 1.9382 1.9320 1.9307 1.9319 1.9313 1.9309 1.9385 1.9321 1.9318 1.9319 1.9420 1.9404 1.9404 1.9450 1.9420 1.9430 1.9398 1.9401 1.9412 1.9432 1.9415 1.9420 1.9639 1.9638 1.9645 1.9649 1.9643 1.9638 1.8776 1.9637 1.9476 1.9484 1.9644 1.9470 2.3037 0.6074 6.0967 6.0996 6.0958 6.0976 6.1000 6.0960 6.0873 6.0989 6.0728 6.0729 6.0934 6.0735 5.2383 5.2431 5.2466 5.2413 5.0208 5.0165 4.9732 5.0003 5.0194 5.0012 5.0155 5.0180 4.9747 5.0025 5.0030 5.0026 4.9991 5.0158 5.0157 4.9926 4.9997 5.0037 5.0171 5.0203 5.0064 4.9945 5.0077 4.9998 4.8080 4.8094 4.8026 4.8014 4.8070 4.8054 4.8431 4.8101 4.9223 4.9220 4.7989 4.9291 6.6286 0.1059 3.2997 3.2976 3.2969 3.3109 3.3039 3.3001 3.1786 3.2969 2.5332 2.5365 3.2993 2.5334 0.0285 0.0283 0.0284 0.0299 0.0276 0.0284 0.0296 0.0298 0.0276 0.0299 0.0280 0.0284 0.0303 0.0298 0.0294 0.0299 0.0321 0.0305 0.0302 0.0305 0.0319 0.0311 0.0301 0.0305 0.0311 0.0320 0.0316 0.0318 0.0347 0.0346 0.0348 0.0351 0.0348 0.0347 0.0317 0.0346 0.0284 0.0287 0.0349 0.0283 0.5916 0.0000 14.0299 14.0298 14.0297 14.0298 14.0298 14.0298 14.0318 14.0297 14.0345 14.0344 14.0300 14.0345 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 Ta Ta W Ta O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O Si H 2.515003 2.513801 2.511948 2.510445 2.512113 2.515507 2.557665 2.513586 2.377297 2.372557 2.520277 2.375497 -1.069806 -1.074204 -1.073052 -1.061433 -0.987527 -0.983949 -0.951266 -0.964552 -0.987535 -0.965097 -0.981582 -0.983921 -0.938742 -0.967600 -0.967020 -0.967652 -0.955185 -0.975634 -0.976136 -0.949984 -0.955491 -0.965435 -0.977913 -0.977558 -0.963543 -0.955065 -0.961390 -0.957937 -0.842241 -0.844234 -0.835642 -0.836404 -0.841266 -0.840174 -0.563043 -0.844966 -0.967061 -0.967787 -0.832866 -0.975407 1.768068 0.123532 1.935198 1.938478 1.939465 1.931467 1.934024 1.935527 1.840834 1.938559 1.859240 1.854563 1.936791 1.855761 -0.751926 -0.757166 -0.757329 -0.726926 -0.753419 -0.751766 -0.706443 -0.720458 -0.753881 -0.719195 -0.749385 -0.752302 -0.673715 -0.724148 -0.715930 -0.723523 -0.787443 -0.816521 -0.818512 -0.767290 -0.788843 -0.811060 -0.818647 -0.817780 -0.789751 -0.765217 -0.787724 -0.790046 -0.748984 -0.750829 -0.735994 -0.740358 -0.746874 -0.746312 -0.740834 -0.751649 -0.887180 -0.888442 -0.739399 -0.898332 1.359721 0.411910 2.039646 2.043111 2.036883 2.032897 2.038060 2.038971 2.038192 2.042698 1.964296 1.956934 2.041613 1.961509 -0.815785 -0.819010 -0.813339 -0.793111 -0.834708 -0.827437 -0.798065 -0.798406 -0.832898 -0.798103 -0.827575 -0.828832 -0.773524 -0.802193 -0.797390 -0.801201 -0.819849 -0.846021 -0.848993 -0.801714 -0.821156 -0.835624 -0.853159 -0.848472 -0.828517 -0.812836 -0.826538 -0.828219 -0.713871 -0.716087 -0.704127 -0.706823 -0.711969 -0.712878 -0.735389 -0.717412 -0.863818 -0.865907 -0.704393 -0.875198 1.300754 0.424986 -2.81861971 8.67431798 1.34875149 9.21995336 -8.38096162 -29.43796876 21.90889367 35.72224758 -9.90506171 -27.34128597 -406.7640 423.3049 -34.4432 -423.4476 -42.7466 -484.0965 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 0 Apr27-2024 21:13:09 Nodes: 1 Procs: 1 Apr27-2024 21:13:10 Nodes: 1 Procs: 1 Silicon (TZP, 1s frozen) 0 Apr27-2024 21:13:10 Nodes: 1 Procs: 1 Apr27-2024 21:13:12 Nodes: 1 Procs: 1 Tantalum (TZP, 4d frozen) 0 Apr27-2024 21:13:13 Nodes: 1 Procs: 1 Apr27-2024 21:13:13 Nodes: 1 Procs: 1 Oxygen (TZP, 1s frozen) 0 Apr27-2024 21:13:14 Nodes: 1 Procs: 1 Apr27-2024 21:13:15 Nodes: 1 Procs: 1 Tungsten (TZP, 4d frozen) 0 Apr27-2024 21:13:17 Nodes: 1 Procs: 24 *** (NO TITLE) *** -6 -17.29705050 -17.66266479 -17.68225046 -17.77619065 -17.78437784 -17.78660660 -17.78752009 -17.78883865 -17.78910118 -17.78950432 -17.78968145 -17.78978255 -17.78985111 -17.78989716 -17.78993072 -17.78997456 -17.79001016 -17.79006253 -17.79011239 -17.79017149 -17.79019746 -17.79020741 -17.79021091 -17.79021776 GEOMETRY CONVERGED