83 lines
5.0 KiB
Plaintext
83 lines
5.0 KiB
Plaintext
$energy SCF SCFKIN SCFPOT
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1 -5679.424654107 5613.178932317 -11292.60358642
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2 -5679.520015420 5612.724895424 -11292.24491084
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3 -5679.672734720 5612.145994741 -11291.81872946
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4 -5679.776115066 5611.817974367 -11291.59408943
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5 -5679.833011837 5611.602749973 -11291.43576181
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6 -5679.858272254 5611.402024489 -11291.26029674
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7 -5679.871370932 5611.326861699 -11291.19823263
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8 -5679.880611748 5611.297975273 -11291.17858702
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9 -5679.887977451 5611.297894442 -11291.18587189
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10 -5679.893973946 5611.292441328 -11291.18641527
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11 -5679.898563054 5611.275532399 -11291.17409545
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12 -5679.901939978 5611.273758829 -11291.17569881
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13 -5679.895513013 5611.448356114 -11291.34386913
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14 -5679.899011351 5611.371731081 -11291.27074243
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15 -5679.902738366 5611.270256055 -11291.17299442
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16 -5679.905434053 5611.255887875 -11291.16132193
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17 -5679.906687708 5611.228975563 -11291.13566327
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18 -5679.908246931 5611.216830118 -11291.12507705
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19 -5679.908631269 5611.231252481 -11291.13988375
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20 -5679.909382978 5611.245130374 -11291.15451335
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21 -5679.909676466 5611.232970427 -11291.14264689
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22 -5679.910289636 5611.233826676 -11291.14411631
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23 -5679.910408807 5611.237480125 -11291.14788893
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24 -5679.910996478 5611.237984468 -11291.14898095
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25 -5679.911453220 5611.232326036 -11291.14377926
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26 -5679.912118583 5611.237288439 -11291.14940702
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27 -5679.912807928 5611.241366459 -11291.15417439
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28 -5679.913586654 5611.244587593 -11291.15817425
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29 -5679.914420683 5611.246397746 -11291.16081843
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30 -5679.915235943 5611.244572995 -11291.15980894
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31 -5679.916099584 5611.246094871 -11291.16219446
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32 -5679.916894995 5611.254457395 -11291.17135239
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33 -5679.917533402 5611.259140337 -11291.17667374
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34 -5679.918072161 5611.263000820 -11291.18107298
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35 -5679.918464420 5611.272734476 -11291.19119890
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36 -5679.918717947 5611.280051987 -11291.19876993
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37 -5679.918819691 5611.275078435 -11291.19389813
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38 -5679.918867330 5611.275466584 -11291.19433391
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39 -5679.918925058 5611.281963944 -11291.20088900
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40 -5679.919043234 5611.278692973 -11291.19773621
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41 -5679.919223236 5611.281098541 -11291.20032178
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42 -5679.919457515 5611.286684295 -11291.20614181
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43 -5679.919869114 5611.301002810 -11291.22087192
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44 -5679.920478849 5611.308392381 -11291.22887123
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45 -5679.921066813 5611.316207288 -11291.23727410
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46 -5679.921910286 5611.310943802 -11291.23285409
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47 -5679.922658936 5611.291067709 -11291.21372665
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48 -5679.923178356 5611.284065150 -11291.20724351
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49 -5679.923390957 5611.281572608 -11291.20496356
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50 -5679.923469100 5611.281074254 -11291.20454335
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51 -5679.923498782 5611.283800768 -11291.20729955
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52 -5679.923507831 5611.284714106 -11291.20822194
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53 -5679.923513222 5611.283650192 -11291.20716341
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54 -5679.923517354 5611.282534962 -11291.20605232
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55 -5679.923518996 5611.282138794 -11291.20565779
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56 -5679.923519357 5611.282391708 -11291.20591106
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57 -5679.923520031 5611.282709614 -11291.20622965
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58 -5679.923520152 5611.283122912 -11291.20664306
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59 -5679.923520255 5611.283341456 -11291.20686171
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60 -5679.923521010 5611.283543746 -11291.20706476
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61 -5679.923521773 5611.283450510 -11291.20697228
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62 -5679.923522689 5611.283101293 -11291.20662398
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63 -5679.923524176 5611.282891312 -11291.20641549
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64 -5679.923525775 5611.282487835 -11291.20601361
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65 -5679.923528717 5611.282482941 -11291.20601166
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66 -5679.923532540 5611.282660982 -11291.20619352
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67 -5679.923535464 5611.283120766 -11291.20665623
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68 -5679.923542108 5611.283930816 -11291.20747292
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69 -5679.923545424 5611.284096933 -11291.20764236
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70 -5679.923549174 5611.283755028 -11291.20730420
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71 -5679.923550672 5611.283220776 -11291.20677145
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72 -5679.923551098 5611.283020557 -11291.20657166
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73 -5679.923550836 5611.282941899 -11291.20649274
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74 -5679.923550704 5611.282914276 -11291.20646498
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75 -5679.923550705 5611.282914340 -11291.20646504
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76 -5679.923550753 5611.282986211 -11291.20653696
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77 -5679.923550881 5611.282975675 -11291.20652656
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78 -5679.923550993 5611.282946880 -11291.20649787
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79 -5679.923550945 5611.282915552 -11291.20646650
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80 -5679.923551004 5611.282890448 -11291.20644145
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$end
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