64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2781697.3617187194 stress="-36.41621287443575 0.28464927808397306 -21.975407101215104 0.28464927808397306 -18.811649304509995 13.543237374531257 -21.975407101215104 13.543237374531257 -42.52837954652483" pbc="F F F" Re 35.23653224 35.08315257 34.87569893 -261.87567554 -190.62919195 -340.98524228 Re 36.51936703 36.02449794 36.54001962 8549.75095116 -8537.99703210 -9237.13628028 Re 37.17908957 37.71157000 35.27283623 -44.36330453 444.33139224 -683.05850263 Re 38.87125129 38.89261866 36.33602252 -3404.16791638 -1493.65610320 1369.55081796 Re 37.65437440 34.72468445 37.60480834 1589.43076642 -1818.67985159 1487.67457712 Re 39.24904131 36.95710423 38.32658108 -5255.69853794 -3074.76232209 2258.00900903 Re 35.43343693 37.08788852 37.46245662 -10190.78057417 9843.06384587 8557.56572133 Re 37.15372048 38.73974981 38.31515254 1465.83494412 -10970.51830976 4989.05369282 Re 39.79657103 34.88384600 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35.69489011 35.45709667 39.79022815 -385.10385113 -362.00048307 -414.55370172 Re 36.99349978 36.65681990 41.17704934 117.19762894 7.94093213 599.20478307 Re 38.34923422 38.15141258 40.11139891 -2104208.52177678 -1918727.29335641 -1130435.22860200 Re 39.16887189 38.89873103 40.55192554 1836341.51701835 1584918.61732754 1346966.08638259 Re 38.11663760 34.67685978 42.77201407 461.96872035 -17909.84163489 -11366.19120017 Re 38.07967910 36.14960744 43.70728992 -932.70554810 17499.35663626 11649.38624704 Re 35.19040632 37.70053348 42.73098293 -547.27661296 -834.05022015 -381.98658391 Re 36.20585275 39.43165245 43.56680203 -2412.59162226 -489.79446161 3537.10897543 Re 40.32350133 34.72491237 39.82913040 -20.28354270 -38.71801562 -44.46189432 Re 41.14472040 36.57210020 41.47623656 179.01046306 -70.89849539 -756.27410730 Re 42.62868859 38.10229843 39.79776302 116500.87946924 -38409.79140015 66286.65114126 Re 43.20097884 39.39296385 41.77238571 103977.17612536 -47406.26981742 -189110.81871102 Re 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9177.93149673 Re 39.93821974 39.85665093 39.93252582 266555.27161151 333269.82566645 -216218.96933455 Re 40.83754919 41.53135297 40.74173604 11641.09991503 -9326.40104463 -34356.20908456 Re 42.19174022 42.90146522 39.66558217 9574452.12705134 -7406483.96356582 12882657.66009275 Re 43.39534190 43.55366389 41.11999025 2100.76004910 1127.34053570 2550.94674304 Re 42.51373892 39.70601702 43.02200692 3311575.23509328 1390021.05217907 -2298697.78708114 Re 44.03160460 41.01466651 43.32695832 2223.83303139 2030.34075542 596.86329591 Re 40.35553523 41.98270291 42.27219172 -10570.69847882 10862.58750033 35118.02381587 Re 41.50486689 43.82148178 43.51651766 61.95683638 92.54012795 59.29686924