32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=45498.59207434089 pbc="F F F" Ir -0.19209658 0.01803379 0.26211066 77 -5151.25694745 -924.19973523 -5597.44490458 Ir 1.59205092 1.88953245 -0.00025825 77 -11476.99196360 -3184.91114961 -9166.59369259 Ir 1.13057441 -0.06095721 1.42766633 77 9640.59645523 -4256.38844227 1717.43512091 Ir 0.06251963 1.36918146 1.63854536 77 -3307.19775691 5989.26965697 527.78778859 Ir 2.71848022 -0.18238300 -0.11335113 77 125.92649937 -404.35374771 -471.00087046 Ir 4.72061273 1.27332474 -0.24218489 77 85.95434077 280.85959475 -321.54942483 Ir 4.55524643 -0.16681009 1.36314542 77 90.41946392 -304.07932200 322.94790470 Ir 2.69508126 1.53251372 1.22988746 77 8526.28265555 -3819.38635737 8519.14302199 Ir -0.26580609 3.00702289 -0.16064617 77 -382.00839160 132.24225722 -114.41711628 Ir 1.70748563 4.45924974 -0.24790376 77 -17250.92926343 21174.42597463 -4993.97176030 Ir 1.62969923 3.09788417 1.70385435 77 -1151.87852240 -7012.01630999 -5985.70852723 Ir 0.35195002 4.64895035 1.48023402 77 -5612.16008585 2364.45164522 -6316.55567166 Ir 2.70183975 3.25645612 0.01745870 77 21581.44502245 -15963.14051311 3230.95048604 Ir 4.34617674 4.48248962 -0.07316430 77 853.58477856 525.93751032 -382.12150722 Ir 4.59229402 2.92634292 1.74900804 77 1161.46228191 -2323.57642469 -3023.55144275 Ir 3.16403691 4.53610988 1.75717001 77 -20421.72360693 4516.94965175 -20551.62336054 Ir -0.14409959 -0.24898510 2.78031369 77 -2414.72489784 -1559.22145489 2665.12179182 Ir 1.10658350 1.78335910 3.34869440 77 12613.19114841 1721.26238505 -24067.14016196 Ir 1.46942388 0.24272239 4.25372983 77 -4038.20355088 -4699.47344323 8828.90875895 Ir 0.03157905 1.31432410 4.42692655 77 -21191.05980468 -4484.25795097 17895.41182476 Ir 2.77562150 -0.03041403 3.21404146 77 8382.78116080 -2410.13577378 -7299.26254176 Ir 4.20869931 1.56324656 3.12341994 77 1188.75142268 -7088.17277862 -10184.61791005 Ir 4.66624111 -0.26429019 4.37409014 77 326.11019968 -290.24179815 222.07892497 Ir 3.29620016 1.59586490 4.62211698 77 -4382.47646636 -834.95389699 6766.70954897 Ir -0.04087781 3.49008256 3.15528481 77 -14318.14544546 -15064.55585009 -23291.20404164 Ir 1.45792216 4.40054034 2.80321583 77 3734.38712719 13284.49804785 8366.77486962 Ir 1.76963501 3.08123101 4.21094857 77 -21016.76307957 -7797.16998246 27226.79162070 Ir 0.42540062 4.17619570 4.49682001 77 2661.18012248 16858.22036870 26937.03559547 Ir 2.88354605 3.37123106 3.15814615 77 19484.86205766 -16869.42977960 -51389.24439702 Ir 4.39256392 4.46620551 2.74945998 77 23519.99164740 3335.19683044 18696.85577474 Ir 4.74010443 2.84483315 4.15782291 77 4921.69835299 6289.53355442 5014.37948822 Ir 3.16215359 4.05411402 4.51345606 77 13216.89504591 22816.81723344 36217.67481045