64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=170.2967488043016 stress="-799.6734480696823 -156.09551219055533 -338.4740332506363 -156.09551219055533 -855.2032945547845 17.16715677818013 -338.4740332506363 17.16715677818013 -723.9839918311834" pbc="F F F" Fe 0.22086729 -0.01689004 -0.22903346 -1.83319979 -1.15139697 -1.64499670 Fe 1.59933616 0.93572417 0.98055861 -31.79700884 -43.08074472 16.24904009 Fe 2.14715992 2.22516294 0.23402360 -5.94277099 16.25188112 -70.25090234 Fe 2.93229823 3.31172061 1.19084223 29.85456716 41.62511761 35.79095429 Fe 2.29465675 -0.06841967 2.44481085 8.42838968 -13.43811724 18.85793640 Fe 3.85840215 0.76443239 3.74197382 0.31816551 1.29084250 0.11531837 Fe 0.01305245 3.37091231 3.11880303 -20.94957417 -17.44190993 -22.27876707 Fe 1.55604684 4.07636534 3.99475015 27.41142701 84.90342209 -62.77827270 Fe 5.37367246 0.41590283 0.08987003 0.00728705 0.77260658 0.19145583 Fe 6.81595901 1.02721648 1.76701063 -28.37559485 21.04949615 -34.75151486 Fe 7.56413860 2.42957765 -0.13579737 -17.41954960 -16.97608855 -15.11838905 Fe 8.67982227 3.56376137 0.86736005 16.60735240 16.65208287 15.10631975 Fe 7.81964364 0.29825864 2.98568119 -30.32654329 -53.74362635 -8.13381899 Fe 8.94092265 0.91364046 3.80687150 63.76396851 27.07495419 38.91699856 Fe 5.13099466 2.64804974 2.21116107 -36.42542708 -24.70751253 -35.40811852 Fe 6.21146060 3.40281203 3.27636527 34.83959708 25.34281220 35.78865882 Fe 0.19056740 4.70676063 0.45558802 -0.11375974 -1.47326620 -0.38979423 Fe 1.49928622 5.79692580 1.73410168 -9.87602554 6.94355206 -5.93981371 Fe 2.49728798 7.21972589 0.09651729 -2.72627685 -2.93762090 -3.39972520 Fe 3.61643991 8.32327578 1.40123177 -67.79489589 45.92053946 -44.37710048 Fe 2.95366604 4.88968876 2.71888199 -29.98444075 -36.76325930 -18.29719617 Fe 4.18297782 5.79320854 3.39174556 44.95351524 32.52070315 23.56876524 Fe 0.30609528 7.83814538 2.63905551 -13.29167425 -18.73536996 -32.82820121 Fe 0.90975672 8.66349090 4.11824152 13.79413033 18.48539850 33.21604116 Fe 5.42288064 4.99707792 -0.22400553 -0.09934051 -0.56250864 0.51006201 Fe 6.60365422 6.12475624 1.46651109 -33.74448513 36.26661385 -30.64770586 Fe 6.67119966 8.29253646 -0.21778446 -0.16641560 -0.48213843 0.98218505 Fe 8.57559210 8.55058575 1.17451505 -0.83405265 -0.64438708 -0.07279278 Fe 7.58087455 5.09122498 2.35935114 33.73464714 -35.57088868 30.82968422 Fe 8.97462727 6.11272182 3.87984742 -0.06914153 -0.01860607 0.36199222 Fe 4.66448343 7.68403127 2.11226018 70.33098526 -42.96086446 46.81147831 Fe 5.97555741 8.31914392 3.89352680 -47.74892235 17.53824232 -27.64241197 Fe -0.22954640 0.28866239 4.68786656 -10.49145561 -9.95092690 -5.67571342 Fe 1.11803101 1.55239207 5.36469048 -5.04441807 -15.47831869 18.54646200 Fe 2.00297454 2.99791377 4.62151619 56.65095836 -69.70573110 41.64913571 Fe 3.55150311 3.51894432 6.34725891 -18.16027093 -23.63607239 18.67020894 Fe 2.43970136 0.30962604 7.02044147 -3.70572179 0.77420785 2.55282524 Fe 4.08450338 0.75571598 8.58475277 -22.06338131 -27.51454303 18.27212959 Fe -0.00344088 2.96978731 7.51668654 -20.10525546 -15.57188317 -17.68782143 Fe 1.22422232 3.91950201 8.54655608 -19.69646718 -20.72990724 40.76075356 Fe 4.08532250 0.00206044 5.83625574 4.05587436 -0.53783649 -1.81094296 Fe 6.48837336 1.00831489 6.43404765 -39.64175865 65.21674514 -34.38521993 Fe 7.84911873 2.25854751 4.84542229 -16.33586905 -13.43154615 -14.31934013 Fe 8.60556472 3.49425818 6.03735392 11.66204704 19.11689421 18.28864413 Fe 7.20384740 -0.14918067 7.03810700 40.39262491 -65.18168343 34.24286795 Fe 8.63411590 0.94480194 8.75181405 -0.71674681 0.10598505 -0.73009038 Fe 5.09980901 2.00409575 7.77385137 2.08078533 0.84550894 -39.53104690 Fe 5.97078520 3.24032483 8.75401561 19.15439127 27.63332847 21.39845068 Fe 0.09263645 4.62936138 4.65540456 -48.29035214 26.51503287 32.27542404 Fe 0.43781512 6.81416538 5.78912195 0.43068163 -0.24892884 -0.22308177 Fe 2.82350393 7.21827495 4.80335328 -24.81946110 -33.08825513 -32.84069983 Fe 3.63834321 8.28337470 5.87827378 24.57870996 32.69780715 32.66587605 Fe 2.36102597 4.94186987 7.87644269 40.26148575 36.73102960 -24.21770183 Fe 4.65391855 6.03411984 8.38544395 -15.71380240 -24.08865387 26.81948313 Fe 0.04351831 8.23553491 7.63970276 0.28756005 -0.02884384 0.10913703 Fe 1.97419286 8.97675809 8.59647343 0.21390747 -0.37040645 -0.62881404 Fe 4.50493887 4.74812168 5.36805486 16.72661772 21.95257617 -18.74255632 Fe 5.89974943 6.22892384 6.12165250 33.14510047 -55.94724602 -65.66971675 Fe 7.34497277 7.80178516 4.71375535 47.73312459 -17.96677125 29.17187160 Fe 8.72557247 8.55011602 6.91154804 -0.96080195 -0.67339035 0.77792324 Fe 7.61642137 4.97690407 7.58223207 -0.85011348 0.52318854 0.25049666 Fe 8.93333148 6.38215830 8.97076095 -0.40855715 0.58240079 -0.79430476 Fe 5.39757659 7.11536967 7.13716159 -15.33469173 80.33867680 38.60782602 Fe 6.59856987 9.06168698 8.85549530 0.44032291 -0.83239591 -1.13983362