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=3.37829872445 stress="-0.4021774738031941 0.01200106326197847 -0.3869383077471485 0.01200106326197847 -0.4608031897786012 -0.08075927557083623 -0.3869383077471485 -0.08075927557083623 -0.5747208809258152" pbc="F F F" Fe 0.22086729 -0.01689004 -0.22903346 -2.88369953 -2.86805996 -3.91303771 Fe 1.15142137 0.93572417 0.98055861 -11.05140905 -31.79634198 18.60521235 Fe 1.67756578 2.22516294 0.46095830 13.34053298 35.03243253 -13.57624762 Fe 2.98736736 3.99745172 1.33024966 -1.22958746 -2.29705409 -7.30488208 Fe 2.79428433 0.24064375 2.76200555 -5.56111613 -2.88251519 -3.78789077 Fe 3.98053443 1.09759444 3.74185685 5.19958954 4.61925544 4.27630112 Fe -0.09128290 2.48069883 2.61819962 1.28622575 0.37706292 -0.06996855 Fe 1.55604684 4.07636534 3.99475015 -41.85063658 96.40571481 -55.07802686 Fe 5.94546432 0.26499873 0.04153483 -87.15710995 -68.53721728 -143.36524627 Fe 6.55012441 0.74045746 1.03426861 84.95177917 64.76315010 145.72760661 Fe 7.32316245 2.26153012 0.30145827 0.93165957 3.91212478 -1.98854568 Fe 8.42712388 3.91385061 1.22088890 0.37653381 -0.45783580 -1.27676023 Fe 7.73578848 0.79150318 3.24752218 -56.06143599 -14.66601124 -35.34868391 Fe 8.92497022 1.06567967 3.95948504 68.99129784 -4.15610848 22.05586204 Fe 5.03690210 2.71350978 2.13730575 -4.88654552 -4.60579799 -9.61439027 Fe 5.80220443 3.42873123 3.46341174 6.57051977 3.33598099 6.85017465 Fe -0.17375207 4.49365118 0.42673195 -6.62041505 -7.75424638 -6.08485033 Fe 0.82447290 5.48365875 1.32972720 8.04898015 6.82144336 7.00207754 Fe 2.04272155 7.62085647 -0.28414312 -0.06232215 -0.54276558 0.73417027 Fe 3.61643991 8.32327578 1.40123177 -46.98121574 28.00792279 -31.08729625 Fe 3.28818839 4.60398937 2.96422878 -4.61110416 -9.21640967 2.90796663 Fe 4.18297782 5.94224761 3.32018597 8.15338321 11.28541490 3.52283517 Fe 0.76542829 7.36017393 3.00132959 0.37270487 -5.62352855 -2.67920649 Fe 0.55316969 9.00322643 3.77198524 -0.67997392 4.36694247 3.51055015 Fe 4.93977516 5.30385587 0.12891241 -0.87549855 -0.31171983 0.39700555 Fe 6.36106461 6.11123760 1.57455603 0.67189273 0.68888117 0.51511641 Fe 6.88067518 8.00165966 0.05288706 -1.70232401 -0.45980382 -0.03061886 Fe 8.81264009 8.18215902 0.91806716 0.33166901 -0.70061848 0.91762261 Fe 7.78147506 5.01841245 2.77341645 -0.69300610 -0.68675369 1.88501616 Fe 8.57808511 6.50549627 3.97718991 1.25880957 -0.96483287 0.86621159 Fe 4.66448343 7.68403127 2.11226018 47.15227564 -27.06866868 30.82535231 Fe 6.29254616 8.65043916 4.07488203 -40.69496386 27.01676593 -25.17351503 Fe 0.27699059 0.21050145 4.62953716 -4.19864173 -2.94761751 -11.18809906 Fe 0.94678843 0.72658758 6.06886405 4.69304720 4.92706500 9.56400899 Fe 2.00297454 2.99791377 4.62151619 39.42154214 -96.56872304 55.94050626 Fe 3.64802863 3.07540258 6.48895769 -0.05648142 -0.47412783 -0.18538220 Fe 2.18748376 -0.01855355 7.64172697 1.52818189 0.09005761 0.67560022 Fe 4.46083802 0.63682131 8.89947205 -2.43279015 -6.37316644 2.74996794 Fe -0.00417630 3.04168674 7.43055625 1.22649238 0.12564217 -0.97948355 Fe 1.65722822 3.86395605 8.99895428 -1.80737672 -3.12747327 5.90676939 Fe 4.36999540 0.17369092 5.82305440 -0.63319484 0.43598944 1.28611042 Fe 6.48837336 1.00831489 6.43404765 -17.87585976 31.49978398 -16.09102485 Fe 8.03275711 2.13385079 4.66573727 -14.16458562 19.20165478 12.63091850 Fe 8.58393954 3.40855627 6.35140552 -1.77406111 0.65724377 1.69182397 Fe 7.20384740 -0.14918067 7.03810700 18.56114695 -29.87158787 16.18449819 Fe 8.93198955 1.32292046 8.95586308 -0.62611084 0.01785305 -0.86409670 Fe 5.01031963 2.06828052 8.02356789 -7.58783041 -21.66032500 -11.82502499 Fe 5.52035194 3.44622535 8.45042604 9.61964324 28.46712396 5.69376205 Fe -0.34252132 4.58933233 5.40322283 0.69421092 0.08284007 0.40257157 Fe 0.59473158 7.04704731 5.65653406 1.02066600 0.16634581 0.28459431 Fe 2.52734501 7.69262016 4.39246191 -77.49179932 -24.01831140 -115.42229708 Fe 3.25121736 7.91196948 5.44518862 78.86206941 23.40651974 115.45321712 Fe 2.24767421 4.65425516 7.53554739 0.54779424 2.48881033 -7.46146621 Fe 3.75553025 5.99180786 8.33433472 1.39671474 -0.26790378 0.09584620 Fe -0.30519708 8.18717081 7.48215882 0.26009564 0.11011554 -0.72410322 Fe 1.85171399 8.99595574 8.67278496 -0.21314941 -0.92281714 -1.41139822 Fe 4.85798705 4.40315209 4.92208795 -1.06290602 -0.08758929 3.31852794 Fe 5.89974943 6.22892384 6.12165250 19.08410571 -34.05673046 -41.17282441 Fe 7.34497277 7.92270812 4.73257588 38.88106110 -26.65737945 26.73073728 Fe 8.64260964 8.84306647 6.60697114 -0.87038747 -1.16986554 0.58624477 Fe 7.26459378 5.20201412 7.51948547 -1.13289175 3.11707541 -0.16924841 Fe 8.87725473 6.77735174 8.86983378 -1.18748148 0.37752632 -1.60727140 Fe 5.39757659 7.11536967 7.13716159 -17.27400978 33.93390043 40.74664868 Fe 6.49947850 8.65939049 8.93558996 0.55729640 -1.93873201 -1.06054776