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:forces:R:3 energy=145.89156517437922 stress="-371.01513056794244 4.644866071640315 0.23750514846962645 4.644866071640315 -375.05920446183126 0.3906912697814846 0.23750514846962645 0.3906912697814846 -322.29898503512663" pbc="F F F" S -0.25354363 -0.01806569 -0.12537193 -3.03706376 -2.31768135 -1.94562467 S 1.70070203 1.20342959 -0.09914834 -20.91385351 13.55846246 -21.11672135 S 1.49793547 0.28187239 1.51001192 -16.91470130 -16.35774925 8.08376719 S -0.01546661 1.67498057 1.57783088 -11.97211639 -3.18873962 -1.74621151 S 2.71904386 0.00082602 0.24624097 18.96582966 -30.57091439 -13.10869600 S 4.64302402 1.48460093 0.11042859 7.16890534 -1.23332570 -9.68235672 S 4.70947124 -0.14487149 1.42706573 5.77120709 -11.63189282 -3.22693117 S 2.91333883 1.34655491 1.37241235 10.53415848 8.47041147 9.01410980 S -0.17769156 3.06769566 -0.27713580 -4.78129213 -2.37420112 -4.75866672 S 1.43858073 4.25205420 0.15488783 -6.36878678 7.17757706 -10.25369242 S 1.55988540 2.70245745 1.66431082 -2.32993894 4.40787415 -0.27981958 S -0.18574270 4.48844065 1.53277713 -5.10659272 7.94668862 -2.82467978 S 2.89971974 2.63930982 -0.03902326 4.81448623 6.45626869 -12.91608017 S 4.28219307 4.71813893 -0.23283931 4.64583108 2.55323663 -4.33221632 S 4.69410236 2.71604098 1.67969651 11.12602031 3.91982834 -5.71356784 S 2.91574283 4.22002482 1.13762093 5.70279523 9.62338469 2.63907806 S -0.08338442 -0.03487808 3.22586561 -13.22707676 -10.29473701 -9.21207884 S 1.79391194 1.22614529 3.19192756 -1.16980294 20.02622414 -14.62177357 S 1.27761356 0.18220204 4.39362841 4.08446984 -23.89456476 26.32969751 S 0.23573857 1.52724172 4.27538150 -19.87884532 13.73315398 9.64095609 S 2.70296332 -0.15112699 3.19094416 12.80718128 -24.31608337 -3.41999956 S 4.28984966 1.18955749 2.64055036 6.03830925 1.60591594 9.69245476 S 4.40698366 0.18107110 4.32825321 8.24540693 -7.07591019 6.52404372 S 2.98643909 1.49912398 4.76120756 4.78968066 -1.35905245 11.94987241 S 0.01193751 3.25226748 2.96431997 -6.98502807 -2.01879000 4.65040706 S 1.80631839 4.57236142 3.05217434 -5.95949178 12.77135684 0.85884632 S 1.73854596 2.76922180 4.28229695 -3.03286762 12.77135188 9.51314282 S 0.02031036 4.68745344 4.52015752 -1.92745581 3.30826185 4.29044930 S 3.08976132 3.27711528 2.87871118 -16.64861483 -25.38616650 7.40459548 S 4.25213077 4.23125112 2.71824351 29.77792487 28.60850759 0.49820187 S 4.63616082 2.76429260 4.62968218 5.78925664 1.22457694 2.80673609 S 3.43192259 4.79977655 4.68543805 -0.00793422 3.85672725 5.26275774