32 Lattice="5.2986602783203125 0.0 0.0 0.0 5.2986602783203125 0.0 0.0 0.0 5.2986602783203125" Properties=species:S:1:pos:R:3:forces:R:3 energy=-20.8376912816 stress="-1.30021179846108 -0.0056606866908180216 -0.040668924165519954 -0.0056606866908180216 -1.1507511893544167 -0.27545659295946395 -0.040668924165519954 -0.27545659295946395 -1.7514441059090406" pbc="F F F" C -0.12049575 0.09262900 0.12011745 0.77884836 0.22260269 -1.24174913 C 1.49933315 1.16752716 -0.13472070 4.77185340 4.18448847 -10.65595431 C 1.16990283 -0.13741853 1.44167687 -2.48899492 -10.81820282 7.41749756 C 0.06406340 1.34032245 1.18161883 -1.32891165 5.65763378 -1.39154201 C 2.35741661 -0.13345828 0.05330042 -0.85686870 2.38749140 4.54960091 C 4.02819628 1.13051072 -0.12713631 0.12188684 3.51311923 0.47948893 C 3.73069924 0.18564236 1.47953488 -1.26760680 -12.56157192 -23.28048160 C 2.80235356 1.48784774 1.61429184 -10.24661951 -7.70133146 -1.95466679 C -0.02248030 2.79621541 -0.12336645 -0.89722298 -2.65321332 2.92863614 C 1.49963458 3.96738796 0.12750193 -6.34656558 1.22070593 -3.83406504 C 1.35673437 2.61411896 1.49166004 -0.99995624 -5.99309184 -6.04887403 C -0.02674560 3.86798705 1.21809610 -1.30688246 2.22713459 -1.65438119 C 2.80915196 2.79845946 0.24284059 -4.92899949 -16.65194477 -21.21841792 C 3.96773458 4.00110839 -0.10992437 1.04688541 1.66420779 -0.91550825 C 3.79142209 2.73842927 1.29636505 22.31962137 -3.12063133 1.82291347 C 2.48764701 3.82530852 1.33601172 0.07867884 19.22498071 5.00726153 C -0.12334412 0.18493032 2.70207953 -5.32299838 -3.65613504 -4.33409417 C 1.27254375 1.14005555 2.64475871 7.92514306 5.73908434 -5.05743094 C 1.19238857 -0.01297415 3.82122968 5.29261119 -3.57534149 4.07283045 C 0.02524378 1.28586233 3.92888485 0.75906261 7.44444420 2.24132585 C 2.87616316 -0.05515562 2.75877113 -10.19551271 -3.84913776 8.56707848 C 4.19048412 1.09626934 2.47020292 14.18012587 10.94209710 11.95428765 C 4.12704285 0.16907269 4.08752891 -3.29819178 2.44768593 -1.71630345 C 2.47920850 1.28141052 4.15811597 4.32636624 0.69976572 -1.24329382 C 0.19309621 2.80091620 2.50085929 -9.58854726 -5.31820201 1.08091894 C 1.42927454 3.91137333 2.75758568 3.42449073 9.96957715 -7.02447677 C 1.14316882 2.88498178 4.02574521 4.25937832 -17.77809232 10.20657007 C 0.11135716 3.82985305 4.03261546 -11.86110138 9.31890574 3.98137593 C 2.68976742 2.69494263 2.45113480 -7.53834275 -0.96590578 9.52987295 C 3.98151896 3.74658585 2.47240234 6.75665483 6.76559337 2.96469152 C 3.57529043 2.74134578 3.78012530 2.55379974 -5.16458045 7.04096705 C 2.51210884 3.70738444 4.04575861 -0.12208422 6.17786417 7.72592200