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=-44.0392793893 stress="-2.8799351630682803 0.17778842142290402 -0.12165472927275973 0.17778842142290402 -3.160959445148378 -0.6180671818844117 -0.12165472927275973 -0.6180671818844117 -3.0807292697570547" pbc="F F F" N -0.11090311 0.13714415 0.07420351 -2.81630045 -19.21419418 -20.86737967 N 1.70960170 1.21726994 0.13708343 -13.32257178 9.14264802 -8.53263914 N 1.28829595 -0.10654689 1.64041416 1.75399687 -15.01612720 -12.54692031 N -0.02117016 1.22221844 1.22919618 -3.59326812 20.64794351 16.91334484 N 2.87679405 -0.04105180 0.20052938 14.28774289 -11.70168831 -2.30244776 N 4.57505321 1.20865944 -0.14996450 -1.03026956 -4.15147197 0.46677493 N 4.38972740 0.22277084 1.68584377 -4.59736695 -24.38296630 -31.81649157 N 3.18362810 1.69581920 1.64685009 0.64305635 -24.10619759 -18.24350502 N 0.14752770 2.89530619 -0.14514920 0.83891579 1.62390671 0.73321107 N 1.70996341 4.49207130 0.15300231 -4.47157550 6.26698077 -22.99932277 N 1.53848316 2.95774659 1.41852158 -17.73863209 -11.90647256 -3.65124695 N 0.20413434 4.53128084 1.12540496 -11.49085076 -0.58807046 2.78149688 N 3.19178619 3.17895518 0.29140871 -7.51681697 -3.39921391 -38.29297276 N 4.72498218 4.53253581 0.35851813 0.56155729 -1.27687016 0.21805656 N 4.28091226 3.10609294 1.46603997 34.12618322 7.25655901 10.11406921 N 2.66110875 4.32157598 1.51361598 14.44869408 25.15639151 20.98750154 N -0.09520581 -0.11098575 2.90985417 -6.88292126 -3.71542960 4.24925057 N 1.30986677 1.10077702 2.99451428 3.25089313 12.82065308 -0.13099007 N 1.25175979 -0.00370518 4.37656677 9.88574027 -21.03454315 12.90357639 N 0.08417477 1.24396547 4.40499636 -18.34559977 8.85924225 5.78927974 N 3.26064027 -0.06618674 3.13132919 4.75546729 -10.91326967 4.19207718 N 4.75978669 1.22592512 2.78504734 14.36054322 17.43540205 30.55235075 N 4.71643430 0.10260697 4.45709467 -2.39451640 1.77009243 -3.44833664 N 2.75683077 1.23028762 4.48810560 -0.67376851 0.21007373 8.82881242 N 0.23171545 3.37600563 2.82183498 -26.41480438 -10.12508980 -4.45692438 N 1.54315750 4.42485375 3.12990665 15.91663237 23.88730610 2.92554663 N 1.28220450 3.28278197 4.56210000 16.66699266 -23.81995842 10.40536155 N 0.13362859 4.32702941 4.45235627 -23.55227726 21.02657134 0.09639807 N 2.98153066 2.77475981 2.91561068 -0.10025978 15.14064611 23.25992068 N 4.41358041 4.32141592 2.84231696 4.82187096 13.34556737 -3.97252100 N 4.29869006 3.33628438 4.26735611 10.93594098 -10.33685798 9.27755760 N 2.83533445 4.24148635 4.58611608 -2.31242781 11.09843728 6.56711144