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=-58.4225832077 stress="-0.16604675895824192 0.015188152883455389 -0.1380550433907744 0.015188152883455389 -0.03732088145146584 -0.08578811139971586 -0.1380550433907744 -0.08578811139971586 -0.21115703650241652" pbc="F F F" Be -0.11090311 0.11115480 0.11044915 -0.88128839 -1.19968693 -2.07991002 Be 1.70960170 1.31143450 -0.16166483 -2.93710835 4.01204284 0.39141032 Be 1.28829595 -0.13891288 1.36371066 0.57083328 -0.08933073 1.26106923 Be -0.22187219 1.51878885 1.29209888 0.96101630 -0.09073773 2.11061402 Be 2.87679405 -0.04105180 0.10842934 1.63838672 -1.57084546 0.06464030 Be 4.56504129 1.20865944 -0.13449789 -1.09566203 3.30411703 1.58116000 Be 4.28802619 0.22277084 1.68584377 -0.21656979 -5.49059646 -4.19316651 Be 3.18362810 1.69581920 1.64685009 -3.96852190 -4.08576868 0.35171150 Be 0.02519121 3.17626233 -0.14597521 0.57874274 -2.63799193 -1.71658741 Be 1.70996341 4.49207130 0.15300231 -0.63000349 2.76575341 -4.48125287 Be 1.53848316 2.95774659 1.12030630 -1.71494589 -3.80596144 4.17828099 Be 0.25664163 4.38825682 1.27041603 -0.38203311 2.30529822 1.97684135 Be 3.19178619 3.17895518 0.29140871 -1.53349951 -5.35049611 -7.05604801 Be 4.38746331 4.53253581 0.02994876 1.29005905 1.84018872 -0.74989876 Be 4.28091226 3.10609294 1.46603997 6.81231876 -2.08123617 0.66843345 Be 2.80598025 4.32157598 1.51361598 -0.05870560 4.69198367 2.73123027 Be -0.14801295 -0.16295799 3.12165461 -1.50445365 -0.63111966 -3.57649753 Be 1.18391079 1.27846858 2.97644859 5.40635142 2.78231334 -2.64543665 Be 1.34126820 -0.15859300 4.31668137 0.26589208 -1.71269770 1.10151945 Be -0.16011740 1.24396547 4.29416865 0.45433556 5.48819744 1.48178718 Be 3.27219963 -0.06825127 3.41320158 -2.15734435 0.36733529 -3.03841197 Be 4.75978669 1.22592512 2.78504734 1.13809639 6.53133528 5.55410416 Be 4.69366909 0.18742062 4.68513451 0.70947101 0.28776832 0.76642134 Be 2.67378768 1.16713840 4.57593385 0.83941431 7.89709286 0.24097499 Be 0.23171545 3.18190327 2.82183498 -1.35334811 -3.13597322 1.10012770 Be 1.71219253 4.42485375 3.12990665 -1.32121086 1.55059574 -2.11590988 Be 1.28220450 3.28278197 4.67252859 3.35305317 -10.21741028 -0.46426687 Be 0.13362859 4.32702941 4.42547280 -4.47738177 4.03569063 0.15112162 Be 3.04852473 3.05473499 2.91561068 -2.80467750 -4.30712291 3.72257624 Be 4.63661615 4.40480033 2.87719504 -1.17565600 1.54531327 1.72115147 Be 4.29869006 3.11041876 4.26735611 0.86879067 -4.88780462 1.11626628 Be 2.83533445 4.24148635 4.63892322 3.32564884 1.88975395 -0.15405538