32 Lattice="100.625 0.0 0.0 0.0 100.625 0.0 0.0 0.0 100.625" Properties=species:S:1:pos:R:3:forces:R:3 energy=35.96430820001491 stress="-6.720578631365368e-05 -2.0656420224788243e-07 3.1224599836615926e-09 -2.0656420224788243e-07 -6.700426381629705e-05 1.9241097064802087e-07 3.1224599836615926e-09 1.9241097064802087e-07 -6.707582423188621e-05" free_energy=35.96430820001491 pbc="F F F" Si 50.20617696 50.16442370 50.23790967 -0.54949626 -0.49117212 -0.46184289 Si 53.80622400 53.84709106 50.10587850 -0.12607419 0.00930365 -1.09064966 Si 53.91604984 50.36240450 53.63883465 -0.07017580 -1.07296339 0.14563767 Si 50.44942569 53.95248858 53.91496132 -1.07708489 -0.06510158 -0.00349852 Si 57.37426718 50.22893312 50.20721780 0.03072906 -0.85794329 -0.88539373 Si 61.06123061 53.72474423 50.49428244 0.84345185 0.13671748 -0.95143237 Si 60.89971724 50.47425196 53.70317282 0.84013695 -1.00851772 0.06241388 Si 57.38972894 53.69578083 53.70940544 -0.06732198 0.02343145 0.06699030 Si 50.12663689 57.43051299 50.28343493 -0.70902914 0.11795292 -0.64976803 Si 53.86156742 61.33867662 50.08428775 -0.03203716 0.62271591 -0.61452081 Si 53.92377621 57.31467796 54.05808504 -0.12928424 0.26496381 -0.21813745 Si 50.22385700 61.29019881 54.08956802 -0.66944311 0.60200219 -0.07231740 Si 57.15217568 57.25246943 50.18656084 0.15272138 0.22938923 -0.96242400 Si 61.27777743 60.91862471 50.30196192 0.41701350 0.38616712 -0.41985523 Si 61.02957625 57.22392528 54.05714258 0.99218919 0.23702296 -0.14581085 Si 57.40131271 61.20293732 53.98954375 0.05855568 0.97120490 -0.21025244 Si 50.53017296 50.32244793 57.61386018 -0.75526988 -0.82011132 -0.04750613 Si 54.06910571 53.94135435 57.57099515 0.01614059 -0.17163234 -0.03220785 Si 54.24333898 50.51128830 60.90143483 -0.11698004 -0.80244516 0.87970537 Si 50.13108079 53.78032560 61.24996120 -0.76484244 -0.08159089 0.79838672 Si 57.63947133 50.21225648 57.73092940 -0.07845953 -1.03182054 -0.18607911 Si 60.99267598 53.77421184 57.27604260 1.01120584 0.03197797 0.16448202 Si 60.85895293 50.42596735 60.89732717 0.68506081 -0.57017829 0.66977431 Si 57.57228869 54.31908757 61.34356379 0.05033229 -0.04631684 1.02390024 Si 50.46703171 57.22318879 57.74220318 -1.12930902 0.11853008 -0.10564391 Si 53.89453751 61.20176000 57.56508326 0.04568067 1.00588983 -0.00244312 Si 53.86412525 57.30470705 60.99798000 0.02959503 0.14770070 1.09585321 Si 50.56057045 61.07936409 60.97763056 -0.58664172 0.56806677 0.61308581 Si 57.41920479 57.47543457 57.25183599 0.10526286 0.05030878 0.15566086 Si 60.85838238 60.97326192 57.62890329 0.82128267 0.75640319 -0.00449288 Si 61.31237782 57.25235600 61.26879462 0.80254076 0.06767725 0.62982941 Si 57.67000510 61.05182242 61.34037227 -0.04044974 0.67236729 0.75855660