32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=21.747797332613345 stress="-0.007498409279588696 0.00014871027601033235 -4.084488898944528e-05 0.00014871027601033235 -0.006308315848295194 8.847803045134518e-05 -4.084488898944528e-05 8.847803045134518e-05 -0.006931961021545422" free_energy=21.747797332613345 pbc="F F F" V 20.85540510 21.11115480 21.11044915 -10.19586118 -8.39987612 -12.44978317 V 22.74329349 22.31143450 20.83833517 -3.55964804 11.44638830 -15.23920576 V 22.31428531 20.83509776 22.36371066 -2.89194404 -15.83103815 9.34431483 V 20.77812781 22.48254321 22.23417995 -10.55185426 5.63992073 5.38955471 V 23.63239121 20.95894820 21.20259391 14.10809818 -15.51586820 -9.90297331 V 25.56504129 21.91044416 20.86550211 5.78836262 2.83946283 -8.58959113 V 25.28802619 21.22277084 22.68584377 12.36045281 -27.66247596 -22.81509190 V 24.18362810 22.69581920 22.94559836 -7.57259864 -6.29647701 -16.04476566 V 21.26959405 24.17626233 20.85402479 -15.31559266 -8.18038726 -22.04903641 V 22.70996341 25.49207130 21.15300231 -6.69943458 29.20237522 -26.04192050 V 22.53848316 23.95774659 22.19143129 -15.07967254 -20.18186876 13.87882528 V 20.95789336 25.38825682 22.15131790 -15.77685319 15.72950283 7.29550875 V 24.05315278 24.17895518 21.29140871 2.13704979 -21.13860927 -45.12607171 V 25.61455359 25.53253581 21.14904689 11.59854012 15.38222301 -11.53093242 V 25.28091226 24.16444828 22.21249634 42.45451382 -11.33251624 8.52716051 V 23.78791456 25.32157598 22.51361598 6.57605843 40.94964212 16.19363904 V 20.85198705 20.97567541 23.98331792 -9.31487745 -5.18811702 0.03162194 V 22.63815645 22.27846858 23.69794387 -12.39353913 3.26041941 9.69590637 V 22.34126820 20.84140700 25.31668137 2.53033469 -6.96932174 7.80952327 V 20.91986395 22.24396547 25.59073906 -4.71845636 3.49680010 4.29690577 V 24.27219963 20.93381326 24.13132919 -10.45215999 -18.70195163 13.42468558 V 25.75978669 22.22592512 23.78504734 29.60674447 17.81913370 18.48075558 V 25.68365717 21.10373889 25.58343331 3.07658059 -2.16247774 7.08010147 V 23.79378950 22.72996693 25.72094491 -0.74255057 -5.72704904 8.90073267 V 21.23171545 24.18190327 23.83184690 -15.68517858 -9.69534559 -2.95054264 V 22.71219253 25.42485375 24.12990665 -7.19401146 25.24243770 -9.80142246 V 22.26673789 24.28278197 25.56210000 3.12309781 -26.23176807 18.38764771 V 21.13362859 25.32702941 25.57034430 -23.46503137 19.21553576 9.62410704 V 24.04852473 24.05473499 23.91561068 -2.91595660 -4.26243080 10.62867791 V 25.63661615 25.40480033 23.97889625 11.67169165 12.96088975 -1.86219374 V 25.29869006 24.11041876 25.26735611 20.26093227 -8.38014177 15.33884458 V 23.83533445 25.24148635 25.58611608 9.23276338 18.67298891 20.07501778