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=680.0180255949426 stress="-0.02073382861628633 0.00023173304602911644 -0.0007363048717696143 0.00023173304602911644 -0.01995145057733599 -0.0005120594913757322 -0.0007363048717696143 -0.0005120594913757322 -0.020379417910647464" free_energy=680.0180255949426 pbc="F F F" Pb 20.85540510 21.11115480 21.11044915 -19.88834362 -45.01621721 -37.84309076 Pb 22.70960170 22.31143450 20.83833517 -14.57790302 4.40939523 -47.58447775 Pb 22.32198775 20.83509776 22.66640352 6.59144288 -50.66747194 -16.05984851 Pb 20.77812781 22.51878885 22.05164101 -37.24358195 25.52166382 22.93999780 Pb 23.84054841 20.95894820 21.20259391 8.80989401 -52.86027973 -26.00468600 Pb 25.56504129 22.11449487 20.86550211 31.31065140 4.14072753 -37.31848011 Pb 25.28802619 21.22277084 22.68584377 33.08876586 -73.47970264 -46.05413426 Pb 24.18362810 22.69581920 22.40244725 -21.63633988 -34.31149179 4.87130991 Pb 21.26959405 24.17626233 20.85402479 -46.19996875 1.36226267 -53.77019455 Pb 22.70996341 25.49207130 21.15300231 -24.17391180 77.55398595 -60.61819417 Pb 22.53848316 23.95774659 22.12030630 -46.89821145 -34.93311095 35.75379170 Pb 20.95789336 25.38825682 22.56916429 -35.57598344 37.71229590 -6.22961188 Pb 23.96469590 24.17895518 21.29140871 37.35303985 -18.78576143 -109.32786668 Pb 25.61455359 25.53253581 21.14904689 25.53835695 25.66672187 -23.49733145 Pb 25.28091226 23.98699481 22.46603997 86.40288440 3.47366953 5.66089057 Pb 23.80598025 25.32157598 22.51361598 23.53657924 90.73409242 29.22101643 Pb 20.85198705 20.97567541 23.92466586 -47.27728917 -23.20952007 -0.00789641 Pb 22.49580977 22.27846858 23.74097065 -2.90957615 20.18922685 14.65500308 Pb 22.34126820 20.84140700 25.31668137 6.64482730 -37.82869783 28.74663775 Pb 20.91986395 22.24396547 25.59073906 -25.49841762 12.20980534 25.62012635 Pb 24.27219963 20.93381326 24.13132919 -22.25116794 -44.49001940 19.12444891 Pb 25.75978669 22.22592512 23.78504734 59.43618060 44.17793335 41.58272034 Pb 25.68365717 21.20288723 25.58343331 23.09143334 -13.90816984 30.24451179 Pb 23.77778834 22.36811319 25.72094491 1.95259645 6.13661534 31.69017966 Pb 21.23171545 24.18190327 24.02253701 -51.03198920 -32.86199865 -15.38840724 Pb 22.71219253 25.42485375 24.12990665 -19.23242249 82.61179850 -16.24347177 Pb 22.28220450 24.28278197 25.56210000 20.66536241 -64.39660058 61.36148408 Pb 21.13362859 25.32702941 25.57034430 -67.20572198 62.54272217 33.54010302 Pb 23.75195432 24.05473499 23.91561068 15.87737977 -40.15898829 19.44755314 Pb 25.63661615 25.40480033 23.77804670 32.48318335 39.19560551 7.82529121 Pb 25.29869006 24.11041876 25.26735611 41.48277909 -17.23282469 30.58098499 Pb 23.83533445 25.24148635 25.58611608 27.33547158 46.50233304 53.08164079