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=194.296146402218 stress="-0.00452899079282693 -0.00011334476172965386 0.00021120122991358838 -0.00011334476172965386 -0.004332962476967805 0.00020462163647182632 0.00021120122991358838 0.00020462163647182632 -0.004379505617075377" free_energy=194.296146402218 pbc="F F F" O 20.85540510 21.11115480 21.11044915 -5.54914016 -7.93302360 -8.83160991 O 22.70960170 22.31143450 20.83833517 -3.20778699 2.87881054 -10.09949980 O 22.28829595 20.83509776 22.64041416 3.48708648 -13.71373411 -4.12701574 O 20.77812781 22.51878885 22.32834452 -11.17012895 4.71397158 0.31555806 O 23.87679405 20.95894820 21.20259391 2.63479504 -12.19723591 -5.84493794 O 25.56504129 22.24235123 20.86550211 6.85521566 0.99042027 -8.15791962 O 25.28802619 21.22277084 22.68584377 16.03883029 -4.75368358 2.00317974 O 24.18362810 22.69581920 22.64685009 -8.91508060 -6.88329740 -1.61940899 O 21.26959405 24.17626233 20.85402479 -11.02017722 -3.90637240 -15.96471898 O 22.73595276 25.49207130 21.15300231 5.44341894 16.23769869 -5.33629702 O 22.53848316 23.95774659 22.14181807 -5.14845017 -10.22034378 7.72028958 O 20.95789336 25.38825682 22.27041603 -10.16883134 11.77205738 2.60305057 O 24.19178619 24.17895518 21.29140871 11.67187713 2.24107403 0.80142002 O 25.61455359 25.53253581 21.14904689 8.67413674 9.22697089 -6.82413319 O 25.28091226 24.06984730 22.46603997 9.80844302 -0.92046019 -12.68724128 O 23.80598025 25.32157598 22.41945141 -1.88785155 12.07952726 -13.20977602 O 20.85198705 20.97567541 24.06329927 -14.50352644 -9.96668001 -1.49999684 O 22.19305158 22.27846858 23.69629901 6.75867471 8.56987206 6.07568776 O 22.34126820 20.84140700 25.31668137 4.64133055 -8.64007093 8.05643658 O 20.91986395 22.24396547 25.59073906 -6.45751625 5.18391909 8.42441550 O 24.27219963 20.93381326 24.13132919 -8.32569377 -12.00764465 3.53816997 O 25.75978669 22.22592512 23.78504734 10.35842442 -2.81317124 -5.31863384 O 25.68365717 21.20288723 25.58343331 10.22724250 -6.33735456 7.73857297 O 24.09460229 22.22100426 25.72094491 -5.87345907 5.11891564 8.10872252 O 21.23171545 24.18190327 23.82183498 -10.79813517 -4.02325650 -0.44260703 O 22.71219253 25.42485375 24.12990665 -3.99674380 16.98713285 -6.14248728 O 22.28220450 24.28278197 25.56210000 -12.01832581 -4.28742204 12.41715539 O 21.01453046 25.18839601 25.57034430 0.21519322 0.18191238 6.68125680 O 24.04852473 24.05473499 23.91561068 -5.74005993 -6.10055566 5.97628199 O 25.63661615 25.40480033 23.93555039 9.19668091 12.59646038 -0.57196291 O 25.29869006 24.11041876 25.26735611 12.76654202 -6.24120465 12.27151122 O 23.83533445 25.24148635 25.58611608 6.00301558 12.16676820 13.94653772