16 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=-21.452050195475714 stress="0.00028976690963126544 0.00019101092531271054 0.0006371084660048801 0.00019101092531271054 0.00036567889583718517 0.00014184993787559236 0.0006371084660048801 0.00014184993787559236 0.00046377590604391945" pbc="F F F" C 21.15415336 20.88406451 21.16880450 -0.99613357 -0.82631758 -1.16515130 C 22.45605807 22.29336881 22.25835382 -0.19464845 0.64891208 0.39931287 C 23.98899798 21.11697015 21.15042608 23.12864509 23.08437115 20.99445661 C 25.27812781 22.50332224 22.43004572 -20.85877547 -23.82979203 -22.97687704 C 20.87762007 24.20518917 21.34561792 -1.60531285 -0.15431965 -0.87845625 C 22.56504129 25.20865944 22.36550211 12.88499616 -9.80554582 16.57594704 C 23.64301513 24.33319943 21.18584377 0.37294109 0.25463935 -1.46928085 C 25.53875661 25.60915804 22.49340500 0.87357970 0.61211756 -0.25837336 C 21.14200640 20.99857077 23.76451638 -0.98121456 -0.90025572 0.69934101 C 22.43282761 22.43065202 25.40505651 -0.19870800 -0.60275361 1.52370592 C 24.19337098 20.95774659 23.97840698 -0.21867653 -1.91103431 0.19179271 C 25.16035081 22.55256764 25.08467333 1.47022250 0.11963108 1.51246975 C 21.19178619 24.16739583 24.32418584 -2.04567930 -0.08928362 -0.30525436 C 22.51427333 25.40619717 25.61002363 -0.28554413 1.23370806 1.34202059 C 23.78091226 24.10609294 23.96603997 -12.21997864 11.57873970 -16.79613157 C 25.08817332 25.53971491 25.28077667 0.87428695 0.58718337 0.61047823