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=201473.6661547348 stress="-9.673085431129733 1.054741430634998 0.46442063594182414 1.054741430634998 -11.5957334649763 -0.41691582332299915 0.46442063594182414 -0.41691582332299915 -11.834409588005443" free_energy=201473.6661547348 pbc="F F F" Tm 21.05936808 20.84400702 21.28521228 -15921.90448223 -21440.86341858 -33346.03050974 Tm 22.54581671 22.45861634 20.99704380 2970.62758120 -44709.30491098 -57580.19516850 Tm 22.51345551 20.77894474 22.38589778 30196.04784849 -8034.46932554 -10022.23037904 Tm 20.85711232 22.13920176 22.50431951 -14359.73628730 28862.70971288 10344.61010048 Tm 24.12789937 21.11732156 21.25461489 -37227.62158664 -26674.58387058 -44234.41169479 Tm 25.23968448 22.73870006 20.92928782 36280.68447029 -10030.05106838 -29970.93271227 Tm 25.48068003 21.32203329 22.27924546 54552.88295531 -11443.01588522 34594.40341887 Tm 24.10459891 22.59061600 22.40085745 -22464.25937912 -44564.03528977 55143.50422566 Tm 21.02960215 24.11018255 21.27482192 -16652.29340516 -73848.08718310 -123609.18658125 Tm 22.58937424 25.75442586 21.43992616 -3703.18766626 3387.52290063 -4860.75679211 Tm 22.33547792 23.56418068 22.23626075 18028.27464204 30730.86393088 84245.10279824 Tm 20.73208116 25.20147036 22.39555656 -29515.76835584 94970.72103936 89182.28143844 Tm 23.97064982 23.90439111 21.35585681 -23801.15537748 67642.61156610 -42556.97300122 Tm 25.44413431 25.12835396 20.94682765 15221.02416386 2909.76468271 -14320.82036223 Tm 25.40152663 23.87097158 22.76862358 16301.28907730 48722.45696478 -36927.38081181 Tm 24.34922839 25.68490095 22.37985877 -2417.45142469 9968.51947143 14295.27805014 Tm 21.41160656 20.88015744 23.78051557 -18804.35725046 -13716.92607418 31912.67739677 Tm 22.28724805 22.62518270 24.35065025 9911.48135673 -52407.53498762 -69708.62076832 Tm 22.52926065 21.13806414 25.65186837 -20254.33466658 -22016.81431065 12515.08992339 Tm 21.02881106 22.91781477 25.52166785 -39029.25484625 -3685.49057294 35889.66890633 Tm 23.73339241 20.91798336 24.01290983 5586.83042509 -5777.32877562 -3860.35581742 Tm 25.62985086 22.71438501 23.99522890 79162.43175179 -74788.65594886 23268.62479022 Tm 25.41845852 21.14194915 25.44565463 11146.17249718 -9528.87741655 2439.42078653 Tm 23.90471535 22.29934132 25.51162738 13309.84082617 -9144.94586091 37702.38775227 Tm 21.17356894 24.16164488 24.04632522 -10048.97782089 8996.87526865 -6922.40491712 Tm 22.67173169 25.64104858 23.92922544 769.82086944 3294.50618965 -2104.24420007 Tm 22.73692134 23.85464942 25.41389135 11572.47646897 58618.56895833 49875.07020054 Tm 21.05347040 25.66401974 25.54822266 -1264.73019833 2519.06411547 2953.29895630 Tm 24.13910847 23.42480511 24.20211996 -80691.27102139 43896.39647707 -46033.64203725 Tm 25.54996421 25.26258436 24.42714681 35840.64612792 104421.51772784 -86588.94267777 Tm 25.28375509 24.00876884 25.37072858 8091.15162538 -85839.20812208 116267.53786828 Tm 24.09937269 25.67126596 25.53933152 -12785.37891859 8708.09401579 12018.17181847