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=930.4543650305048 stress="-0.043819311500359386 0.0002095621647534934 0.003363328232142573 0.0002095621647534934 -0.04389931975272042 -0.0007194520042217836 0.003363328232142573 -0.0007194520042217836 -0.04878922491274226" pbc="F F F" W 20.91049160 20.96409321 20.93858073 -78.58634899 -65.56832280 -107.93959783 W 22.25205420 22.67690076 21.05988540 35.53618696 7.35005801 -179.79739418 W 22.20245745 21.16431082 22.31425730 138.03480474 -216.37248895 51.84408572 W 20.98844065 22.34912061 22.39971974 -209.88450554 134.62408449 110.53178644 W 23.79900377 20.94663949 20.78219307 -4.87939426 -37.85792414 -50.57181082 W 25.53256999 22.26716069 21.19410236 42.94562240 77.77844438 -84.00050784 W 25.33096497 20.88201197 22.43300593 137.08976048 -108.15173790 -86.77751500 W 23.72002482 22.32072597 22.41661558 97.45987620 -4.81766224 -27.78519474 W 20.96512192 24.22586561 21.29391194 -130.17150649 -321.95270616 -260.79217891 W 22.22614529 25.52103145 20.77761356 57.89005504 149.66519602 -115.63101991 W 22.68220204 23.89362841 22.73573857 -214.38182175 76.57422259 -185.97046754 W 21.02724172 25.27538150 22.20296332 -86.95095461 315.74127188 296.01596926 W 23.56938830 24.22083292 20.98258956 100.17694489 -46.11133300 -75.01945844 W 25.48735431 25.23022082 20.96030570 41.26351461 33.58017665 -65.11158696 W 25.56543583 24.05936010 22.62918500 45.18184340 -71.67519400 1.75904773 W 24.09995250 25.58978792 22.51193751 -27.29439253 73.25121413 -18.32194259 W 21.25226748 20.96431997 24.04396501 -111.04980696 -49.02575149 -56.22004056 W 22.57236142 22.70379337 24.38575403 -37.40167811 -177.51585513 -11.65509400 W 22.26922180 20.78229695 25.52031036 87.72471554 -52.17229635 115.85938981 W 21.18745344 22.60958096 25.37970777 -163.75596212 -8.49462440 153.54136631 W 24.27711528 20.87871118 23.75213077 -215.37940479 -191.16039578 116.93176012 W 25.23125112 22.21824351 24.13616082 235.24811574 129.85814448 -145.73240468 W 25.26429260 21.12968218 25.71980528 66.53691930 -137.40516388 100.22090495 W 24.29977655 22.68543805 25.45460942 -159.13693636 64.54567720 205.95404788 W 21.07327937 24.19989723 24.12961200 -136.14651227 -46.04747861 -85.84310351 W 22.37425859 25.65720406 23.72271271 33.76677112 125.67993202 15.56135950 W 22.38507600 24.57328435 25.48273691 115.65496160 -38.24547227 119.82702056 W 20.86065667 25.67089611 25.47011124 -92.64630302 100.68904290 46.32921513 W 23.70220318 23.71755886 23.85541431 324.69372571 177.29200511 130.53377891 W 25.39917148 25.47557052 24.06574541 105.52850451 38.59508961 -37.08487466 W 25.71005355 23.99816509 25.65352822 75.77757713 26.81118513 30.18946602 W 24.29594673 25.65710459 25.49042854 -72.84437158 40.53866250 99.15499381