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=52.93313046602528 stress="-0.025467009583226438 -0.0016803081550695554 -0.007373257060154543 -0.0016803081550695554 -0.018521567820997165 -0.003542936619912962 -0.007373257060154543 -0.003542936619912962 -0.01764912967019089" pbc="F F F" Db 21.29040053 20.84008549 21.03249975 -273.52986972 -2.54059677 -23.50091648 Db 22.70139451 22.78993114 22.56178410 -20.01686629 -38.38576573 41.39410009 Db 23.61552036 20.83220109 21.18451123 295.22942990 -39.92014135 -10.89180073 Db 25.75502638 22.78277064 22.23609372 113.84684650 -109.49270140 83.07677774 Db 21.14488871 23.78754865 20.88912151 -59.21657761 33.82199875 -61.64760378 Db 22.76694939 25.65610282 22.31867591 -41.25136483 44.79338603 20.86386902 Db 24.20159793 24.03269622 20.88638582 -87.11843138 38.58328880 -197.48021713 Db 25.50523705 25.52321132 22.47873679 95.10350593 104.93822272 -8.91242621 Db 20.77137689 21.30720007 23.81878040 -13.56933076 -15.12796724 3.60484240 Db 22.55145887 22.65930814 25.50277172 -59.98549178 21.22552827 103.34018781 Db 24.09363443 21.25938773 24.14966315 43.67649936 -127.30378217 -77.70190606 Db 25.46499498 22.62535358 25.79407500 65.26811325 -39.42866792 87.51539315 Db 20.99586631 24.17261013 24.01708163 -215.72682952 -158.27829126 -175.56570777 Db 22.25062821 25.63467221 25.28750059 168.33201485 202.29118905 175.19788266 Db 24.24946998 24.09196037 24.09794811 -80.78499893 -6.43259585 -23.81777329 Db 25.77762050 25.22480488 25.67164886 69.74335104 91.25689608 64.52529859