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=-59.89850363687357 stress="-0.00251349393748149 0.0003705525263881957 0.00017621090261218857 0.0003705525263881957 -0.0016737171958164955 -0.0008169864726353463 0.00017621090261218857 -0.0008169864726353463 -0.002012006417393327" pbc="F F F" W 20.91870436 21.04860922 21.20118821 -1.19578039 -0.53543572 -0.69337809 W 22.70960170 22.31143450 22.33833517 -16.00242072 16.40637023 10.09823539 W 23.78829595 20.83509776 21.14041416 12.09824449 -17.28960045 -14.25410294 W 25.27812781 22.79098848 22.26215777 12.82126044 -6.65543194 2.52853550 W 21.00812325 24.21873489 21.38625107 -31.76648218 -20.99158538 -19.62006709 W 22.56504129 25.20865944 22.36550211 -9.79517541 59.43740370 43.92040963 W 23.78802619 24.22277084 21.18584377 32.89283525 -23.02907906 -43.15806110 W 25.47948213 25.64391375 22.86779500 1.45062060 1.40807613 -3.03730384 W 21.26959405 21.40797779 24.03592806 -4.77004361 -3.24419346 0.01589756 W 22.53179838 22.70426383 25.65300231 2.72326479 -0.95005425 6.22951228 W 23.96333691 20.95774659 24.04842823 0.17565485 -3.05585300 0.19783702 W 25.24009786 22.67103879 25.33251603 2.65636377 0.37413317 2.08581500 W 21.19178619 24.31258377 24.11843813 -10.38235588 -1.33024898 0.33031597 W 22.68489789 25.53253581 25.64904689 -0.47970879 2.93178147 3.15987259 W 23.78091226 24.10609294 23.96603997 7.16770826 -4.08911992 8.62276522 W 25.35450498 25.37631097 25.42922666 2.40601453 0.61283745 3.57371688