4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=41.303022707538574 stress="-155.70822939788002 19.23370008509505 -42.88366998040338 19.23370008509505 -127.47976507016325 -21.121618192987924 -42.88366998040338 -21.121618192987924 -172.45965037462273" pbc="F F F" W 0.19178619 0.17895518 0.29140871 -71.43888205 -57.62845543 -117.85259543 W 1.61455359 1.53253581 0.14904689 29.48776001 37.67751580 -23.93854247 W 1.28091226 0.10609294 1.46603997 88.09829665 -44.16668031 89.25598609 W -0.19401975 1.32157598 1.51361598 -46.14717461 64.11761994 52.53515181