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=22.683538294423773 stress="-94.85762354883315 11.29579700527739 -24.717553908599726 11.29579700527739 -78.30473672377697 -12.19770702339465 -24.717553908599726 -12.19770702339465 -103.9313508259704" pbc="F F F" Mo 0.19178619 0.17895518 0.29140871 -42.93260396 -35.16427520 -70.39538391 Mo 1.61455359 1.53253581 0.14904689 18.49667975 23.50815291 -14.97970163 Mo 1.28091226 0.10609294 1.46603997 52.86255551 -27.28629475 53.54036634 Mo -0.19401975 1.32157598 1.51361598 -28.42663130 38.94241704 31.83471921