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=1.6728954253799875 stress="-54.13398819797466 1.3426946755300997 -5.7482690321532 1.3426946755300997 -52.83869875120445 1.3314501243507344 -5.7482690321532 1.3314501243507344 -54.42101477101125" pbc="F F F" Mo -0.14801295 -0.02432459 0.06329927 -22.60093588 -15.78211691 -22.12482954 Mo 1.43745442 1.27846858 -0.00548572 14.29220863 19.87011268 -16.45065386 Mo 1.34126820 -0.15859300 1.31668137 21.74623244 -22.91299570 20.55140891 Mo -0.08013605 1.24396547 1.59073906 -13.43750519 18.82499992 18.02407449