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=-9.80602625109 stress="-7.250296137468107 -0.8175322802597758 0.5648527495022071 -0.8175322802597758 -6.23258045966968 -0.8017855639444048 0.5648527495022071 -0.8017855639444048 -6.8815562256215514" pbc="F F F" Mo -0.14801295 -0.02432459 0.06329927 -10.36055086 -9.45312633 -9.49557131 Mo 1.43745442 1.27846858 -0.00548572 9.91654978 8.49130849 -7.69540650 Mo 1.34126820 -0.15859300 1.31668137 7.49030831 -7.42310830 6.31575734 Mo -0.08013605 1.24396547 1.59073906 -7.04630723 8.38492613 10.87522047