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=18.388210060504566 stress="-96.98938354025047 31.395838616169666 2.3233593170853055 31.395838616169666 -84.0586097392057 5.473840061316778 2.3233593170853055 5.473840061316778 -67.7032687473301" pbc="F F F" Mo 0.23171545 0.18190327 -0.17816502 -18.77913139 -16.85570444 -22.18534419 Mo 1.71219253 1.42485375 0.12990665 24.10557825 24.60255560 -20.23006768 Mo 1.28220450 0.28278197 1.56210000 52.91698388 -59.70804523 27.67530344 Mo 0.13362859 1.32702941 1.57034430 -58.24343074 51.96119407 14.74010843