4 Lattice="3.75 0.0 0.0 0.0 3.75 0.0 0.0 0.0 3.75" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=204.81428666570181 pbc="T T T" Mo -0.14459490 0.11115480 0.11044915 42 -155.14713533 -277.46645311 -296.36509358 Mo 1.14710170 0.74893450 -0.16166483 42 138.23396573 72.78632131 -94.30507436 Mo 0.72579595 -0.16490224 1.07791416 42 134.71787256 -130.80372249 173.13758397 Mo -0.22187219 0.95628885 0.76584452 42 -117.80470296 335.48385430 217.53258396