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:Z:I:1:forces:R:3 energy=10459.834690284359 pbc="T T F" Re -0.09819066 -0.06522707 -0.07751728 75 36181.78673328 37078.90147523 -1771.51197086 Re 1.78935370 1.74450864 -0.19756203 75 -34312.05701500 -37669.63812755 -8212.27113432 Re 1.63796294 -0.12450882 1.44248157 75 1851.19807039 6255.39998073 6609.37778290 Re 0.28915599 1.54127681 1.38391713 75 -3720.92778867 -5664.66332842 3374.40532228