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=200.31545086 pbc="T F T" Hg 0.18637616 -0.03836086 0.13318514 80 -61.83433439 -87.25080708 -51.33386405 Hg 1.22051529 1.69273990 -0.19277068 80 67.27306175 90.37689475 -32.14905798 Hg 1.26172667 0.01038628 1.38436473 80 77.23277976 -108.30032552 44.36643241 Hg 0.50670669 1.49816022 1.22604988 80 -82.67150712 105.17423786 39.11648962