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=15319.205709194852 stress="-2556.833895901561 1122.2974183861845 549.7617349946233 1122.2974183861845 -2233.1047913865227 371.0904347912413 549.7617349946233 371.0904347912413 -2043.0396764348561" pbc="F T T" Xe 0.23171545 0.18190327 -0.17816502 -20059.17022267 -15895.93994079 26912.01866177 Xe 1.62780321 1.32965408 0.00710170 8247.72173100 9261.04579782 3290.63455618 Xe 1.28220450 0.28278197 1.56210000 51088.06403892 -37072.40117456 -19502.46804823 Xe 0.13362859 1.32702941 1.57034430 -39276.61554725 43707.29531753 -10700.18516972