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=2882.0532341417997 pbc="T F F" Ds -0.06444840 0.29327960 0.01739291 110 7613.05223015 -10013.47194757 -6504.59874498 Ds 1.76447077 1.25585439 0.22545095 110 -10375.42087482 7878.32193016 -2438.44740670 Ds 1.60421172 -0.07817697 1.32229893 110 -609.79916021 -1890.60197166 1618.15191183 Ds 0.03003958 1.27153995 1.27064996 110 3372.16780489 4025.75198907 7324.89423985