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=371104.7090055851 pbc="T T F" Ac 0.20996341 0.10662489 0.15300231 89 -946600.57521239 61967.53914680 -831475.20016687 Ac 1.53848316 1.49028240 -0.08147842 89 155460.48196889 27435.41186985 -233175.39382382 Ac 1.45789336 -0.11174318 1.27041603 89 1070571.82790212 200237.47013439 854002.82787846 Ac 0.19178619 1.67895518 1.79140871 89 -279431.73465863 -289640.42115104 210647.76611223