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=34599.79716398632 pbc="T F F" U -0.16875388 0.19900183 -0.12324464 92 79710.74002371 -102578.46728042 -14851.42988355 U 1.73344841 1.47642935 -0.06903601 92 -81169.04059056 109428.82624932 -11904.52789529 U 1.21713348 0.26743709 1.42023797 92 38212.30730333 -59479.83242780 12861.47486363 U 0.10260661 1.64124282 1.61696469 92 -36754.00673648 52629.47345891 13894.48291521