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=13539.12320810455 stress="-2467.287791329741 -712.0643673145382 6.885130197375677 -712.0643673145382 -1818.8542186684435 66.6481203053034 6.885130197375677 66.6481203053034 -2009.8530176974439" pbc="T F T" Mc 0.18387762 0.20294859 -0.16912223 1384.98554628 -17539.90014294 -6727.27688983 Mc 1.60563823 1.59003763 0.11795123 -2533.24190322 10994.24216566 -10265.67506208 Mc 1.71267092 0.20788226 1.43712954 -20787.05027110 -26092.84960725 5070.92834854 Mc 0.04267438 1.24428924 1.25541092 21935.30662804 32638.50758453 11922.02360337