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=718.4616257888533 stress="-148.88707446328365 -8.823401764609915 -15.166864980731873 -8.823401764609915 -182.0842795703037 37.899553106199114 -15.166864980731873 37.899553106199114 -138.22363575451104" pbc="T T T" Mt 0.00163315 -0.16828950 -0.05607787 -733.46562451 969.80493918 453.70693384 Mt 1.24621006 1.50829448 0.29535089 577.58539252 456.78029055 -1179.93851977 Mt 1.41798614 0.27498308 1.58478226 -541.99646945 -1963.63223689 806.38509312 Mt -0.23932472 1.48950181 1.62122422 697.87670144 537.04700716 -80.15350720