4 Lattice="1.5 0.0 0.0 0.0 1.5 0.0 0.0 0.0 1.5" Properties=species:S:1:pos:R:3:forces:R:3 energy=133.53224989306415 stress="-246.35745885368084 -202.94869524493933 275.71867297984556 -202.94869524493933 -1096.1618910152847 154.5866432396724 275.71867297984556 154.5866432396724 -308.6506042083133" pbc="F T F" user01 -0.03693220 -0.06371100 -0.25271761 4.06035608 -0.43242806 4.13110811 user01 0.73193431 0.52500758 0.20070203 433.62433876 -2.15127963 -542.23200740 user01 0.45342959 -0.09914834 0.60306398 305.98608196 1187.81983749 -176.98864779 user01 0.28187239 0.76001192 0.73453339 -743.67077680 -1185.23612981 715.08954708