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=3368.2434183993487 stress="-15942.93771430075 9098.542657411896 2107.5509516563106 9098.542657411896 -17573.992085881517 114.21946607620339 2107.5509516563106 114.21946607620339 -8692.156834681935" pbc="F F F" Lr 0.12366693 -0.17417053 -0.16119304 -2278.46599671 -2576.59617684 -1638.29709913 Lr 1.20910317 1.47978294 -0.07853355 3377.19466522 3116.71275578 -3742.47176174 Lr 1.36573563 0.02297767 1.47367547 10313.35489889 -10420.29082905 1425.05891160 Lr 0.17034439 1.29072628 1.52541285 -11412.08356740 9880.17425011 3955.70994927