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=152.0377030670962 stress="-737.9059903721256 550.5460549391388 -436.0390802109706 550.5460549391388 -683.1748916969871 401.2438484668603 -436.0390802109706 401.2438484668603 -432.5442754793205" pbc="T T T" user01 -0.14459490 0.11115480 0.11044915 807.10824858 -1308.78304184 470.62953460 user01 0.95960170 0.56143450 -0.16166483 -1291.46822092 1303.32679380 -697.00160058 user01 0.41509000 0.03769167 0.59907360 434.83369949 -75.57578675 305.42666869 user01 0.00089865 0.76878885 0.76418829 49.52627285 81.03203478 -79.05460271