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=149.10392829820768 stress="-17.966496239369576 0.8581963875499817 -1.3153294054964202 0.8581963875499817 -20.60921960132539 -0.2914458583153363 -1.3153294054964202 -0.2914458583153363 -19.510388058784454" pbc="T T T" W -0.14459490 0.11115480 0.11044915 49.94011735 -49.32384889 -33.86852148 W 1.70960170 1.31143450 -0.16166483 -115.25073415 38.16471885 41.57216879 W 1.28829595 -0.16490224 1.64041416 -11.66025100 27.21606751 -53.21085901 W -0.22187219 1.51878885 1.32834452 76.97086781 -16.05693747 45.50721169