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=122.5709108310773 stress="-785.8545422043314 2.0041429365243744 -460.7696040734147 2.0041429365243744 -409.2738799041974 81.61422104027156 -460.7696040734147 81.61422104027156 -748.7327055935434" pbc="F F F" I -0.16108599 0.13911163 -0.12132215 -494.60272944 -80.73881921 -448.37244287 I 1.55331833 1.45976486 -0.29017161 134.25397185 133.52003607 -86.23839495 I 1.22513515 -0.14303144 1.23250180 400.90657875 -166.69012711 438.95194849 I -0.15969972 1.77120299 1.34124695 -40.55782116 113.90891025 95.65888933