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=-9.725538839174767 stress="16.190654392878578 -0.44019239770452767 -0.16085787816232866 -0.44019239770452767 14.545066843284712 -0.22094973625447345 -0.16085787816232866 -0.22094973625447345 13.47523022407827" pbc="F F F" B -0.17114904 -0.19399834 0.04670512 4.05219016 5.08849494 4.68915918 B 1.61495049 1.30696545 0.00127298 -4.56579167 -4.51677704 5.63801444 B 1.53715739 -0.00030174 1.38854360 -5.16667817 5.47257953 -5.39909825 B -0.03197041 1.26614954 1.25901721 5.68027968 -6.04429742 -4.92807538