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=-1.0745776262626547 stress="0.06689032165835712 -0.015021927376881709 -0.0018184341179283362 -0.015021927376881709 0.07179183177630247 -0.006325881571654808 -0.0018184341179283362 -0.006325881571654808 0.09161167430108473" pbc="F F T" user14 0.05590935 0.26071323 -0.12903042 0.49565969 0.71237918 -0.52855086 user14 1.35387447 1.78925879 -0.13863947 -0.46454458 -0.45044392 -0.24206623 user14 1.27872620 0.24329444 1.43388801 -1.11655732 0.95908935 0.23113979 user14 0.20540518 1.27064311 1.64098362 1.08544221 -1.22102461 0.53947729