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=-20.95794976512839 stress="1.0923240202219628 -0.00016791040645682657 0.05026620822200653 -0.00016791040645682657 1.1879540759921758 0.009738169525082474 0.05026620822200653 0.009738169525082474 1.1441971985597073" pbc="T T T" C -0.14459490 0.11115480 0.11044915 -1.23817985 2.09751130 2.05546362 C 1.70960170 1.31143450 -0.16166483 5.03554188 -2.02091395 -2.87698272 C 1.28829595 -0.16490224 1.64041416 -0.64298888 -1.46825618 2.71420122 C -0.22187219 1.51878885 1.32834452 -3.15437315 1.39165882 -1.89268212