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=-3.51876406984 stress="-0.08436733006836333 0.4090682036364989 -0.04862124484806477 0.4090682036364989 2.425534669812001 1.0817661473771512 -0.04862124484806477 1.0817661473771512 2.2014234681805673" pbc="F F F" C -0.14459490 0.11115480 0.11044915 0.43448342 6.29767785 5.28977131 C 1.58639575 1.27038270 0.04092907 -0.38296290 -1.81809524 2.19747560 C 1.28829595 -0.09986095 1.64041416 0.81475290 1.52524269 -1.93904935 C 0.00089865 1.51878885 1.32834452 -0.86627343 -6.00482530 -5.54819756