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=-8.20670462491 stress="2.7960297107508136 -0.1725651016511129 -0.3944780940447412 -0.1725651016511129 2.1625995536140086 -1.0841589340959683 -0.3944780940447412 -1.0841589340959683 1.9125712026778305" pbc="F F F" C -0.14459490 0.11115480 0.11044915 4.14040062 2.21022624 1.25878387 C 1.70960170 1.31143450 -0.16166483 -6.06514248 -4.43818291 5.44866693 C 1.28829595 -0.16490224 1.64041416 -3.31583578 6.23357213 -5.50079875 C -0.22187219 1.51878885 1.20513857 5.24057765 -4.00561546 -1.20665205