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=-36.13841009756788 stress="1.5770431476405873 -0.08334415235762158 -0.04299213843199152 -0.08334415235762158 2.6014719449840804 0.011118118334772567 -0.04299213843199152 0.011118118334772567 2.458115026606342" pbc="F T T" C 0.10770798 0.29974846 0.24917156 14.57062039 3.58666161 5.70350522 C 1.56645190 1.75057754 0.01372022 -15.60723632 -4.92069742 0.23196819 C 1.48498828 0.40261086 1.71882811 -15.37028614 7.19746515 1.01415405 C 0.19035541 1.55691237 1.23216068 16.40690207 -5.86342935 -6.94962746