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=15.27219842584275 stress="-2.8786426170823147 0.1289795757459272 1.7681122766208128 0.1289795757459272 -1.9910629283820922 0.1464623365426709 1.7681122766208128 0.1464623365426709 -3.233096814958779" pbc="T T F" Cn 0.45843970 -0.18027191 0.10906305 -14.06522870 19.44028016 -18.09218312 Cn 1.51086727 1.40856385 0.09189945 58.74335020 -13.62659996 -57.09191874 Cn 1.67807203 -0.20778244 1.46949869 13.21715029 9.51735185 9.38388052 Cn 0.47603331 1.53019820 1.22680315 -57.89527178 -15.33103205 65.80022134