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=46.072121358404246 stress="-4.667078064254337 0.5977529748912735 -0.36632752876841235 0.5977529748912735 -6.171626168351818 -0.3002601711557239 -0.36632752876841235 -0.3002601711557239 -6.037029312113668" pbc="F T T" Si 0.29768454 -0.01726309 -0.13934333 -44.16502739 -19.33423465 26.82227021 Si 1.67089611 1.41979814 -0.29779682 48.58207175 15.20608530 25.61644928 Si 1.21755886 0.15136103 1.39917148 61.91504049 -38.60389363 -28.41135510 Si 0.26235339 1.34838096 1.71005355 -66.33208485 42.73204298 -24.02736439