16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=77.94069098998068 stress="-0.005492672145948408 -8.478972677644452e-05 -0.0001346813811643028 -8.478972677644452e-05 -0.005330169513368088 -0.000124587016101204 -0.0001346813811643028 -0.000124587016101204 -0.0057030763901368825" pbc="F F F" S 21.09876657 20.90011496 20.82907923 -4.46849647 -4.34221104 -4.12111552 S 22.74624097 22.77404880 22.35498893 -24.67492016 -5.08939400 -12.15595968 S 24.21038109 21.20947124 20.85512851 0.54323512 -23.62425716 -26.32027451 S 25.55280714 22.41333883 22.34655491 49.58867070 -7.24880491 -14.33500692 S 20.87241235 24.08351600 20.91049160 -20.74115665 -2.32008569 -19.72496888 S 22.23480172 25.43858073 22.25205420 0.99723477 31.91163326 -2.63657825 S 24.15488783 24.05988540 20.70245745 9.00138184 16.90988502 -27.75897321 S 25.66431082 25.31425730 22.74070813 11.76357141 14.62424291 -7.69152601 S 21.03277713 20.89971974 23.83798133 -14.50123807 -10.62501642 1.34135283 S 22.46097674 22.32615808 25.71813893 -17.25564746 -0.93239999 27.84431848 S 23.83952211 21.19410236 23.83096497 -2.20550821 -50.45800500 8.73165589 S 25.38201197 22.43300593 25.22002482 35.38709521 -16.91544647 35.04434158 S 20.77696427 24.12040895 23.96512192 -19.18524997 1.42909876 14.17485392 S 22.72586561 25.79391194 25.22614529 -7.50028660 9.72813840 8.09937657 S 24.25957740 23.77761356 24.18220204 -6.23947479 35.68650538 8.85859612 S 25.39362841 25.73573857 25.52724172 9.49078932 11.26611696 10.64990759