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=-9.219478143223226 stress="7.050246884526743e-05 2.527550262527832e-05 2.6060873145036153e-05 2.527550262527832e-05 7.92894498256649e-05 -1.1283362959197322e-05 2.6060873145036153e-05 -1.1283362959197322e-05 6.871530881784609e-05" pbc="F F F" H 20.85540510 21.11115480 21.11044915 0.33087010 0.27191492 0.25655087 H 22.70960170 22.31143450 22.33833517 -0.30288717 1.24321153 0.65551945 H 23.64028300 20.89839703 21.13492844 0.28463174 -0.36491264 -0.22160440 H 25.27812781 22.51878885 22.32834452 -0.46702189 0.20073965 0.29663109 H 20.87679405 23.95894820 21.20259391 0.37801470 -0.35404999 0.30900254 H 22.56504129 25.20865944 22.36550211 -1.23319968 0.88406805 1.01702515 H 23.78802619 24.22277084 21.18584377 1.04283643 -1.09976230 -0.69973167 H 25.68362810 25.69581920 22.64685009 -0.46948358 -0.44420425 0.17873297 H 21.26959405 21.17626233 23.69529298 0.21546787 0.22810698 0.05291710 H 22.70996341 22.49207130 25.65300231 0.18231796 0.22454758 -0.63747878 H 24.03848316 20.95774659 23.91852158 -0.30461097 0.45535910 -0.22516400 H 25.45789336 22.38825682 25.27041603 -0.37762568 0.33755200 -0.30413930 H 21.19178619 24.17895518 24.29140871 0.41799648 -0.38996402 -0.40590557 H 22.61455359 25.53253581 25.64904689 0.31076418 -0.31368824 -0.28187095 H 23.78091226 24.10609294 23.80744697 0.29590791 -0.58846353 0.34780378 H 25.30598025 25.32157598 25.51361598 -0.30397839 -0.29045483 -0.33828828