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=-40.950393693884735 stress="-0.007280856250220491 0.0035371170637453066 -0.004533894467626217 0.0035371170637453066 -0.006834322499048155 -0.0001459608810800518 -0.004533894467626217 -0.0001459608810800518 -0.00761010035010697" pbc="F F F" Mt 21.01512894 20.76388630 21.17345192 6.07579784 5.36702055 5.96890295 Mt 22.63004832 22.63882818 22.67580650 -13.26566856 18.91299005 -61.94698378 Mt 23.93011182 21.00618241 21.07492101 -5.72392133 3.98449467 4.36874229 Mt 25.41642578 22.77188606 22.11583055 181.90001911 -186.73514818 201.89929872 Mt 21.00723984 24.18378102 21.52513560 -20.14398705 -21.26539702 -11.21322750 Mt 22.60431640 25.67238496 22.28108139 27.63705280 9.86387698 16.79325917 Mt 24.27546578 23.93381917 20.95373801 -198.39777846 184.59902919 -188.33483326 Mt 25.34713988 25.70336249 22.29699375 -1.99397146 -0.76416789 7.33779793 Mt 20.85294205 20.93578734 23.90390318 2.65109738 3.27234226 -8.12943044 Mt 22.41468440 22.31122700 25.24154796 -82.47074953 46.17349161 112.21693234 Mt 23.90889699 21.45324886 24.03835614 136.32299682 -104.71030968 -65.70528585 Mt 25.48909792 22.62036628 25.35064348 14.57347450 5.91773820 12.73502018 Mt 21.27002037 23.88230522 24.05431903 -98.30516619 -45.79045934 -96.87634201 Mt 22.20388082 25.20077192 25.41581467 65.03352805 87.80789945 91.33088348 Mt 24.18257481 24.29864411 24.18843404 -46.89158874 -46.69417078 -62.06992786 Mt 25.28125371 25.63741368 25.55220285 32.99886483 40.06076993 41.62519364