16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=907.277402932905 stress="-4476.277987266732 -1239.9406191226592 -271.634570270754 -1239.9406191226592 -3974.9998370294543 -1296.4014538474385 -271.634570270754 -1296.4014538474385 -4320.790574653964" pbc="F F F" Fm -0.10396270 -0.15620638 -0.10457267 -30.68914008 -32.63437107 -23.62406183 Fm 1.73163511 1.07390173 1.30794021 -366.36150963 124.74088215 420.40693931 Fm 2.97749113 0.18094855 -0.26934771 281.71871294 -348.43211153 -374.66704587 Fm 4.36476919 1.85911845 1.75971384 318.10127677 -322.28218647 -60.87724844 Fm -0.21647320 2.64138969 0.27079719 -29.92977737 11.09908326 -55.66054101 Fm 1.33495589 4.41448690 1.76527559 -6.10953970 404.12477713 -335.79258266 Fm 3.00106912 2.58026654 -0.05504515 -18.02713682 280.32667664 -217.10110252 Fm 4.47168517 4.26192617 1.66725599 329.62051836 358.62091381 -257.45294412 Fm -0.14847486 -0.04294845 3.32258044 -46.02955679 -37.74806775 -28.46513490 Fm 1.56806309 1.35675313 4.58762363 -107.95927776 75.76517868 147.77999745 Fm 3.10687040 0.16613670 3.25139459 -1080.73616432 -1299.75476190 -1185.69209945 Fm 4.29155369 1.28307180 4.38006685 1241.49254653 1127.31532564 1190.45560063 Fm -0.09579980 3.06406176 2.86603169 -245.56851373 -207.96322618 198.95390491 Fm 1.77125725 3.95067188 4.71542804 -164.13764523 139.25819845 262.78799716 Fm 2.91794122 3.23886177 2.87348662 -170.78647013 -331.02419598 235.77349732 Fm 4.40070081 4.39310501 4.45364314 95.40167698 58.58788512 83.17482402