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=-21.527586990383714 stress="42.728299171883194 3.1375107192791294 5.563009133545586 3.1375107192791294 44.000752525801644 3.9209158387782406 5.563009133545586 3.9209158387782406 43.375072646155914" pbc="F F F" C 0.15772700 0.19326219 -0.01495916 1.10102980 1.71099215 1.39743534 C 1.42556059 1.67881607 1.57246592 1.21121778 0.38170708 1.44292282 C 3.23045184 0.29829666 -0.02065565 0.82002599 2.49554915 3.63162192 C 4.40665727 1.27718416 1.55077450 -4.81019592 -1.15528790 -0.61206388 C -0.11077883 2.88913594 0.00387043 1.68333952 -1.20438582 1.63887701 C 1.63711843 4.60867024 1.47604521 1.33980302 -3.18795164 0.53562454 C 3.09063848 3.16141272 0.24824674 -0.85354535 0.05834911 3.51168720 C 4.60989385 4.70914245 1.45873523 -1.72587410 -1.45590653 0.00277424 C 0.21071555 -0.29638301 2.98446086 2.10264907 2.27093745 -0.12264866 C 1.12943793 1.56543165 4.36447814 -0.25455886 1.25966232 -4.34620139 C 2.76334785 0.14573287 2.78228795 -0.62139052 3.98289418 -1.71780467 C 4.60821729 1.30936150 4.32485097 -1.46211045 0.29094451 -1.70884144 C -0.06251967 3.04239513 3.11263573 4.36934624 -0.96697906 0.89935850 C 1.19899645 4.71981806 4.21701928 -0.20055530 -2.51474701 -2.15453648 C 2.81560473 2.93591280 3.06719023 -2.09091647 -1.36703517 -1.56062926 C 4.59260563 4.73214988 4.41004078 -0.60826445 -0.59874280 -0.83757579