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=-0.48180364990023755 stress="1.3202497427004328e-05 1.936454404868413e-06 5.526607572946204e-07 1.936454404868413e-06 1.4960871355480204e-05 1.4957725297034273e-06 5.526607572946204e-07 1.4957725297034273e-06 1.4932333078316996e-05" pbc="F F F" user14 20.73775074 21.21596485 20.77112428 0.02038859 0.01641818 0.02214953 user14 22.70736641 22.45941251 22.32737506 0.07801569 0.04181685 -0.03996946 user14 23.99504480 21.07135975 20.90402137 -0.03187303 0.05312457 0.05885035 user14 25.62856250 22.71051227 22.75733735 -0.10819835 0.05771265 0.03410801 user14 21.22820354 24.25715298 21.10245711 0.08432971 0.03657405 0.09965565 user14 22.17481696 25.59157420 22.49930921 -0.04356072 -0.13106969 -0.02678314 user14 23.89696404 23.90897090 21.28777027 -0.06147459 -0.06947948 0.11937395 user14 25.29351842 25.75028592 22.56287727 -0.03822498 -0.06075360 0.03035114 user14 20.87758090 21.28932651 23.75797967 0.05614603 0.04353564 -0.00046569 user14 22.37019546 22.35580172 25.44777785 -0.00976217 0.00173911 -0.06694205 user14 23.81322236 20.72818683 23.72587647 -0.01916978 0.06567094 -0.02135390 user14 25.47482765 21.91795081 25.76428595 -0.01959028 0.00697655 -0.02558565 user14 21.06272911 24.15099045 24.00019407 0.08273779 0.02879475 -0.01568037 user14 22.24287656 25.66210106 25.42994781 -0.01336736 -0.04541809 -0.04999936 user14 24.24206577 23.98404227 23.92125868 0.05405997 -0.01473202 -0.07267018 user14 25.51781404 25.54990360 25.31527613 -0.03045652 -0.03091041 -0.04503882