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=4.561215733085354 stress="-0.00015703062953221532 6.706199620068167e-06 -5.2752172831014846e-05 6.706199620068167e-06 -0.00015091428304605612 -6.79805416730114e-05 -5.2752172831014846e-05 -6.79805416730114e-05 -0.0001714309046547544" free_energy=4.561215733085354 pbc="F F F" F 20.93166693 20.86811158 20.95962528 -0.52135892 -0.14253229 -0.12142190 F 22.58611608 22.53369179 22.52598936 -1.48112065 -1.26102618 -1.53952290 F 23.49045719 20.96375436 20.90583543 0.56584401 -0.52995201 -0.60617341 F 25.25559716 22.20178472 22.79874826 -0.50151809 -2.07848138 0.89552961 F 20.77290972 24.07500422 20.86136659 -0.31097982 -0.02287518 -0.31395771 F 22.55835534 25.24645637 22.48193431 -0.33226526 1.58684764 -0.52120574 F 23.92001865 24.03166700 20.70342959 0.33906114 -0.03744210 -0.65986656 F 25.40085166 25.49793547 22.78187239 0.35001684 0.28651066 -0.71102246 F 21.01001192 20.98453339 24.10170120 -0.75875257 -0.80724582 -0.40725361 F 22.37793365 22.21904386 25.50082602 0.39041915 0.23178403 1.21305923 F 24.24624097 21.14302402 23.85498893 1.65850439 0.45304504 -1.60744519 F 25.61042859 22.59148321 25.35512851 0.53904292 0.18506067 0.82631926 F 21.05280714 23.84634476 23.84655491 -1.57171347 -0.11061552 0.10597541 F 22.09243717 25.32230844 25.41049160 0.22379054 0.62077713 0.69332395 F 23.72286420 23.71554500 23.75205420 1.31017324 1.46731164 2.04095837 F 25.57150341 25.55988540 25.20245745 0.10085654 0.15883365 0.71270365