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=0.5607103495455962 stress="-9.197031673455635e-05 -1.3172100028395335e-06 -6.437293473608132e-06 -1.3172100028395335e-06 -8.60055248446164e-05 2.6346854676196256e-06 -6.437293473608132e-06 2.6346854676196256e-06 -8.422589936392917e-05" free_energy=0.5607103495455962 pbc="F F F" O 20.77761356 21.18220204 20.89362841 -0.16074407 -0.17216074 -0.08697566 O 22.73573857 22.52724172 22.27538150 -0.49172246 0.19815866 -0.08947954 O 23.70296332 20.84887301 21.22083292 0.08132331 -0.46421939 -0.42310619 O 25.28984966 22.48735431 22.42299150 0.77438267 0.11126376 -0.22457599 O 20.90698366 23.94671956 20.82825321 -0.14328149 0.16502982 -0.11671787 O 22.63102478 25.59995250 22.76120756 -0.23231857 0.41991425 -0.14544658 O 24.01193751 24.25226748 20.96431997 0.04865376 0.12377856 -0.52334539 O 25.54396501 25.57236142 22.58886938 0.28147684 0.22348641 0.00437670 O 21.23854596 20.76922180 24.07998149 -0.25300904 -0.22942490 0.00013688 O 22.52031036 22.68745344 25.52015752 -0.15675177 -0.19763093 0.72682847 O 23.86244468 21.27711528 23.87871118 0.05979273 -0.74185988 0.32802077 O 25.25213077 22.23125112 25.21824351 0.44870598 -0.15190704 0.39047570 O 21.13616082 23.76429260 24.12968218 -0.52567688 0.17131253 -0.11171633 O 22.71980528 25.79977655 25.68543805 -0.13456080 0.22545473 0.21962912 O 23.95460942 24.07327937 24.19989723 0.18906363 0.19546635 -0.11677758 O 25.62961200 25.37425859 25.65720406 0.21466616 0.12333781 0.16867351