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=91.59512556311073 stress="-0.0021940967289719305 4.667742268438711e-05 2.9448173540062257e-05 4.667742268438711e-05 -0.0020459068800947463 -0.0003489799321689961 2.9448173540062257e-05 -0.0003489799321689961 -0.0020750238267154674" free_energy=91.59512556311073 pbc="F F F" O 20.85540510 21.11115480 21.11044915 -6.03656112 -4.44243504 -4.83934976 O 22.70960170 22.31143450 22.19032222 -7.65271066 4.96905174 2.08972197 O 23.78829595 20.83509776 21.14041416 6.65296370 -13.90773883 -11.64654639 O 25.27812781 22.49446427 22.32834452 12.33085983 -0.35301642 -2.79919394 O 20.87679405 24.02224746 21.20259391 -8.52454490 0.72008184 -6.16521715 O 22.56504129 25.20865944 22.36550211 -12.31426274 21.99373990 9.61006118 O 23.78802619 24.22277084 21.18584377 15.44635184 -4.63949586 -21.96532249 O 25.68362810 25.69581920 22.58430451 4.15705360 3.73407146 -1.15458211 O 21.26959405 21.17626233 23.85402479 -7.33883860 -6.66198378 2.98412658 O 22.48843198 22.49207130 25.65300231 -1.26954201 -2.90016787 10.53728456 O 24.03299744 20.95774659 23.91852158 0.14999771 -11.41436670 2.13097199 O 25.45789336 22.22952502 25.27041603 7.94208349 0.08874581 7.02160584 O 21.19178619 24.02036218 24.10809008 -10.91366971 1.53378880 1.56483629 O 22.53441754 25.53253581 25.64904689 -1.68257015 5.90077963 5.40802405 O 23.78091226 23.85005841 23.96603997 4.68860849 2.20717997 3.35275582 O 25.30598025 25.32157598 25.51361598 4.36478123 3.17176535 3.87082356