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=-39.85943458334686 stress="2.3256422147028297e-06 0.000147999171256777 0.00011514697576131944 0.000147999171256777 0.00033856351196992767 -0.000329130679869763 0.00011514697576131944 -0.000329130679869763 -0.00011318820709114233" free_energy=-39.85943458334686 pbc="F F F" Si 20.85540510 21.11115480 21.11044915 1.00359147 5.33811443 0.88956124 Si 22.70960170 22.16342156 22.31401058 -5.47178585 4.91051291 4.17522764 Si 23.78829595 20.83509776 21.14041416 3.34793322 -4.30166901 -4.71685639 Si 25.34142708 22.45624327 22.10681310 -1.58983438 -0.61780101 0.16388217 Si 20.87130833 23.95894820 21.12245785 1.70828647 -5.73338382 1.58292738 Si 22.56504129 25.20865944 22.36550211 -11.70578092 7.61265324 7.43883856 Si 23.78802619 24.22277084 21.18584377 12.36512758 -7.29564817 -7.34166543 Si 25.68362810 25.69581920 22.64685009 -3.87486717 -3.27439869 1.26049906 Si 21.01355952 21.26700139 24.12622441 1.77870858 3.58238575 -0.76308074 Si 22.64377666 22.62340049 25.65300231 1.57781187 -2.31773279 -2.31138169 Si 24.29826985 21.14140375 24.12140880 -6.42794931 -3.09073572 -5.24647936 Si 25.45789336 22.38825682 25.35384934 3.35607149 10.52637681 5.95266180 Si 20.98764022 24.12704972 24.51235362 -1.43201331 -2.71368402 -0.78607774 Si 22.61455359 25.35437079 25.57390064 1.29045701 1.10815871 1.47162937 Si 23.78091226 24.23599959 23.96603997 4.53349680 -0.25895843 0.10555372 Si 25.30598025 25.10378048 25.51361598 -0.45925355 -3.47419018 -1.87523957