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=-4.151579386137907 stress="0.00023445323765561353 2.8549566409771808e-05 -1.2066959803928253e-05 2.8549566409771808e-05 0.00020849290003406118 8.709198782109628e-05 -1.2066959803928253e-05 8.709198782109628e-05 0.0002369253436504032" free_energy=-4.151579386137907 pbc="F F F" C 20.91870436 21.04860922 21.20118821 -0.02807147 -0.00790902 -0.08268108 C 22.70960170 22.31143450 22.33833517 -0.61541218 -4.21942870 0.62928233 C 23.78829595 20.83509776 21.14041416 -1.70759121 2.19735820 1.71761366 C 25.55032744 22.45260211 22.45967371 -0.06435307 -0.38815765 0.35060183 C 21.13658074 23.95894820 21.38625107 2.42868113 2.26510078 1.87707911 C 22.56504129 25.20865944 22.36550211 1.92548812 -6.06652027 -4.40573296 C 23.78802619 24.22277084 21.18584377 -3.54780674 3.07286306 3.29828521 C 25.47948213 25.64391375 22.86779500 0.14486539 0.10662685 0.01330242 C 21.50130950 21.35816560 23.85402479 2.19802110 1.88976163 -2.15954269 C 22.53179838 22.70426383 25.57785606 -0.95251391 0.60557511 -1.08351532 C 24.16838981 21.24052856 23.98062158 3.27610269 2.45863698 1.57472280 C 25.59152195 22.38825682 25.09744544 -2.59033524 -2.33038504 -1.94262459 C 21.26213048 24.17895518 24.29140871 1.24202961 -0.04376924 1.55396952 C 22.61455359 25.53253581 25.64904689 -0.74725633 -0.60421262 -0.71351282 C 23.78091226 24.10609294 23.96603997 -0.99841112 1.10312001 -0.60943373 C 25.35450498 25.37631097 25.42922666 0.03656322 -0.03866009 -0.01781369