32 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=-29.18672473480018 stress="-0.00037396270381318913 -0.000514562535322813 -6.906074253640929e-05 -0.000514562535322813 -4.099870242341298e-05 0.00028022797886721854 -6.906074253640929e-05 0.00028022797886721854 0.0004090198958690613" free_energy=-29.18672473480018 pbc="F F F" C 20.88909689 21.11115480 21.11044915 -1.11632219 5.51662023 6.14636808 C 22.70960170 22.31143450 20.86432452 2.44583591 -5.43963700 -4.26779791 C 22.28829595 20.83509776 22.64041416 5.72486177 0.87079153 -3.19261748 C 20.77812781 22.51878885 22.32834452 -2.04615823 -7.00124304 -5.27456364 C 23.60009055 20.95894820 21.16634827 -9.88178548 3.06851102 3.98390609 C 25.47087672 22.20865944 20.86550211 -4.33167284 1.86717943 5.22841459 C 25.28802619 20.97836799 22.68584377 -3.51918918 5.87596737 4.39912135 C 24.18362810 22.69581920 22.34863482 6.85823720 -3.41043081 0.72711916 C 21.26959405 24.17626233 20.85402479 -0.42612773 3.05545761 4.88815421 C 23.00871167 25.49207130 20.92591203 3.99365007 0.58711228 1.10801101 C 22.53848316 23.95774659 22.29942344 7.97024602 -7.61042960 -0.93225662 C 20.95789336 25.24962341 22.32877138 -6.52834449 0.11318436 -0.67753261 C 24.19178619 23.92541155 21.29140871 -9.59646494 -3.33128392 -4.54977674 C 25.59648790 25.53253581 21.06906554 4.72344293 0.52479280 3.79850728 C 25.28091226 24.10609294 22.46603997 2.69244904 12.45509236 2.17158023 C 23.80598025 25.52227801 22.51361598 -5.30920511 2.45659894 2.54649448 C 20.84992252 21.25754780 24.06329927 -1.00563569 2.65337431 2.50181744 C 22.43745442 22.27846858 24.00452620 1.75023880 -4.76426765 -0.25665287 C 22.34126820 20.84140700 25.31668137 3.42220418 4.21293362 2.23288865 C 20.90439734 22.24396547 25.59073906 -1.96333650 -2.31190455 -1.38812258 C 24.27219963 20.93381326 24.13132919 3.30034952 -8.68315084 8.57685971 C 25.75978669 22.32762633 23.78504734 9.86186071 5.55067469 -3.88379618 C 25.68365717 21.08082088 25.58343331 -8.58347513 -1.77320050 -7.89016180 C 23.51489789 22.44892056 25.72094491 -5.39616250 -4.75420126 -2.93660921 C 21.23171545 24.18190327 23.82183498 -1.05516977 4.42946391 -13.02220967 C 22.71219253 25.27984268 24.12990665 5.97743229 0.35443048 -11.93567701 C 22.39263309 24.28278197 25.56210000 -2.00302350 1.76872849 9.62487497 C 21.13362859 25.18215792 25.57034430 -2.39540573 -2.04039146 6.91990328 C 24.04852473 24.05473499 23.91561068 -3.69605151 -10.13264990 -7.51629255 C 25.63661615 25.40480033 23.93000218 6.52519488 -1.49013782 0.30564694 C 25.29869006 24.11041876 25.26735611 -0.94290494 6.27481652 -2.86594177 C 23.74867328 25.08804126 25.58611608 4.55043212 1.10719835 5.43034120