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=1245.7625174329885 stress="-0.02247552746689237 0.0001610932130244808 -0.0011377400982341206 0.0001610932130244808 -0.02120335092988961 -0.0007285826799223459 -0.0011377400982341206 -0.0007285826799223459 -0.02269239956088397" free_energy=1245.7625174329885 pbc="F F F" C 20.85540510 21.11115480 21.11044915 -29.60627821 -40.11491482 -45.99289847 C 22.70960170 22.34512630 20.83833517 -9.31308528 10.59774124 -39.23612599 C 22.31428531 20.83509776 22.36371066 -1.49881677 -41.69562972 3.18613212 C 20.77812781 22.48254321 22.23417995 -36.17366589 19.82897498 20.21943316 C 23.87679405 20.95894820 21.20259391 13.71444719 -47.86570082 -28.98277191 C 25.56504129 21.96425659 20.86550211 32.30503200 3.17171492 -36.45548072 C 25.28802619 21.22277084 22.68584377 26.89357010 -100.36078239 -78.29089266 C 24.18362810 22.69581920 22.64685009 -36.02482635 -43.59359772 -15.31847983 C 21.26959405 23.87804706 20.85402479 -22.02067348 1.60889885 -42.16740745 C 22.70996341 25.49207130 21.15300231 -20.95205267 41.48358302 -58.86727645 C 22.53848316 23.95774659 22.71726984 -31.72786217 -18.45572038 -20.68167322 C 20.95789336 25.38825682 22.04332575 -38.94906695 32.70069424 6.54810312 C 24.19178619 24.17895518 21.29140871 -27.20656465 -22.36777063 -120.25289265 C 25.61455359 25.53253581 21.14904689 30.87870202 32.11349250 -23.74398177 C 25.28091226 23.98699481 22.46603997 123.86657890 14.51275021 23.82364859 C 23.80598025 25.32157598 22.51361598 22.95272387 88.14459447 27.35871349 C 20.85198705 20.97567541 23.92466586 -46.93763615 -29.25278974 -1.25773894 C 22.49580977 22.02492495 23.97644859 -0.67630249 20.63968694 -13.82728850 C 22.26128685 20.84140700 25.31668137 -4.98131358 -56.59054970 46.27662524 C 20.91986395 22.44466750 25.59073906 -29.70735775 0.22759406 26.66510076 C 24.27219963 20.93381326 24.13132919 -16.67300491 -47.63235873 27.25050138 C 25.75978669 22.22592512 23.78504734 76.53539946 59.71639837 71.54381045 C 25.68365717 21.20288723 25.58343331 22.14246090 -14.68243397 31.14778647 C 23.49928362 22.34894620 25.72094491 15.98298167 4.23527090 40.98853183 C 21.23171545 24.17983874 24.10370736 -65.25744063 -15.37512333 -25.67754199 C 22.71219253 25.42485375 24.12990665 -16.30377858 71.97671816 -12.48836003 C 22.28220450 24.28278197 25.56210000 56.04938271 -81.57261951 64.20338566 C 21.13362859 25.32702941 25.57034430 -97.37330346 96.30274610 37.48831178 C 24.05853665 24.03926838 23.91561068 -1.77599407 -9.70816809 34.16063027 C 25.63661615 25.40480033 23.97889625 36.94451482 46.63804842 -4.12332876 C 25.29869006 24.11041876 25.26735611 49.44525685 -22.26659171 52.58971740 C 23.83533445 25.24148635 25.58611608 25.44797355 47.63584388 53.91370760