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=1707.7593062763822 stress="-0.2916790024693186 0.031477934703316654 -0.16456389068952607 0.031477934703316654 0.0008402118711137006 0.1822756500151883 -0.16456389068952607 0.1822756500151883 0.05698925866564025" free_energy=1707.7593062763822 pbc="F F F" C 20.88909689 21.13714415 21.07420351 202.32498253 -102.75957990 -392.67079997 C 22.61543713 22.06703166 21.13708343 -605.78221655 205.28915347 -148.03141094 C 22.06120567 20.89345311 22.38687053 2.41278618 -307.54574321 351.20424623 C 20.97882984 22.22221844 22.22919618 -131.01908070 450.20628814 237.17133400 C 23.87472952 21.24082058 21.21260583 476.30519173 -47.94261380 156.46600546 C 25.54957468 22.31036064 20.86632813 -299.15030658 206.80782175 165.19914870 C 25.53426717 21.36579486 22.54083270 324.40890502 -912.45850859 -287.21233471 C 24.29405669 22.90529044 22.50197860 -2498.89735710 -3309.60445423 1125.13816127 C 21.32240119 24.08960116 21.00891261 9.55967748 -119.03982345 0.04718113 C 22.76984881 25.19452875 21.31731314 -175.98751908 68.33599556 -9.16837603 C 22.35274046 23.94618724 22.45129871 388.94436423 -256.03123019 -103.03186972 C 20.85761310 25.26191818 22.23139277 -46.37410305 43.36361152 40.50246212 C 23.97397926 24.39709411 21.05856940 -622.45834330 -1022.86750130 125.37811887 C 25.44551856 25.41454779 21.08205282 1124.51594565 781.11240040 7.95439157 C 25.00093708 23.88305721 22.38265556 1934.47909153 4107.53159492 -632.95261551 C 23.77110217 25.04772127 22.53464743 164.77395639 -63.09146663 16.33663986 C 21.03418910 20.86930382 24.29903784 -4691.93185777 3249.05076799 661.60826805 C 22.46469614 22.05385008 23.69747760 258.33160907 56.27597027 -53.75374432 C 22.19014120 21.06223992 25.10653103 7317.08486457 -1824.69699949 1964.29422944 C 20.90721825 22.16695697 25.49772272 -2640.50620525 -1359.15730156 -2932.05753555 C 24.45327072 21.06483804 24.23128169 -441.09597317 -456.40009853 -1327.14878555 C 25.72410666 22.26989013 23.85740876 -705.62705436 620.44703888 -254.53004864 C 25.45287897 20.98518418 25.60374366 -168.81097512 734.15729424 848.28445502 C 23.98330747 22.46825206 25.60065268 589.14386268 -273.63125653 509.06227426 C 21.23171545 24.18190327 23.82183498 -5493.44773840 6010.56719539 2043.53228495 C 22.98930781 25.30356493 23.88203743 -53.52205571 -1.41707122 53.79936138 C 22.28220450 24.28278197 25.56210000 10613.85240998 -4655.03385822 8059.87154619 C 21.13362859 25.32702941 25.57034430 -5120.78941986 -1413.61351733 -10011.14930831 C 23.77977585 23.77297850 24.05177150 247.47135338 -84.10989066 -8.54347531 C 25.40090875 25.35940976 23.95047441 54.36294445 -102.40021570 -427.84210684 C 25.49858729 24.24003076 25.14161470 22.46221562 -241.58894348 169.41046862 C 23.99253851 25.00713482 25.47119209 -35.03395447 20.24494148 52.83183428