32 Lattice="5.124742789698574 0.0 0.0 0.0 5.124742789698574 0.0 0.0 0.0 5.124742789698574" Properties=species:S:1:pos:R:3:forces:R:3 energy=-141.88915640119248 stress="-0.1457744834632013 0.0010675704213164927 0.007349153353234548 0.0010675704213164927 -0.14134135599790681 0.005332519623477089 0.007349153353234548 0.005332519623477089 -0.1449200747596058" free_energy=-141.88915640119248 pbc="F F F" C 0.00452611 0.00215918 0.00761429 2.89421856 2.90159689 2.99494032 C 1.30345434 1.29385669 0.01414994 -2.06972397 -2.07543165 -6.63999069 C 1.29134157 0.01747673 1.28437667 -2.68113980 -6.51020090 -2.01142115 C 0.01726298 1.29082135 1.28435859 -6.21341743 -2.22221253 -2.13653175 C 2.54651004 0.02456598 0.02121365 2.48793964 1.58139461 1.43823604 C 3.83754036 1.30206165 0.01339721 -1.78872446 -2.11887588 2.07701192 C 3.83806555 0.01808621 1.26974769 -1.71490784 1.89222525 -2.46016278 C 2.54402009 1.26533748 1.29640737 3.89709501 -3.13811417 -3.77040458 C 0.02083860 2.57246189 0.01980345 1.73038733 2.54929717 1.70854562 C 1.27741992 3.82343602 0.00636389 -2.34068864 -1.77705173 1.75905275 C 1.27176519 2.56325431 1.27779836 -3.49337209 3.79823589 -3.34606391 C 0.01138551 3.84559886 1.30276382 1.97176385 -1.98568257 -2.06984429 C 2.56600423 2.58730006 0.02258864 2.52453526 2.39549537 -5.79681691 C 3.83661445 3.84841945 0.01455685 -3.23601895 -3.20117548 3.23362826 C 3.84701223 2.54093363 1.30278832 5.80855430 2.21062120 -1.84344826 C 2.54042248 3.86424114 1.28270641 2.24167069 5.74528230 -1.80348347 C 0.01419691 0.00622565 2.58063237 1.83880926 1.95131539 2.38865008 C 1.30029044 1.29679326 2.56415230 -3.68336734 -3.29847068 4.15366833 C 1.26592574 0.02436200 3.83362028 -2.43076244 1.85914718 -1.75373098 C 0.01070126 1.25625445 3.82104370 1.80817902 -2.40901697 -1.75068509 C 2.57345869 0.00329019 2.54800313 2.27028493 -6.47859092 2.26131909 C 3.82315411 1.29969784 2.55182019 6.58899649 -1.83691711 1.96010629 C 3.85759413 0.02233853 3.83952389 -3.14433103 3.16041929 -2.97795891 C 2.58533262 1.26845210 3.82638179 2.22080668 -2.06872497 6.19072083 C 0.01437349 2.56486136 2.58267166 -5.95082183 2.14209808 2.31050261 C 1.29826127 3.83062301 2.55824502 -1.56329580 5.95504072 2.09770239 C 1.26226043 2.56871798 3.86591618 -1.87774841 2.29347981 5.65377038 C 0.00629484 3.86113809 3.84717236 3.05110481 -2.96561814 -3.02353942 C 2.54686121 2.56372694 2.56939419 3.54363674 4.40473575 3.95827478 C 3.85136932 3.82649515 2.55566078 -2.43293407 -2.46742774 2.11349339 C 3.82788359 2.56196611 3.84879540 -2.36444690 2.68684862 -2.15558627 C 2.55238214 3.86416986 3.86640716 2.10771842 -2.97372208 -2.75995462