32 Lattice="5.357213800745011 0.0 0.0 0.0 5.357213800745011 0.0 0.0 0.0 5.357213800745011" Properties=species:S:1:pos:R:3:forces:R:3 energy=-75.29318634191493 stress="-0.18851836119397247 0.00023471593394044373 0.0072401788522664864 0.00023471593394044373 -0.19301322122836995 0.032550160459046115 0.0072401788522664864 0.032550160459046115 -0.1712312314056136" free_energy=-75.29318634191493 pbc="F F F" C 0.00286560 0.02104434 0.00333382 3.04804981 3.38680089 3.05285071 C 1.36368713 1.33911426 0.01681049 -1.63007306 -0.13750013 -7.86163410 C 1.33690736 0.01765275 1.36911711 -0.37689969 -7.91365138 -0.54225378 C 0.00489878 1.33491461 1.35236160 -7.82703062 -0.76845523 -1.47111377 C 2.65290056 0.02606443 0.02587038 0.47022830 -1.42289444 -0.61084502 C 3.98523703 1.32465903 0.04285260 0.40156890 1.30539245 -0.14272457 C 4.02103083 0.01210986 1.32544294 -0.62191758 0.96022699 2.44730360 C 2.67394590 1.32753275 1.34626209 0.04274036 2.00240467 3.72745132 C 0.04229364 2.68406879 0.01937006 0.18189307 -0.26933675 0.15141659 C 1.33983103 4.02056606 0.02145174 1.86919972 -0.77504780 1.51400318 C 1.31378607 2.67676392 1.31133657 2.90689178 -0.68928150 -0.28400320 C 0.01237342 3.99235699 1.36393652 -0.14106273 1.36694387 -0.96118861 C 2.69432662 2.67333076 0.00888970 -0.27342608 1.26154520 -6.43939308 C 3.99339486 4.01696622 0.00937614 -2.47729593 -2.30931294 2.21995313 C 4.01214861 2.71111610 1.36067739 5.96400556 -0.94576181 0.87178605 C 2.70176438 4.03465854 1.36758831 -1.57098044 6.15425628 -0.38784045 C 0.00397666 0.02095915 2.67061051 -0.70515205 -0.69174210 0.94209282 C 1.31185666 1.36333402 2.67326756 0.91950346 3.27752280 -1.52580869 C 1.33981284 0.03871593 4.01650663 -0.16080848 -0.65789671 0.49713644 C 0.01008564 1.32176400 4.01070446 0.69534588 1.10260609 -0.44493317 C 2.65199486 0.00679770 2.69997091 1.45093623 -6.76547406 -0.84748972 C 4.02741837 1.34102001 2.69755742 5.80043214 -0.02907689 -1.23455201 C 3.99399922 0.01442497 4.01641004 -2.12331523 2.36370528 -2.65283253 C 2.67536684 1.35037047 4.00411227 1.27269534 0.29500928 7.05609153 C 0.00825333 2.70307188 2.65562434 -6.62496223 0.18280893 3.68527059 C 1.35283140 4.00939233 2.68490553 -0.04234166 6.44278850 1.08710920 C 1.35286443 2.66978002 4.01226850 -2.78909966 1.19305023 6.63586035 C 0.00357565 4.02998423 4.04253551 4.19603127 -4.42394108 -4.15086589 C 2.67561683 2.68117679 2.68609550 -1.96293415 -3.08099003 -3.70763124 C 4.01657402 4.02669387 2.71622950 0.71449568 0.74011585 -0.96009474 C 4.01474954 2.71783921 4.01482282 0.49350696 -1.90655900 -0.16816692 C 2.69124119 3.99475951 4.02301397 -1.10022487 0.75174453 0.50504597