32 Lattice="6.221810177004237 0.0 0.0 0.0 6.221810177004237 0.0 0.0 0.0 6.221810177004237" Properties=species:S:1:pos:R:3:forces:R:3 energy=11479.974347556936 stress="-193.79132671663163 -5.575448668520999 0.8474955112907956 -5.575448668520999 -194.91089451577884 1.970369691662211 0.8474955112907956 1.970369691662211 -191.933017794586" free_energy=11479.974347556936 pbc="F F F" Xe 0.05020351 0.05628468 0.03320427 -1383.50953857 -1137.26537835 -1197.93158359 Xe 1.53995160 1.53168450 0.03383037 175.82943747 468.62444511 -1732.49468227 Xe 1.50420922 0.04043771 1.54744064 1002.36296556 -2102.91366427 358.81825691 Xe 0.04221041 1.50543336 1.63980324 -1954.71623217 973.61262312 -351.79747289 Xe 3.14004559 0.01348191 0.01564737 -109.02932394 -1512.44638579 -1200.42074344 Xe 4.64050229 1.55070722 0.01126214 1505.71784264 177.35853467 -1333.45946720 Xe 4.70594366 0.04048786 1.62464699 1248.16877543 -1436.89298814 -355.56503576 Xe 3.14365109 1.52013916 1.50108619 -412.50906252 547.28250600 877.87898459 Xe 0.01556711 3.12685362 0.00760228 -1476.29744116 -476.78538377 -1152.26113553 Xe 1.52598465 4.60703046 0.01700732 446.53730242 1613.95842120 -1361.55491461 Xe 1.51675084 3.13726942 1.55493625 557.10939892 -652.09750342 239.45544089 Xe 0.02097428 4.66731243 1.54318472 -1559.11895720 1401.92534682 22.53783739 Xe 3.06418668 3.08068671 0.00792355 343.44400818 251.62754540 -1311.85799617 Xe 4.63034782 4.64798345 0.01929993 746.61806006 601.94621656 -721.90511625 Xe 4.71593673 3.07458015 1.63239248 1160.62870471 178.61479087 -459.93740147 Xe 3.14502806 4.68991664 1.60978717 -494.52663184 1232.27703729 -526.13244299 Xe 0.04731487 0.03667243 3.12491725 -1309.05424580 -1747.33986206 332.38068315 Xe 1.61206470 1.53703747 3.15827342 -216.57794865 587.47195214 -448.61019036 Xe 1.62069794 0.03897714 4.67698011 -154.83835368 -1602.08527713 1369.30872433 Xe 0.03720777 1.50953238 4.66140430 -1127.70655411 507.12549089 1285.35586472 Xe 3.12798472 0.03838220 3.12106373 -58.51405215 -1622.96364267 -180.26076327 Xe 4.70717973 1.54312436 3.11559866 1191.23777045 237.51284901 388.36619256 Xe 4.62621959 0.02122269 4.67053349 790.45404099 -765.29972030 924.88236237 Xe 3.06651985 1.60404763 4.72652248 395.41465932 -211.27023579 1527.24993194 Xe 0.00253681 3.13479870 3.11094993 -1616.78766606 -338.91631520 367.26883801 Xe 1.50277503 4.63286344 3.09341032 324.33448442 2030.40323697 119.19050487 Xe 1.60977645 3.19634463 4.67803974 -917.78931102 -563.00584553 1770.66103377 Xe 0.02008262 4.71157247 4.70959221 -764.19704359 680.08453394 701.95276074 Xe 3.05693123 3.13074761 3.15680556 546.37445856 -274.58942127 -622.35496357 Xe 4.60621816 4.65447495 3.09857636 1433.49460832 1197.88310933 623.48161713 Xe 4.62169157 3.06001110 4.67792837 1225.18680205 418.04478085 1105.66886916 Xe 3.05513773 4.71053242 4.71812589 462.25904298 1338.11820355 942.08600682