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=2166.3569289361517 stress="-0.1779467260770626 0.0454900099450384 0.017817665259767988 0.0454900099450384 -0.1408126700523951 -0.019568104489367466 0.017817665259767988 -0.019568104489367466 -0.15191000952308584" free_energy=2166.3569289361517 pbc="F F F" Br 21.22988329 20.84946378 21.08659729 -620.90291662 -306.68747180 -558.02187061 Br 22.50692072 22.20719581 20.71990148 -967.39124625 1120.96682831 -364.48342807 Br 22.39840449 21.17706077 22.27631824 986.16406148 -503.53590859 610.54657887 Br 21.07205936 22.20499676 22.53482680 -651.88770865 578.43569198 49.65145432 Br 23.74119978 21.16305968 20.89206082 1104.87833623 -1077.38859568 -133.17333362 Br 25.54350670 22.68097869 21.27775582 59.85401717 -919.84199137 -1340.53013884 Br 25.26126312 21.22320004 22.42683138 319.10586147 -448.76998739 141.17987200 Br 23.97856265 22.41924785 22.20935934 -407.30970613 442.67817592 254.44084611 Br 20.84733465 23.90966189 20.89237590 -24.99756123 -34.73172224 -20.96344126 Br 22.52692209 25.28084434 20.92942857 -673.48745683 410.16899183 -1256.88560996 Br 22.48777981 23.85874807 22.33675638 -388.41420124 -495.15821022 99.07463641 Br 21.22635511 25.70287994 21.94468719 -564.74878341 209.15650195 458.90215362 Br 23.88152869 24.28910490 20.97197767 926.60416269 -1007.63705425 -661.36823700 Br 25.39327567 25.70585027 21.11584392 28.24588443 25.63738632 1.28176027 Br 25.72496063 23.81065407 22.41442876 187.70256122 1127.36392386 1071.75287732 Br 23.49950887 25.27177154 22.29625995 848.94139520 904.96874865 966.96984881 Br 21.09319736 21.07067480 24.09906327 -104.63391415 -180.20717376 63.14158538 Br 22.58586421 22.29277873 23.92087931 -112.38703828 362.85587511 -271.23139839 Br 22.98251412 21.14863700 25.21774785 -2155.07656906 -328.67111771 2365.56856831 Br 21.27245932 22.45845976 25.55790891 25.75809139 -469.86574789 493.52884068 Br 24.09953437 21.12255250 24.16477078 1949.98129839 -186.74407549 -2405.63639478 Br 25.29834557 22.64814700 24.04249700 527.09276643 -363.14165154 -33.26221686 Br 25.18240296 21.03529693 25.55427664 285.82741983 -26.83559956 364.26428985 Br 23.63491414 22.88903355 25.74294898 939.95548676 -857.55371008 154.04096166 Br 20.94239131 23.63843234 24.34511196 -134.46525597 -13.82655343 -716.50096432 Br 22.77866512 25.29430506 23.91063927 -317.58802141 102.44847472 254.44640842 Br 22.43081479 23.99421449 25.73914816 -1103.65136845 692.43293649 101.37035922 Br 20.87701440 25.16326385 25.19882678 -64.73209377 478.65203799 234.47041902 Br 23.92659962 23.70228961 24.00485068 -373.44960293 368.84638396 -157.94937571 Br 25.12800900 25.51414781 23.94939350 25.69230255 29.06834140 -35.90079501 Br 25.29683989 23.98031974 25.44266959 181.89752866 43.01145420 131.57542448 Br 23.75757104 25.16702159 25.51824485 267.42227047 323.90481831 139.70031968