32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2166.3569289361644 stress="-13183.71704159749 3370.263856808012 1320.0751837656871 3370.263856808012 -10432.529098841873 -1449.7617254082593 1320.0751837656871 -1449.7617254082593 -11254.708785546456" pbc="F F F" Br 0.22988329 -0.15053622 0.08659729 -620.90291662 -306.68747180 -558.02187061 Br 1.50692072 1.20719581 -0.28009852 -967.39124625 1120.96682831 -364.48342807 Br 1.39840449 0.17706077 1.27631824 986.16406148 -503.53590859 610.54657887 Br 0.07205936 1.20499676 1.53482680 -651.88770865 578.43569198 49.65145432 Br 2.74119978 0.16305968 -0.10793918 1104.87833623 -1077.38859568 -133.17333362 Br 4.54350670 1.68097869 0.27775582 59.85401717 -919.84199137 -1340.53013884 Br 4.26126312 0.22320004 1.42683138 319.10586147 -448.76998739 141.17987200 Br 2.97856265 1.41924785 1.20935934 -407.30970613 442.67817592 254.44084611 Br -0.15266535 2.90966189 -0.10762410 -24.99756123 -34.73172224 -20.96344126 Br 1.52692209 4.28084434 -0.07057143 -673.48745683 410.16899183 -1256.88560996 Br 1.48777981 2.85874807 1.33675638 -388.41420124 -495.15821022 99.07463641 Br 0.22635511 4.70287994 0.94468719 -564.74878341 209.15650195 458.90215362 Br 2.88152869 3.28910490 -0.02802233 926.60416269 -1007.63705425 -661.36823700 Br 4.39327567 4.70585027 0.11584392 28.24588443 25.63738632 1.28176027 Br 4.72496063 2.81065407 1.41442876 187.70256122 1127.36392386 1071.75287732 Br 2.49950887 4.27177154 1.29625995 848.94139520 904.96874865 966.96984881 Br 0.09319736 0.07067480 3.09906327 -104.63391415 -180.20717376 63.14158538 Br 1.58586421 1.29277873 2.92087931 -112.38703828 362.85587511 -271.23139839 Br 1.98251412 0.14863700 4.21774785 -2155.07656906 -328.67111771 2365.56856831 Br 0.27245932 1.45845976 4.55790891 25.75809139 -469.86574789 493.52884068 Br 3.09953437 0.12255250 3.16477078 1949.98129839 -186.74407549 -2405.63639478 Br 4.29834557 1.64814700 3.04249700 527.09276643 -363.14165154 -33.26221686 Br 4.18240296 0.03529693 4.55427664 285.82741983 -26.83559956 364.26428985 Br 2.63491414 1.88903355 4.74294898 939.95548676 -857.55371008 154.04096166 Br -0.05760869 2.63843234 3.34511196 -134.46525597 -13.82655343 -716.50096432 Br 1.77866512 4.29430506 2.91063927 -317.58802141 102.44847472 254.44640842 Br 1.43081479 2.99421449 4.73914816 -1103.65136845 692.43293649 101.37035922 Br -0.12298560 4.16326385 4.19882678 -64.73209377 478.65203799 234.47041902 Br 2.92659962 2.70228961 3.00485068 -373.44960293 368.84638396 -157.94937571 Br 4.12800900 4.51414781 2.94939350 25.69230255 29.06834140 -35.90079501 Br 4.29683989 2.98031974 4.44266959 181.89752866 43.01145420 131.57542448 Br 2.75757104 4.16702159 4.51824485 267.42227047 323.90481831 139.70031968