32 Lattice="6.21977525113423 0.0 0.0 0.0 6.21977525113423 0.0 0.0 0.0 6.21977525113423" Properties=species:S:1:pos:R:3:forces:R:3 energy=11943.18194575872 stress="-200.90244907300925 -8.151570351102764 -0.9229539718210228 -8.151570351102764 -201.5335054458854 -1.1495194389127306 -0.9229539718210228 -1.1495194389127306 -202.05377713290295" free_energy=11943.18194575872 pbc="F F F" Xe 0.03328474 0.05804140 0.03949901 -860.51871153 -846.87823276 -893.94631805 Xe 1.58355869 1.60680950 0.03084426 -548.95733770 -524.73772874 -1902.74994045 Xe 1.60316382 0.02075441 1.53566830 -482.26682154 -1686.14324777 136.39948908 Xe 0.03724042 1.60292613 1.55936954 -2020.18052566 -501.11873680 -292.32237767 Xe 3.18567167 0.05318354 0.05969289 -290.60958514 -1558.73647809 -1707.49373982 Xe 4.71460941 1.53876599 0.03246733 1299.14356719 363.78191312 -1212.07469759 Xe 4.65381090 0.05835568 1.60230838 1683.97490454 -1404.31954527 -18.55768898 Xe 3.09884979 1.55347315 1.52550817 334.14550275 592.06835308 869.41683157 Xe 0.02257308 3.16945717 0.01885248 -1368.52541145 -686.36252014 -1694.65523303 Xe 1.50373838 4.68452812 0.05411619 462.92184735 1290.96121163 -1622.05967206 Xe 1.52733939 3.09565992 1.59442445 685.48608718 500.95787521 -241.00328018 Xe 0.00143601 4.60512903 1.50472846 -1576.50540025 1640.01389675 889.92570916 Xe 3.05982782 3.05397505 0.03835059 592.17619020 829.31187144 -1792.96338090 Xe 4.64601988 4.71589771 0.05974096 713.98506746 783.86641817 -986.24498157 Xe 4.65721189 3.16032487 1.52833913 1259.33616281 -330.98873040 419.46880790 Xe 3.05019158 4.68889059 1.51064236 387.53424403 1315.17408925 477.57539791 Xe 0.00402508 0.04607961 3.15402351 -1260.50823238 -1211.80080403 -301.59960779 Xe 1.50844846 1.58350745 3.07860049 818.27220751 -676.86878448 395.38394956 Xe 1.54499885 0.03151770 4.65387555 214.87871661 -1190.45121154 1142.12638348 Xe 0.02853037 1.59820210 4.69866727 -1470.98672767 -278.79699768 1278.74524681 Xe 3.11712035 0.01614429 3.05600113 -358.68465561 -1647.15566140 534.22567697 Xe 4.62512580 1.53770809 3.16565689 1749.54428787 425.57298606 -619.98144522 Xe 4.61047677 0.04096204 4.70166793 859.13644938 -1066.94136231 902.24495454 Xe 3.10650732 1.55663335 4.63265745 -524.03285733 34.36682689 1783.54475892 Xe 0.04757884 3.07644656 3.09690023 -2200.58709662 782.21352051 312.28850226 Xe 1.57543132 4.71662182 3.09772867 -412.36880904 1471.20400903 14.60778826 Xe 1.50102683 3.09359872 4.64949172 341.75799774 234.69543193 1772.42531505 Xe 0.00744752 4.67206674 4.69353214 -737.81103451 714.39409400 584.97680835 Xe 3.05529093 3.12551032 3.17045581 317.89975997 56.55710669 -804.95253390 Xe 4.69482394 4.61170002 3.17186218 812.05330366 1431.29111968 -347.45893839 Xe 4.64054306 3.10456148 4.61921728 1231.96255989 -30.86210421 1713.59194674 Xe 3.01134993 4.64799442 4.71304458 348.33435031 1175.73142219 1211.11626904