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=-127.42588616334747 stress="-338.5564930908113 3.3644196648656077 17.565644578737434 3.3644196648656077 -342.4372435417 13.63102958238261 17.565644578737434 13.63102958238261 -329.9060317576583" pbc="F F F" Mn -0.03764213 0.04882976 -0.28095614 1.67147902 0.66528107 2.02890472 Mn 1.50082602 1.74624097 0.14302402 -15.29820390 -13.18148029 -27.50427649 Mn 1.32510017 0.11042859 1.70947124 0.48393353 -23.05021244 -10.04371912 Mn -0.14487149 1.55280714 1.41333883 -20.51069156 -4.62777152 -6.58667792 Mn 2.54875809 0.13476574 0.03236199 4.38435950 -7.32462800 -5.96062284 Mn 4.62260891 1.17255110 -0.06141927 -0.76019308 -1.28049660 -0.79912994 Mn 4.25205420 0.15488783 1.55988540 6.58074102 -5.88266976 -6.35772143 Mn 2.70245745 1.66431082 1.61020402 31.31576731 -25.55585993 -6.53708219 Mn -0.01155935 3.03277713 0.05682434 -8.13411122 3.86368113 -6.16834452 Mn 1.36408990 4.31784872 -0.24116280 -0.21595711 4.81390884 -0.65586151 Mn 1.71813893 2.76716069 1.69410236 -15.29156022 35.47330230 -11.97489569 Mn 0.07219398 4.40402490 1.43300593 -3.50318692 5.82125648 -2.28232318 Mn 2.72002482 2.77696427 -0.08338442 14.52622126 12.36471479 -21.85293124 Mn 4.28146540 4.65120802 0.27957470 1.66990749 1.12871837 -3.79632035 Mn 4.22614529 2.83546251 1.27761356 22.26424389 -0.24840873 -9.29501962 Mn 3.22596375 4.39362841 1.73573857 5.11620756 23.78247453 -10.68661720 Mn 0.02724172 -0.03187860 2.70296332 -13.24260905 -7.03583405 6.16951414 Mn 1.34887301 1.72083292 2.78984966 -10.79368300 -15.72432898 29.76628597 Mn 1.29458363 -0.07700850 4.16871033 -0.12036557 -6.28823399 5.99280498 Mn 0.18107110 1.32825321 4.68434682 -5.83263199 -2.12822210 3.65168651 Mn 3.09995250 0.26120756 3.01193751 3.84645483 -15.53458566 7.25585297 Mn 4.75226748 1.34868471 3.04396501 10.90483219 -1.58137265 1.43025596 Mn 4.57052164 0.21662613 4.56712632 0.39229886 -0.40862030 1.19616702 Mn 2.76922180 1.42950503 4.52031036 3.63073652 -2.19198061 11.65744917 Mn 0.18745344 3.02015752 2.87970777 -22.07614058 12.78311455 11.16057877 Mn 1.77711528 4.37871118 2.75213077 -10.40216842 18.47306581 11.21194381 Mn 1.32067456 2.71824351 4.63616082 -1.56868655 9.39896317 9.84924581 Mn -0.23570740 4.62968218 4.67686952 2.74621303 -3.15509994 -2.57933415 Mn 3.29977655 3.18543805 2.95460942 7.47459355 0.93003495 16.86908945 Mn 4.57327937 4.69989723 3.40521180 3.69931342 4.94703276 1.81456464 Mn 4.37425859 2.87042119 4.26564846 7.55776205 0.06108040 11.76062396 Mn 3.10244045 4.58373232 4.68657822 -0.51487584 0.69317640 1.26590952