32 Lattice="8.0 0.0 0.0 0.0 8.0 0.0 0.0 0.0 8.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-89.57941358390273 stress="-128.17980067327096 16.657875898858627 -6.790608258660566 16.657875898858627 -120.70383157386792 -13.874946877386648 -6.790608258660566 -13.874946877386648 -125.46002170854709" pbc="F F F" U -0.11090311 0.13714415 0.07420351 -2.66871059 -4.64552786 -6.25627766 U 2.11543713 1.56703166 0.13708343 -4.81189137 8.50183519 -3.73326638 U 1.56120567 -0.10654689 1.88687053 3.80515810 -6.07128798 3.78206583 U -0.02117016 1.72221844 1.72919618 -5.67192934 6.82185844 3.46553468 U 3.87472952 0.24082058 0.21260583 7.94987010 -6.46184068 -1.26835246 U 6.04957468 1.81036064 -0.13367187 0.06662574 0.25366732 -0.18767578 U 5.78802619 0.22277084 2.18584377 2.01510665 -7.50871638 -7.66206417 U 4.18362810 2.19581920 2.39309106 -3.37234172 -4.33957716 -2.48475559 U 0.41261807 4.03125126 -0.03554662 -0.91742594 0.15172621 -0.87274421 U 2.20996341 5.99207130 0.15300231 -2.30213864 2.10659031 -2.82140759 U 2.03848316 3.95774659 2.12799282 0.09136943 -1.59578056 -4.46062599 U -0.18697813 5.94106395 1.68375486 0.08456492 0.47799265 0.07368095 U 4.19178619 4.17895518 0.29140871 -3.61877057 -3.98619961 -9.91887086 U 5.96110850 5.90494817 -0.02864467 1.37099940 1.00186046 -0.56803005 U 5.78091226 4.01658454 1.96603997 9.93727685 0.32865861 1.81037835 U 3.80598025 5.82157598 2.01361598 1.23050159 8.04528160 1.73801480 U -0.20943222 0.13056324 4.12318467 -2.31372552 -3.85595383 -2.09224394 U 1.63991187 1.94277940 3.80877158 2.04750745 -0.31225423 2.32390170 U 1.82970885 -0.12581587 5.71640111 0.53534901 -0.59260854 0.97076462 U -0.20647469 1.70494220 5.87293214 -0.19825539 3.28124462 3.04480221 U 4.27219963 -0.06618674 4.13132919 -3.79231981 -2.84655181 0.50846444 U 6.25978669 1.72592512 3.78504734 5.62008190 6.55347774 6.70086086 U 5.95081786 0.39698958 5.91439828 0.69977013 -0.46596890 2.26310767 U 3.67786600 1.88110047 5.94096973 0.11160394 0.13091507 0.99439877 U 0.23171545 4.18190327 3.59879924 -6.58150695 0.07631481 2.89019127 U 2.21219253 5.92485375 4.12990665 -2.06144836 5.16826731 -0.82575176 U 1.78220450 4.28278197 6.06210000 2.94828728 -6.90016359 2.76161481 U 0.13362859 5.82702941 5.98695988 -5.10530154 4.22031531 0.06745611 U 4.01364665 4.05473499 3.91561068 -0.38555765 -1.17235813 5.04962435 U 5.86276144 5.90480033 3.89822649 2.02022613 2.43594093 0.28017308 U 5.79869006 4.11041876 5.76735611 1.87088895 -1.30934532 1.64992404 U 3.83533445 5.74148635 6.08611608 1.39613578 2.50818801 2.77710788