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=58391.672162397685 stress="-261268.44430971623 44129.69923109493 138834.46069775955 44129.69923109493 -171952.94552532164 11269.31329026306 138834.46069775955 11269.31329026306 -303939.2111440605" pbc="F F F" Sb -0.10984510 0.12095780 -0.14647506 -138.01660384 -96.14251737 -97.19359943 Sb 1.42698939 1.81695742 -0.08465805 2737.83253110 -4094.47282305 -3498.59759312 Sb 1.33398042 -0.04206607 1.66772384 44281.93378245 8173.51539629 -42657.03690053 Sb 0.22537007 1.61690427 1.75662689 -16666.22914535 -18038.46213190 1786.63848519 Sb 2.55424521 -0.03208035 -0.06467590 -1597.74584231 -62.66125079 -1699.20840851 Sb 4.25075012 1.51463173 -0.21729964 583.93763245 -222.61110862 -347.69342062 Sb 4.02915508 -0.22525138 1.04315228 2091.02234645 -895.05201326 1186.23096885 Sb 3.17904533 1.55326080 1.72657125 -10844.73061676 149.13690977 -19970.07182819 Sb 0.06561610 2.93454527 0.21069971 -5881.96416012 2447.52928899 -3358.58604382 Sb 1.78983625 4.46028292 0.05865258 -3725.00388421 2492.38085774 -2763.22557463 Sb 1.28971704 2.72247657 1.48241766 18751.98735889 17676.10852966 1118.39010524 Sb -0.06452146 4.56205504 1.31675881 -294.75733404 926.91873830 622.69808059 Sb 2.98772411 3.11212099 -0.19046241 2061.31080455 -1491.43889749 -698.29534891 Sb 4.59411525 4.74634517 0.03187205 107.92045045 86.54687010 -27.47207427 Sb 4.50121417 2.93045154 1.83292221 2439.72942783 1377.38403173 -1307.42646990 Sb 2.77459117 4.39825585 1.56010443 91540.22579951 -11336.62539015 -115753.77826754 Sb 0.30472869 -0.25070361 2.66654657 -44217.10057312 -9477.97020344 42933.88217829 Sb 1.57883716 1.52276646 3.40173414 1136.14088129 4120.63049300 -6698.36395891 Sb 1.88293864 0.14364402 4.38439232 -1925.51588340 -7995.26864243 5547.76554121 Sb 0.36691156 1.21711992 4.65067518 -4669.37060335 -167.37613416 3887.15694608 Sb 3.06780602 -0.21300491 3.04842560 -9849.88627442 -12781.72856575 -6242.41696568 Sb 4.06238546 1.08813971 2.97053736 22301.50530427 14651.27172250 -23240.29771086 Sb 4.20740090 0.26700118 4.23716456 56135.34862752 -69443.47169644 23362.56196242 Sb 3.24884751 1.31368505 4.43362439 -48937.68969422 52888.39187623 20982.09967995 Sb 0.04231828 2.66074667 3.22276453 -3662.99927841 2100.06953822 292.15029687 Sb 1.96044030 4.50291312 2.63879558 -89760.76435563 11732.74693889 118748.13664680 Sb 1.19753830 3.28088368 4.48634093 3538.74581439 -1108.22001644 1919.37055266 Sb 0.19209449 4.77246523 4.73579005 -1719.35366807 2562.46794693 428.61261625 Sb 3.18086152 2.51467513 3.12534476 -5651.90415773 14068.49426015 3226.16556258 Sb 4.39012647 4.67124512 3.12412940 1684.11536230 433.24553969 -1608.99485342 Sb 4.14891770 3.09187238 4.60098125 2656.18759697 -462.78504445 2183.39989185 Sb 3.13927469 4.66424263 4.49839908 -2504.91164543 1787.44749753 1743.39950349