64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=39.8560458748505 stress="-0.0016388871674568243 -0.00023444724269409452 -0.0006081688967210726 -0.00023444724269409452 -0.0016580288184234787 -0.00013707489866140456 -0.0006081688967210726 -0.00013707489866140456 -0.0014251097142251462" pbc="F F F" Si 35.22086729 34.98310996 34.77096654 -5.83381738 -4.80646740 -3.80639776 Si 36.59933616 35.93572417 35.98055861 -10.31311788 -29.70138473 20.11205208 Si 37.14715992 37.22516294 35.23402360 -1.62260073 11.54513174 -33.53075909 Si 37.93229823 38.31172061 36.19084223 13.55625618 21.94201543 9.70252561 Si 37.29465675 35.14771729 38.20399864 -2.22815174 0.02417714 -0.97787282 Si 39.35802973 36.07349581 38.45018589 -1.77556328 -4.46688238 5.62987927 Si 34.76884260 38.20444678 38.02575960 -8.74820616 -4.18793295 -9.58205135 Si 36.55604684 39.07636534 38.99475015 -30.96232671 70.31482922 -40.01695935 Si 40.23975440 35.55577733 35.25284888 -4.10126620 -2.96921237 -4.87460967 Si 41.57116719 36.00454661 36.78983070 -3.78226843 6.39319110 -5.25362899 Si 42.51432400 36.93324962 34.69615509 1.70865320 2.19078405 0.17033343 Si 43.42712388 38.91385061 36.22088890 8.86064841 -13.33852941 -10.44943309 Si 42.73578848 35.29825864 37.98568119 8.27895971 -7.09106531 8.52248067 Si 43.94092265 36.79747090 39.26025248 13.94312067 -11.57277343 -16.52307805 Si 39.61890133 37.67682157 37.20485326 7.85185755 0.85023038 0.69308910 Si 40.88770729 38.85467497 38.80938152 8.12992028 -3.71812872 -0.60812605 Si 34.72941635 39.65017747 35.17843495 -3.56925439 -7.59916044 -1.12950877 Si 35.67994952 41.20201413 35.91957267 -2.34632138 -5.00208479 7.54784674 Si 36.83832478 42.32454839 35.07964709 10.33244720 7.75697320 -9.73864764 Si 38.61643991 43.32327578 36.40123177 -44.55298920 28.29458925 -29.76273802 Si 37.95366604 39.88662246 37.71888199 -19.01271581 -0.02769571 -19.15172128 Si 39.18297782 40.79320854 38.41313349 11.47459403 15.87240504 2.42069004 Si 35.64061762 42.55244599 37.63905551 -6.04962528 -1.05281490 -1.69685172 Si 36.15510351 43.81252997 39.11824152 -4.25484325 10.41916812 -1.25922686 Si 40.31463283 40.76250514 35.06533237 -6.17359622 -2.35366295 -8.11776138 Si 41.60365422 41.12475624 36.46651109 -10.83275687 21.45550107 -9.45582246 Si 41.78042048 43.31103882 34.75724372 0.92104599 -0.31841851 1.77454295 Si 43.52629705 43.46239944 36.79309461 -2.74782058 -2.47332227 1.06114357 Si 42.58087455 40.09122498 37.35935114 1.95433005 -12.09622739 18.27221675 Si 43.73510397 41.07781524 38.65337001 6.29167586 6.37303002 6.49397345 Si 39.66448343 42.68403127 37.11226018 43.45309967 -26.45844222 28.25762064 Si 40.97555741 43.31914392 38.89352680 -18.06698674 11.32037151 -8.95162683 Si 34.79982066 35.07367197 39.04841791 0.87084733 1.57253336 -0.05086730 Si 36.13897766 36.35282927 40.68258771 -7.09817331 -2.72988471 -0.32477413 Si 37.00297454 37.99791377 39.62151619 37.51175358 -79.07337165 42.07843429 Si 38.27194644 38.51894432 41.34725891 6.15938932 -1.62917106 6.50435880 Si 36.62825395 35.17049102 42.29388522 3.92926193 -1.89807263 5.61298583 Si 39.08450338 35.75571598 43.99881808 -10.12599480 -14.59003409 9.70528893 Si 34.99655912 37.96978731 42.51668654 -9.31607343 -8.10765660 -10.18763852 Si 36.22422232 38.91950201 43.54655608 -9.22600108 -8.41056649 19.65037024 Si 39.77228412 35.41553907 40.84226646 -14.30516305 -3.36073500 -7.79707029 Si 41.48837336 36.00831489 41.43404765 -12.33126061 38.02307356 -13.63162298 Si 42.84911873 37.57553626 40.41930713 -60.19645083 -45.10834660 -29.08127931 Si 43.60556472 38.49425818 41.03735392 45.92079511 62.08143480 43.83832636 Si 42.20384740 34.85081933 42.03810700 27.44307367 -36.68051873 22.28902004 Si 43.82898977 36.05759461 43.76534421 -1.35447595 -1.00959560 -1.34568131 Si 39.73333753 37.00409575 43.00005349 2.58069912 12.57400930 -13.30285404 Si 41.03695434 38.28719268 43.94632733 3.69718017 7.21594668 1.76996832 Si 34.83286624 39.89949207 39.94651716 -7.65019966 8.02977937 7.71608998 Si 36.16201767 41.98989951 40.74303982 -13.18243095 -10.43816718 9.51360803 Si 37.82350393 42.53299423 39.80335328 -5.39750698 -18.46044802 -27.61743678 Si 38.63834321 43.28337470 40.87827378 26.58759185 22.02707732 26.83527228 Si 37.36102597 39.94186987 42.87644269 15.25292341 17.74056962 -12.40991697 Si 39.23911782 40.86547492 43.69892213 1.05631673 -2.41508222 4.00815647 Si 35.06236183 42.74812411 42.77511221 -1.68642461 -1.71703262 -1.94432118 Si 36.48115325 43.96771709 43.78828861 2.16168168 1.91991750 1.64578692 Si 39.50493887 39.93176006 40.24335814 2.46161590 -4.86988475 6.91266077 Si 40.89974943 41.22892384 41.12165250 28.21368293 -30.34354897 -35.92814635 Si 42.34497277 42.80178516 39.71375535 20.18080088 -8.53295789 9.77947610 Si 43.54610002 43.89496231 41.59964402 -1.90492315 -1.08791427 1.05038400 Si 42.83394746 40.70480081 42.92669675 -59.54092399 -41.82854680 -47.83597390 Si 43.77099171 41.28111300 43.66957874 59.55501568 38.43292297 46.47181791 Si 40.39757659 42.11536967 42.13716159 -22.83102340 35.55980275 40.28919458 Si 40.99934153 43.70821989 43.60820831 2.78201591 1.59627726 0.01481008