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=20375.264626419008 stress="-0.22547365906845282 0.06182589451257947 0.03951057916899603 0.06182589451257947 -0.2989630782073351 0.042175694921353896 0.03951057916899603 0.042175694921353896 -0.2271361735071541" pbc="F F F" Si 34.71073787 35.01802796 34.99720234 2.88035859 1.87911166 2.55001350 Si 36.51565337 36.29122991 36.70270477 -530.33761826 1072.49608781 -413.64203760 Si 37.26753144 37.54843996 35.07410888 2.24435765 3.56408402 4.59209706 Si 38.83940371 38.73309978 36.84529823 -2.97547444 83.98392902 -43.84987584 Si 37.17510234 34.95618749 37.22518563 529.25389446 -1065.01024228 419.76898839 Si 38.17420688 36.35630293 39.45014625 3575.06091453 -9633.32166207 -1028.44936055 Si 34.83044193 37.60535166 38.04033836 -2517.04313202 -4075.06731794 -1259.38592131 Si 35.55761737 38.77925805 38.40279599 2381.31048287 3976.04725655 1280.62005437 Si 40.20766194 34.88835235 35.29637488 -5.80342921 -3.10203092 -1.75583891 Si 41.64941104 36.00927996 36.31008337 -28567.43414783 40676.60296906 -28926.84445335 Si 42.48124460 37.20458161 35.17107549 53.78282327 79.18868369 -71.88792798 Si 43.89912022 39.51095319 36.49028507 -5.64805483 2.14367862 5.07381158 Si 42.23717092 35.16944561 36.90803205 28514.51639286 -40742.76602365 29009.56684568 Si 43.85125865 36.31917191 38.97169002 -4.94930894 2.62989517 0.61459625 Si 39.73846173 37.14172871 37.18930231 56.02656103 -96.91302346 22.16554447 Si 41.53981791 38.55262783 38.81992246 -5.87333235 -11.35638036 3.10225869 Si 35.47553505 40.07455190 35.40004640 -2972.12250193 -8734.56245963 -5829.98609506 Si 35.84235356 41.15130607 36.11930925 2979.62078884 8731.05839065 5836.09757774 Si 37.83294651 42.79600216 35.40296460 -661.47649496 -912.43146532 -588.25991495 Si 38.65014627 43.92561070 36.14091508 657.58451851 904.95388173 597.64509621 Si 37.16010495 39.23382220 37.66827950 87.87811751 53.43541583 -36.27348197 Si 39.24256966 41.35055682 38.41760453 -7144.89379281 -25071.08185840 21497.86848748 Si 35.82679830 43.27290669 36.70090620 5.48965340 -0.56381436 1.13506903 Si 35.73956645 43.39276069 39.00832494 1.65757170 -3.02226608 -1.56017346 Si 40.42938150 39.88480659 35.25705093 -4440.45852172 -8627.92546358 -7643.38435649 Si 40.90844863 40.81583685 36.08263484 4437.35834367 8626.32387142 7657.10706950 Si 42.99624655 42.98854303 35.22352459 -0.84734387 -1.68298053 2.38080139 Si 44.17961205 43.17543595 37.12515208 -3.30233478 -2.87821283 1.81973086 Si 42.43359527 40.30725969 38.13913122 -5837.13577098 -3312.68025078 -2776.54112976 Si 43.54849321 40.94173764 38.66789772 5837.27618033 3322.84904061 2769.93907509 Si 39.50181119 42.26832575 37.63219886 7113.18914684 25180.80795024 -21554.92085144 Si 41.82163017 44.19868560 38.72399337 0.68210809 -3.84145824 0.13572658 Si 34.92744577 35.31248276 40.60050315 0.98072713 1.98512759 -0.44905320 Si 35.94116746 36.69947631 41.96071911 1797.71215800 -1184.14533288 -732.08357307 Si 37.70657463 37.61710475 39.58466909 -3586.04783931 9630.26161753 991.98239541 Si 38.29653881 38.21859331 41.38805979 -126.53165906 -17.41328541 -87.21986892 Si 37.87378712 34.63538800 42.37731917 1.51652809 4.57820354 -1.39130834 Si 39.33918320 35.49183673 43.90328644 3.60286441 2.28775956 -5.33883711 Si 34.74806732 37.49065051 42.44823517 -1787.46245870 1187.56737377 730.26440325 Si 36.72691291 39.36085320 43.68776665 -45736.29512526 13498.75092805 38409.00754829 Si 40.27163348 34.96097722 40.67710554 -830.66739781 -728.61656646 -430.78046857 Si 41.37724754 35.93894433 41.25477675 807.03200575 728.20822003 410.04043714 Si 42.52262249 37.41977013 40.47360823 11.74822435 17.67357382 -7.75984697 Si 44.19681413 38.85459984 40.70992464 -5.18068139 2.08056120 0.47748279 Si 41.74102054 35.47390339 43.15480793 2.58472719 -3.27847525 31.36322534 Si 44.08200359 36.93178091 43.09327102 -4.77301051 0.42416639 -3.23838314 Si 39.98328990 38.17121886 42.04525026 72.49066111 5.64902155 -117.92386917 Si 40.77369646 38.07146816 43.65245187 87.17608192 -14.06339971 173.40209324 Si 35.78985991 40.33320081 39.49152509 14.82422760 59.34363674 40.13239180 Si 36.56726793 41.51251492 41.79137977 -29.36246686 -43.23535728 68.80481448 Si 37.28582683 42.45513289 40.31564860 34.01093004 38.85336734 -65.82839022 Si 38.79607174 43.93914398 41.10519885 -0.50630994 -5.46961918 0.70398568 Si 37.60916924 39.10051718 42.94679792 45717.16517440 -13463.29545867 -38362.27971588 Si 38.18327624 41.28450296 43.66385246 -5.40899846 -4.58972628 -5.81724492 Si 34.86959396 43.06352579 42.36673069 6.83523839 -1.80384805 -0.35737261 Si 36.61799268 43.87399084 43.74186682 -0.73363037 -4.40297340 -4.33966315 Si 39.68675869 39.72459701 39.16474957 28.84266757 -115.14639945 51.01357885 Si 40.50154642 41.24202269 41.30411991 920.34741036 -938.89716693 -957.83473415 Si 42.84789958 42.15106732 40.85046349 -5.89291399 -12.96713467 -2.27984786 Si 43.70175564 43.94357854 41.62327708 1.46693377 3.36653831 2.56043427 Si 42.54266148 39.96532923 41.99904312 -0.39993068 2.21975181 -4.54652245 Si 44.22644477 41.26207753 43.08740681 -5.08509353 -0.53228526 -5.33198453 Si 39.62528560 42.13669503 42.21716190 -917.16940221 937.86929643 954.69979397 Si 41.19910373 43.12254512 43.88140665 -2.33059721 -3.01945045 -5.09332546