64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=279820.11439979053 stress="-1226602.1510659852 224934.13143707532 -260786.22616702085 224934.13143707532 -936922.2441722557 462976.97481618664 -260786.22616702085 462976.97481618664 -1219338.4863723791" pbc="F F F" Na 0.34474231 0.48859823 -0.33802287 -112.55594939 -57.86164861 -183.36086154 Na 1.45586268 1.01834976 1.65668828 -651067.30786523 648496.32705172 -832351.94002773 Na 2.40279398 2.39408717 -0.15737059 41.83295784 56.58761017 -82.76499350 Na 4.15953290 4.13435545 1.08736240 -206181.89884304 -101201.83486845 229076.89383069 Na 2.09619211 0.38115390 2.47112977 653185.65316352 -650015.35591398 830663.62224976 Na 4.17623806 1.29860621 3.73500871 -30141.95070559 2745.83377050 3999.26624453 Na 0.22064365 1.90020120 2.83790132 -2090.61730498 1623.47414889 1663.13087465 Na 1.11922631 3.81401497 4.05107162 5648.92715437 -1813.32232165 -7202.65968176 Na 5.61691242 -0.03030404 0.60865280 -698.16321069 -927.57664614 -552.83197402 Na 6.57019735 1.83139605 0.75227838 -73210.22047545 -52023.56525194 62187.10439407 Na 7.55090887 2.53612803 -0.07677249 70602.11261060 50686.99867780 -65377.23112510 Na 8.71593418 3.39171343 1.08925150 3108.82787044 2283.25651810 3092.45821378 Na 6.61568325 0.18866940 2.54417814 300.55979943 -102.08384702 516.67431189 Na 8.75351756 0.79986431 3.97185624 4244.78569742 -5063.91263023 -3696.44052154 Na 5.05340571 2.16848054 2.68537288 15319.38270094 15410.31624189 -19444.10047455 Na 6.20668562 3.17391489 4.16391965 -431.47524189 942.64599983 65.03690710 Na 0.46269692 4.84550921 -0.26726317 -15.93345613 -67.34409138 -30.02201937 Na 0.90495523 7.10889399 0.78097679 -311866.64851645 5441.62750372 47222.50896599 Na 2.23930434 7.08501388 0.57228935 311961.60372915 -7855.81599313 -49788.07215506 Na 2.87538555 8.80947263 1.22625564 585.99518238 2474.63438667 625.13348307 Na 2.05153089 4.98195237 2.53656212 61.23959832 369.20498450 -807.27481485 Na 3.65640005 5.38483993 4.05742233 -2264.40511182 187.67295570 -900.99184910 Na -0.04709519 7.30920195 2.51686741 -962.96686625 184.74481146 1709.36232055 Na 1.76053387 8.94388124 3.75309678 -27.30284520 858.24534423 -541.44844983 Na 5.01647912 4.55500908 0.13524910 204411.82970178 98522.23075874 -229617.80012383 Na 6.05960115 6.13171775 0.44133726 1555.60037135 2732.29166937 233.71896466 Na 8.31230129 7.12536275 0.38223135 -14526.73152230 -72307.12943231 -47228.07696258 Na 8.56115933 8.35619462 1.18547015 14627.81290873 72354.03813103 47220.25945482 Na 7.02007853 5.63041516 2.43911795 61.98237049 -103.62355475 216.95752771 Na 9.03320775 5.67199364 3.93275937 194.73289660 -157.48215360 18.64440754 Na 4.44318998 7.78980691 2.45350630 -47288.01482655 -28125.00886734 -35158.22859053 Na 5.54952314 8.43952609 3.27632855 47477.15510605 27988.02798209 35337.22749452 Na -0.08148301 0.18111706 4.31865669 -165.96580963 -481.18775257 -466.21129840 Na 0.26998281 0.94167510 6.29267197 -16867.84926955 -202350.93455781 -132923.21971126 Na 2.11037454 2.57008781 5.09921728 1849.93405713 -2282.02614065 1900.12396772 Na 4.04335373 3.95855511 6.46169649 -2669.58338339 3090.20910716 -577.22424515 Na 1.73995751 -0.14520029 7.06929682 1517.15585069 -1138.64756625 788.73804619 Na 4.43174641 0.61562134 8.82492211 -0.75214639 -2.76407183 2.75886833 Na 0.35752762 2.09385470 7.04387120 15420.89369314 203561.96233843 132740.72821874 Na 0.52960178 4.15425882 8.18735937 -97.94927885 58.90907804 151.63785008 Na 5.01609900 0.21600994 4.61375586 14270.79657026 -18492.53896771 15013.47831567 Na 6.75099433 1.30774861 6.30342445 -620.02844928 -2479.94092618 2452.84414204 Na 7.75301346 2.00443879 4.85396187 -1318.99456631 5674.28820443 1190.25382175 Na 8.78555879 3.69488081 6.31964753 119.08190848 11.67025521 -3.59440384 Na 8.38720499 -0.10509666 7.56004899 -230.39115122 -1295.42681607 -1023.21342158 Na 8.73309067 1.40501965 8.84887375 288.54085016 1245.61659193 1064.76630539 Na 5.24268007 2.53951200 6.75006761 1237.96959715 -2005.97917118 1049.99701583 Na 6.80525073 3.67178918 8.70273927 -3959.17954439 -12264.23471626 9383.39935410 Na -0.18485423 4.44406951 5.03947462 -7803.32256484 3741.37605183 5882.26137977 Na 0.73011640 6.48063254 6.48504544 -2457.83076955 60.25046685 -2007.87702961 Na 1.82026809 7.20046128 4.90662624 710.16808530 -378.73753779 -477.49179360 Na 3.24892918 9.09146181 6.18416728 66.42039169 20.34979591 -24.41543100 Na 2.20881635 5.65720831 7.38213584 2459.59444615 -1343.62702384 1329.01479756 Na 3.80647714 6.21247859 8.98762113 -598.71608027 -243.91274418 633.43016117 Na -0.05727160 7.41876728 8.05804042 -1096.10300525 578.09935777 1518.76641695 Na 1.51525033 8.97818566 8.05265890 290.74234776 328.20110272 46.87596566 Na 5.42330200 5.29517555 4.84791723 260.75192927 -4754.99382410 -3480.93397259 Na 6.00313537 6.53095959 6.03122124 2704.40823472 4501.45959114 2782.97362634 Na 7.56052031 7.47234914 4.26498887 -60.64919896 78.90362865 -79.89317638 Na 8.64702251 8.59529414 6.05431933 98.68652161 77.64354415 110.14036363 Na 7.22626291 4.97892661 7.70359913 2973.13000502 11799.83800828 -10144.22723225 Na 8.66199125 5.64995592 8.99604741 976.35987999 467.13500530 866.89832547 Na 5.49392996 6.87802573 7.92398992 198.05148724 652.89626244 1388.14124364 Na 7.05636482 9.02569718 8.17118158 0.78828365 29.90210028 26.31850920