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=1897.1720591673002 stress="-6794.435637694192 -970.7186559388301 -3915.3248310068057 -970.7186559388301 -4033.34955400397 1177.7971071538977 -3915.3248310068057 1177.7971071538977 -12494.02692826057" pbc="F F F" Cd 0.19438553 -0.20864156 0.00488014 -0.68185025 -0.85030388 -0.76115353 Cd 1.32164986 1.44606259 1.29599364 -16.85732617 33.79760783 -17.66739891 Cd 2.43618781 3.43946920 0.52406193 -105.03924295 -30.21870363 -34.06516060 Cd 4.06739765 3.82311415 0.95011161 -798.88836721 -884.73589644 644.75601748 Cd 2.10122708 -0.12454761 1.88407557 18.83429940 -40.06183331 14.13560182 Cd 3.49814224 1.30934208 3.15066012 -403.37923871 -288.33823618 264.46495511 Cd 0.60164729 3.06621579 2.44826243 -48.30479799 -37.93098321 -156.59357166 Cd 1.04119136 3.46669870 4.01384088 35.29612924 44.97980597 126.27838952 Cd 5.72581463 0.46808084 -0.16902868 -1309.43443153 -435.09555877 -2805.51960146 Cd 6.28867730 0.65512601 1.03701056 1248.81462332 465.08442672 2773.04028613 Cd 7.03442930 2.91422641 0.12604032 -5.15132201 -0.42692832 -3.47918665 Cd 8.80910855 3.18654947 1.28429729 5.20079399 0.74595796 3.45884185 Cd 7.72531098 -0.06551026 1.81065789 60.54281721 -30.27050918 32.64886758 Cd 8.42798882 2.01620637 4.10363483 29.95569380 -21.74195330 -22.07022800 Cd 4.59866705 2.09708639 2.43268917 404.35549390 288.19863648 -262.51581628 Cd 6.48060276 3.33664837 4.05545140 -2987.77780905 1799.70981006 -4659.93829985 Cd 0.31676746 4.51210944 0.69485945 -2.43797349 1.64047617 -2.31062282 Cd 1.64353288 6.73706525 1.06468661 -805.89656973 -890.61761821 579.46256422 Cd 2.53812837 7.64893649 0.41638794 847.04447951 863.47911991 -614.68276064 Cd 4.44114812 9.00652854 0.86142578 -0.16711111 3.87496806 -7.75464843 Cd 2.24925236 4.87883678 2.05284136 -1.11927043 -0.04990451 6.32485480 Cd 3.33694186 6.33325636 3.28652234 12.65212142 -11.52485561 -7.20676414 Cd 0.39007685 7.61762883 2.02733319 -42.45408094 -20.19574572 -95.11632716 Cd 0.38159243 8.24035800 3.61381705 -10.73922424 53.43220295 124.87858572 Cd 4.97493625 4.73434022 0.33142423 904.80225183 909.58554216 -619.72068460 Cd 6.65061704 5.64460016 1.54262562 0.36043150 1.68033701 -0.06187177 Cd 7.39228021 7.30569580 -0.13425619 -23.23705653 -17.74735419 -18.94749928 Cd 8.65559963 8.28798720 0.86838528 23.32013731 18.12836862 18.62617114 Cd 7.86639992 4.81618733 3.25998351 -33.28481123 -91.33004505 -29.25979697 Cd 8.48979619 6.36517033 3.74681620 67.23998456 55.58356746 -48.62473372 Cd 4.73136167 8.23683681 2.78128577 -4.89379331 -4.43205783 6.66952807 Cd 6.74200301 8.81280903 3.13430600 6.67661780 1.79565398 1.14974315 Cd -0.03169405 0.02220910 4.74527663 -0.52625027 -0.09841067 -0.30603485 Cd 2.12784170 0.68194072 5.74756148 -0.33628224 1.24862203 -16.71284111 Cd 1.90058073 2.87298510 5.56268323 43.84940567 -18.15572576 -10.85508728 Cd 3.85657795 3.61337858 5.85617130 5.07078219 4.77592260 -12.94171679 Cd 2.28496337 0.15354847 7.65206552 -1.46088304 -6.61764338 15.22993579 Cd 3.88211260 1.21145415 8.74460491 2.00547525 1.09443732 3.43939014 Cd 0.80465014 3.09271303 7.00873511 -33.74498722 5.77826248 39.88662473 Cd 1.62376433 3.57680341 9.03395822 -0.09003786 -0.28927239 4.28461723 Cd 5.06129370 0.55545567 5.50414713 -727.89285889 -481.29926796 -755.54402547 Cd 5.97788347 1.15872809 6.45289813 923.36046564 274.22824857 656.82425562 Cd 7.13743839 2.93986694 5.08180838 2918.91383366 -1808.96842897 4667.10355928 Cd 8.50806199 4.00528004 5.70507492 35.83220373 27.60235018 16.12452135 Cd 7.51739361 -0.00106578 8.00177991 -1.49061378 -2.37348778 -0.04764383 Cd 8.99457199 1.67264915 8.34584301 1.79251953 2.15535388 0.36895686 Cd 4.92669641 2.25861561 6.97085105 -189.56622321 201.03973706 102.81190989 Cd 6.04980589 4.21320460 8.69958735 -0.16264440 -0.10944833 0.06701949 Cd -0.25953653 4.95903094 4.47504070 -8.08806809 9.37088852 2.84194931 Cd 1.40583106 6.25788630 6.24167046 400.10429795 -416.84375190 -733.10435865 Cd 2.24510444 7.65757280 4.24715838 -0.94404296 10.42449198 12.91356132 Cd 3.97429943 8.54524650 6.18721201 -0.92956974 0.92437408 -1.08902825 Cd 3.02986215 4.55690135 7.49747211 -2.34020323 3.20268309 3.91063205 Cd 2.94970161 5.97987454 9.19802555 -0.07323478 2.45865402 2.72098095 Cd 0.77396205 6.91589751 7.39953146 -400.15561941 416.42649328 733.02881782 Cd 1.30846832 8.77363526 9.10698340 0.10677131 0.17366225 0.17662220 Cd 5.24232206 5.62407666 5.21152563 -308.31242756 -65.88318342 -542.82372646 Cd 5.98919044 5.78438472 6.52484641 316.32080930 49.60364805 529.41880713 Cd 7.92350079 7.09538385 5.24142158 -31.48867140 34.76036171 73.69978718 Cd 8.63100491 8.35018963 6.83668059 1.72367628 3.87656877 3.57294105 Cd 8.12345985 5.51269947 7.60816224 -4.86971052 -9.77679332 -7.49031365 Cd 8.92136705 6.93793938 8.78788649 5.86653116 9.60572957 9.14480400 Cd 5.24012515 7.21444607 7.61692759 -21.26326901 8.15750231 -3.61635424 Cd 6.36971881 7.83325763 9.07538012 13.43722802 7.35942814 17.36315708