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=-81.83079665677263 stress="-0.0001304714401284087 6.604305175684514e-05 -0.0002171828233912072 6.604305175684514e-05 -0.0004059772392064183 0.0002578687524968232 -0.0002171828233912072 0.0002578687524968232 -0.0011378664320552453" pbc="F F F" Cu 35.06370892 35.04500902 35.01919699 0.53245119 0.33056965 0.08214891 Cu 37.04790086 35.83605788 35.61377069 -29.44669081 -51.77911293 48.70194764 Cu 37.55259552 36.72813370 34.78600541 29.18940823 51.56181517 -48.39537574 Cu 38.58011841 38.45391593 36.18525893 -0.24563011 0.12252500 -0.81047699 Cu 36.79790524 35.05846903 38.08185862 1.14641588 0.23971731 -0.97148902 Cu 39.03588274 35.45859239 38.87957522 -66.58186126 39.18929186 -261.89550270 Cu 34.91597288 37.84327934 37.74925930 0.74027574 0.00322049 0.48337486 Cu 36.55604684 39.07636534 38.99475015 -23.78911746 58.38872601 -33.34341102 Cu 40.88499006 35.03620971 34.91076815 0.26488996 0.51375692 0.14145656 Cu 41.79729920 35.80778337 36.77532619 -0.89685562 1.50998338 -1.90811238 Cu 42.40513757 37.66058214 35.11733759 -2.45901562 -1.89753887 -0.94060010 Cu 43.51505611 38.45844813 35.77826181 1.90659143 1.44672708 1.07058531 Cu 42.41987058 35.36500318 38.21105730 -0.53050004 -1.55464387 1.80138515 Cu 43.88510867 36.35219691 39.13819686 2.43033583 -0.27083152 0.26406407 Cu 39.89773111 37.84077848 37.90033123 -0.30768148 -1.23164298 0.44890092 Cu 41.26837714 38.91726306 38.71506015 1.06090175 1.06674675 0.09598961 Cu 34.80084162 39.62743926 35.11872414 0.11382740 -0.09437854 0.77720241 Cu 36.15805272 40.73658530 36.67376922 0.38065930 0.08583059 -0.12085810 Cu 37.61363197 42.55593552 34.77520588 -0.26692121 -0.48641518 0.14357581 Cu 38.61643991 43.32327578 36.40123177 -16.25514038 9.84701494 -10.95862008 Cu 38.31027764 39.78087390 37.80440478 -0.10548053 -1.19711766 -0.38944782 Cu 38.87510485 41.23418069 38.46428709 1.52043393 1.12948213 0.76196424 Cu 35.25603358 43.19718185 37.40996722 0.69431846 -0.66596459 -0.09642979 Cu 35.94119039 43.57310438 39.51556685 0.01058802 0.96122855 -0.22777282 Cu 40.38624477 40.74886162 35.02484260 -1.44908835 0.14911029 -1.02009815 Cu 41.21537689 41.21128805 36.45749618 1.46475521 0.29021874 2.31123542 Cu 41.78955913 43.34759965 35.42075215 -0.24701098 -0.67313221 0.68989687 Cu 43.96107175 43.10585605 36.52182787 -1.22412294 -0.66539391 0.42094551 Cu 42.91875667 39.86213989 37.61866461 0.12515730 -0.15896469 -0.54770319 Cu 43.95988970 40.97790229 39.02834847 0.01027459 0.63103473 0.70555319 Cu 39.66448343 42.68403127 37.11226018 17.26589597 -9.41818160 10.62007853 Cu 41.17426133 43.78926313 39.16846967 -3.67769957 2.97287121 -0.60372003 Cu 35.38501276 35.28866353 39.13808314 -1.55115435 0.67208410 0.58598968 Cu 36.45728100 36.28136614 40.74253845 0.35520734 0.32922024 0.13928967 Cu 37.00297454 37.99791377 39.62151619 24.31397985 -57.52116923 33.01878039 Cu 38.63354400 38.98155677 41.53109462 0.19498817 -1.91874898 0.58881526 Cu 36.87432696 35.43353967 42.64808674 -0.21641639 0.11507137 0.28432824 Cu 38.88675380 35.67312151 43.42903809 -0.62400484 -0.47761852 -0.23788982 Cu 34.93971441 38.30799785 42.39689011 0.15986030 -0.67128101 -0.74253974 Cu 36.66718888 38.72644850 43.40138151 0.62493327 -0.54497834 0.13192858 Cu 39.32594504 35.28940135 40.01988805 66.46299171 -38.40785207 262.43544246 Cu 41.14587698 36.31829147 41.67865158 -0.99544232 0.77158243 -2.02278721 Cu 42.50274218 37.18164099 39.64737597 -2.26620189 1.02086168 0.94523388 Cu 43.95066619 38.87146700 40.57697763 -0.53044617 0.25741465 -0.64284597 Cu 42.48850221 35.33418514 41.69111865 2.19846320 -0.97213849 0.06211407 Cu 43.44291475 35.89158883 44.05716205 -1.03346874 0.11990169 -1.18501029 Cu 40.39566135 36.85685179 43.05585270 -0.12579947 0.74104979 1.74787641 Cu 41.24050602 38.88933161 43.35637329 -0.77639954 0.48170192 -0.01029582 Cu 34.78315429 39.50959042 40.43036294 0.48018851 -0.02251690 0.13031842 Cu 35.80726161 41.99601827 40.77972059 -0.78334653 -1.13626482 0.64481149 Cu 37.58264280 41.90871137 40.02016825 0.39918152 -2.69356398 -0.95324615 Cu 38.23940195 43.25828986 40.90834746 0.75091079 1.18688935 1.45848310 Cu 37.81545551 40.27619585 42.44604683 -1.08095559 2.57703797 -0.62360187 Cu 39.09775119 40.72218372 44.06082348 0.93634551 -0.08956209 -0.48354102 Cu 34.82317285 42.59462510 42.42857401 0.25455065 0.35735373 0.52085735 Cu 36.50547386 43.46642497 43.72889286 -0.03607803 -0.57411225 -0.76343041 Cu 39.84423945 39.60672203 40.23977120 -0.44708649 -0.52016783 -1.35737921 Cu 40.61083299 41.22892384 41.12165250 -0.93560307 -34.51808021 -41.46122411 Cu 42.19474472 42.71630150 39.33489678 3.79172469 -3.92034742 0.88185452 Cu 43.91349408 43.67361795 41.44587432 -1.26870945 -0.95545599 -0.49398939 Cu 42.18098279 40.39437182 42.35439740 1.29586458 0.26575147 -0.46812459 Cu 43.64757145 41.08586328 43.75864263 -0.32605799 0.24519874 -0.29953592 Cu 40.60615151 42.11536967 42.13716159 -0.88309647 35.64928746 40.89212211 Cu 40.94353050 43.71498423 43.36781104 0.28671342 -0.19310068 -0.01349120