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=138.2695834567493 stress="-0.0011114061850238147 -0.0002050784830504704 -0.00045821546473834204 -0.0002050784830504704 -0.0008776064156862126 -0.00017601439812546085 -0.00045821546473834204 -0.00017601439812546085 -0.0014673451260200504" pbc="F F F" Cu 34.71939539 35.48859191 34.53044110 0.90330074 0.61752815 0.80300290 Cu 36.00865117 36.50863146 36.74527722 4.57255612 -3.27582181 -3.94418647 Cu 37.29139931 37.02873743 34.80109158 0.06732839 -0.27132436 0.72712345 Cu 39.20406319 39.39967651 36.86212133 -2.19264409 -0.39075771 4.06737388 Cu 37.60866961 35.08142075 37.34241625 -0.90537170 -0.57551404 -1.83678199 Cu 38.92190916 35.45749393 38.91815114 -10.79222121 0.95760709 -13.18175296 Cu 34.64170515 37.42820914 37.59181841 -6.96937734 2.75831525 2.53710871 Cu 36.41369732 38.30717084 38.33724806 2.58785704 0.91517949 0.95387289 Cu 39.30679689 34.74762540 34.84994625 -0.34440704 0.89765396 0.84241945 Cu 41.57559177 36.57388855 36.24781918 -20.17531848 -17.35318999 30.48117190 Cu 42.27486798 37.18149516 35.18186856 19.55843684 17.45532171 -29.94174031 Cu 43.58332020 38.73277147 36.74498245 82.31978421 -69.21360048 -104.09570855 Cu 42.79852853 34.91864618 37.59474789 -0.32206799 1.28150833 0.42591947 Cu 44.08684331 36.92689659 38.71784730 -0.15790992 0.08554541 -0.94227058 Cu 40.61116147 37.90955196 38.06373456 -70.53741956 -97.16192286 -79.04952110 Cu 41.11805914 38.61552624 38.63869929 64.21219307 101.97152795 75.26596451 Cu 34.86362623 40.37956837 35.14801360 0.53697379 -0.23785454 0.73571279 Cu 36.73108471 40.84829128 36.69775631 -92.38854446 64.39223648 -137.58352198 Cu 37.96667680 42.97661173 35.29292364 -37.90460374 -18.65539927 -18.31257272 Cu 39.09699718 43.51355606 35.85696437 35.99415712 18.49116643 16.68225655 Cu 37.23807910 40.49569653 37.45381834 90.04182047 -64.00835378 136.69057741 Cu 38.77084937 40.96481760 38.95313122 5.53996941 -7.20491946 -17.26289241 Cu 34.92478538 43.25970402 37.74118231 -15.42339259 -4.86875826 -28.07068961 Cu 35.64241307 43.44570187 39.00396330 16.22685574 3.55603153 28.44702964 Cu 40.15286386 39.50476606 35.16949370 2.26436107 -0.79157513 -4.49931506 Cu 41.15035597 41.20998817 36.25716198 -14.83852298 -14.72494934 22.67633054 Cu 41.93264790 41.87596291 35.17507945 12.28554034 10.05354020 -24.06498433 Cu 43.20608291 43.12923654 35.88585597 2.92542952 3.13179117 2.76105477 Cu 43.01785041 39.20659703 37.46025484 -82.73074706 68.87666693 103.28944789 Cu 43.98279388 40.56793095 38.95728435 -0.75661669 0.42347111 0.97219607 Cu 40.36962846 42.90586033 37.35108628 0.90421066 -0.20190188 3.50869368 Cu 42.09493102 43.64881858 38.77134696 2.82634435 8.65405178 -8.67269926 Cu 35.50642656 34.88943163 39.58090337 1.12108082 1.14911316 -0.23399639 Cu 36.70393059 36.15492922 41.78494866 -23.09799905 26.57986271 -26.86352962 Cu 37.86423553 37.45246347 40.20049871 -1.20391635 -0.35520807 -1.92109575 Cu 39.36044418 38.29517714 41.44519205 -4.16498762 3.77568311 -2.71575944 Cu 37.42959423 35.30818853 42.60437339 23.51028850 -26.91143958 25.92972310 Cu 39.59146651 36.62721153 43.03051693 -13.48100078 -10.52797297 7.23838142 Cu 35.29690680 37.61382492 42.97517575 -15.13303542 -15.80818481 0.19897650 Cu 36.36980422 38.76941415 42.95930205 4.34878563 4.14935355 3.09678235 Cu 39.94216908 35.46626579 40.16819221 10.66029537 0.74111951 14.51152015 Cu 41.82445264 35.57723860 41.27323337 1.37002654 7.75729117 -12.47499563 Cu 42.14475098 37.48763196 39.70955613 3.33591406 -6.18329243 4.69073142 Cu 42.96186142 38.97321239 41.05068668 0.73471124 0.04654200 -0.78264822 Cu 41.89602403 34.70389340 42.69609892 0.33632219 -7.18981850 13.23775265 Cu 42.99809073 36.58453445 44.08038932 -0.97936042 0.34353964 -1.10961986 Cu 40.85619148 37.44452641 42.29637803 11.12455445 -35.42412618 -51.60174592 Cu 40.98287224 38.28610325 43.26232978 8.34316784 42.97553413 47.85999881 Cu 35.07103996 39.91840529 39.59422849 -1.65102332 -5.55211534 -5.17389546 Cu 35.60747345 41.25256360 40.72537987 3.12156925 6.13563646 5.12686003 Cu 37.76213594 42.11159882 39.56088617 -11.21708869 12.34297499 6.49239917 Cu 38.11061896 43.63427324 41.37438591 -0.28307626 -0.87570102 0.39930088 Cu 37.47494554 39.95814612 42.57481331 -39.78056310 -26.45673823 -35.76200919 Cu 38.37341372 40.63696641 43.12257032 48.64901430 36.21180170 32.16595380 Cu 34.73384018 43.36253082 42.49004159 -1.03049294 -0.97368421 -2.73393568 Cu 36.00328687 43.71154959 43.99775770 2.09620142 0.13832167 1.52216742 Cu 39.59846879 40.39502411 40.32457862 -6.79698366 -4.78349862 -1.93990455 Cu 40.79508350 40.38243255 41.42789546 15.46871329 -2.71975257 10.59928698 Cu 41.78210355 42.44401453 39.94639239 -2.50741779 -9.64665466 9.07996163 Cu 43.52450566 43.99178297 41.74146360 -1.15568297 -0.85305284 0.00949623 Cu 42.64643753 40.23754931 42.75468718 -8.47558145 0.02746964 -4.00948504 Cu 44.06453102 40.47447075 43.75382798 8.31963581 1.35674347 5.80345830 Cu 39.74400276 41.90364390 42.28894980 0.85454192 5.68579297 0.08950090 Cu 41.58081750 43.76756968 43.66665700 0.23543315 -0.73883994 -1.13825016