1372 Lattice="25.674945153680245 0.0 0.0 0.0 25.674945153680245 0.0 0.0 0.0 25.674945153680245" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3909.0969636442837 stress="-19.61436480365589 -2.2471778022685527 -2.151785901827509 -2.2471778022685527 -17.324557509979968 1.3688479031238785 -2.151785901827509 1.3688479031238785 -19.41447931744192" pbc="F F F" Cu -0.02588066 -0.01919279 0.00788422 -0.35606063 -0.19133834 -0.22464344 Cu 1.81409909 1.82745893 0.01415442 0.44658075 0.39756301 -1.07664499 Cu 1.81361479 0.02801835 1.82754582 0.42259264 -0.96541419 0.74189858 Cu -0.01812897 1.90070521 1.86701739 -0.94357119 -0.21182904 0.14854566 Cu 3.63136651 -0.03354706 -0.02285115 0.23603025 -0.43105758 -0.47406350 Cu 5.53491584 1.81902627 -0.00656371 -0.54723503 0.52076412 -0.94807245 Cu 5.52168902 0.02334898 1.81294770 -0.31458801 -0.81751660 0.81819297 Cu 3.63273346 1.83618778 1.80084584 0.70993933 0.31632234 0.90910503 Cu 7.33193382 -0.00143371 0.01534158 0.13192032 -0.71219214 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0.39534127 -0.60253697 Cu 9.15337754 5.53292290 -0.01530605 0.28055219 -0.23432715 -0.66706519 Cu 9.19386909 3.69129204 1.81187558 -0.39520502 0.02437479 0.94779558 Cu 7.37070444 5.53757061 1.82109331 -0.27345058 -0.45790891 1.19766938 Cu 11.01461364 3.65679648 -0.03397176 0.05571987 0.26147872 -0.54497556 Cu 12.86629819 5.50188577 -0.01554214 -0.32608075 0.23165059 -0.69097721 Cu 12.85679854 3.70446574 1.84363892 -0.28593038 -0.37730788 0.53139334 Cu 11.02595551 5.48971138 1.83766191 -0.24757375 0.23233977 0.60461475 Cu 14.66273374 3.68759818 -0.03105926 0.04141982 -0.27640658 -0.48377847 Cu 16.50932356 5.47489889 0.02451153 -0.01304428 0.23428037 -0.57094211 Cu 16.47688275 3.63840870 1.86827038 0.30818564 0.41310694 0.23378642 Cu 14.65387314 5.49198388 1.82688389 0.52641676 0.21070478 1.03944698 Cu 18.39530676 3.70142887 -0.00426297 -0.39938494 -0.43717287 -0.57939259 Cu 20.16179099 5.48840233 0.00732764 0.40005482 0.21141067 -0.53174822 Cu 20.15687499 3.63813353 1.85338614 0.48893866 0.32055265 0.45650985 Cu 18.36148896 5.49024496 1.81747677 -0.30971501 0.33795712 0.99810363 Cu 21.99274937 3.64657252 -0.03499206 -0.39213790 0.42086806 -0.51800459 Cu 23.87546002 5.47778034 0.01556458 0.39130657 0.27075891 -0.67241933 Cu 23.87251068 3.72671430 1.83723999 0.74414248 -0.37300524 0.35729542 Cu 22.03302826 5.51486699 1.84973200 -1.06012740 -0.27407293 0.46612669 Cu -0.02978043 7.30409326 0.02917856 -0.53919687 0.43818891 -0.67548071 Cu 1.85978223 9.15629618 0.02358905 0.23114878 -0.43770213 -0.97047282 Cu 1.80193499 7.34806517 1.86288339 1.08361627 -0.04687529 0.44604290 Cu 0.02143724 9.20612198 1.85759456 -1.02888636 -0.18717043 0.39366842 Cu 3.71156447 7.32216728 0.03139915 -0.32623962 -0.09796544 -0.66724993 Cu 5.48783796 9.19034986 -0.00590773 0.34107818 -0.20321982 -0.89824886 Cu 5.53107764 7.34833127 1.83318223 -0.17316628 -0.17824731 0.98599646 Cu 3.69304692 9.16890343 1.79908021 -0.32110363 -0.27469652 1.35856353 Cu 7.30937853 7.31203923 -0.02663568 0.16252123 0.49880620 -0.82950669 Cu 9.18523541 9.16512569 0.03344929 -0.22522662 0.01065678 -0.98708626 Cu 9.13778010 7.35520465 1.81145214 0.33915041 -0.28378651 1.22044372 Cu 7.37101020 9.14248753 1.80447785 -0.44704254 0.40614646 1.09464937 Cu 10.99702867 7.36876430 0.01923329 0.22845625 -0.47819237 -0.69034680 Cu 12.86170830 9.14162478 0.03363926 -0.37127426 0.32118962 -0.59989169 Cu 12.87193612 7.30409215 1.85835378 -0.46404168 0.14003561 0.64356743 Cu 11.00049949 9.14520991 1.81286553 0.14764412 0.28195658 1.26703831 Cu 14.67007020 7.37642729 0.01057854 0.32582837 -0.37282173 -0.63055932 Cu 16.52323266 9.18170635 0.00095587 -0.04078504 -0.20152898 -0.74407341 Cu 16.53868368 7.34406967 1.84019229 -0.19406029 -0.38671316 0.72822222 Cu 14.70258454 9.18533650 1.82711449 -0.35217563 -0.05655523 0.94767636 Cu 18.36925317 7.33962585 -0.03078577 -0.23021240 -0.13890911 -0.53747333 Cu 20.18771720 9.14300084 -0.00115102 -0.16372916 0.26765132 -0.80198844 Cu 20.19745435 7.35504652 1.83971099 -0.52375301 -0.43218797 0.66031495 Cu 18.35032632 9.15232082 1.81584144 -0.12709565 0.27082883 0.91305919 Cu 21.99885439 7.33999731 0.03175278 -0.24348099 -0.29793874 -1.00704582 Cu 23.86056760 9.16695634 -0.00869251 0.50827561 0.01747441 -0.44611035 Cu 23.83125571 7.34683894 1.86815412 1.01384107 -0.11020823 0.40514728 Cu 22.00750158 9.13735324 1.82962360 -0.56831158 0.64885799 0.64919172 Cu 0.01599843 10.96909241 0.00317356 -0.63538224 0.14636035 -0.72597935 Cu 1.80428630 12.86927731 0.03021237 0.81770936 -0.20450485 -0.82327863 Cu 1.83162404 10.97772270 1.81087670 0.97621403 0.28107999 1.09815768 Cu 0.02410586 12.80161539 1.86594274 -1.00749634 0.25611773 0.24755289 Cu 3.63510680 10.96974632 0.02244693 0.11515489 0.61544971 -0.92015283 Cu 5.47161271 12.84557883 0.01501817 0.36604820 -0.40808597 -0.64347561 Cu 5.46558643 10.93715924 1.81238243 0.42039217 0.46694890 1.03204639 Cu 3.69742495 12.86291659 1.84226976 -0.37741782 -0.56575730 0.90526807 Cu 7.37105012 10.98905947 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