108 Lattice="10.650045154781594 0.0 0.0 0.0 10.650045154781594 0.0 0.0 0.0 10.650045154781594" Properties=species:S:1:pos:R:3:forces:R:3 energy=-331.84715368785777 stress="-0.006182951316648878 0.0007164667098749229 0.0006297694350642817 0.0007164667098749229 -0.007048056891836146 0.00026932347721958625 0.0006297694350642817 0.00026932347721958625 -0.006315200953590257" free_energy=-331.84715368785777 pbc="F F F" Cu 0.01772400 0.02587511 0.00964488 0.33066946 0.30553821 0.31855368 Cu 1.79570237 1.74634280 0.00069270 -0.19259360 0.19139948 -0.11259061 Cu 1.74511283 0.00044994 1.80062241 0.09358975 -0.33105681 -0.31391761 Cu 0.01455060 1.73976151 1.79245972 -0.31031442 0.25087002 -0.24797661 Cu 3.51829933 0.01548360 0.02536572 0.12957849 -0.02046322 0.05072858 Cu 5.34273772 1.78630452 0.00576883 -0.22483985 -0.06607667 -0.26398487 Cu 5.32679451 0.03394562 1.75985437 0.10404188 -0.39259101 0.04339048 Cu 3.56752031 1.74982715 1.79935664 -0.14065194 0.36099691 -0.29075276 Cu 7.08366713 0.01124368 0.01101921 0.04130966 0.03877106 0.05629479 Cu 8.82629858 1.77817787 0.03773228 0.15506448 0.01526342 -0.16819552 Cu 8.86165535 0.03406671 1.75714931 -0.11831506 0.00761400 0.12106518 Cu 7.11154373 1.79800230 1.75270445 -0.22149445 -0.22544641 0.44276631 Cu 0.00082337 3.54917534 0.01444443 0.20920655 -0.18436035 0.13930785 Cu 1.74167227 5.34946484 0.01455491 0.19915173 -0.21744145 -0.34538552 Cu 1.80482199 3.53042378 1.79158095 -0.21934220 0.05509378 -0.30524676 Cu 0.01405020 5.30555511 1.74046925 -0.24803459 0.14809789 0.29695799 Cu 3.58029884 3.56562417 0.02428724 -0.25648622 -0.13200418 -0.31895324 Cu 5.34095704 5.31534260 0.01871706 -0.12139956 0.28444065 -0.34589384 Cu 5.29839663 3.57775910 1.79530436 0.08044069 -0.41366993 0.12033688 Cu 3.54742445 5.32931416 1.76867061 -0.13284728 0.21915152 0.12894060 Cu 7.07944878 3.52884048 0.02828809 0.19811186 0.28920468 -0.41802447 Cu 8.90052618 5.35234072 0.00917025 -0.20689754 -0.14650228 0.18019009 Cu 8.87894455 3.55762994 1.78798411 0.36218845 0.12089999 -0.09803772 Cu 7.07748078 5.29561084 1.75856276 0.30523365 0.35233312 0.34418704 Cu 0.01180188 7.13775708 0.01854678 -0.07093469 -0.06015070 -0.05430947 Cu 1.80078740 8.85198218 0.01606164 -0.17152094 0.16308791 -0.00286528 Cu 1.74138411 7.11862664 1.74581808 0.29445820 -0.22573773 0.51178097 Cu 0.00531653 8.83972364 1.80349613 0.02009861 0.14349770 -0.08086487 Cu 3.51873952 7.12470732 0.01117379 0.31869711 -0.25743922 -0.28823667 Cu 5.35298334 8.84366013 0.00394420 0.01551110 -0.09714479 0.09971231 Cu 5.32378221 7.11445527 1.80633145 0.12089999 -0.27658494 -0.27132676 Cu 3.57187140 8.86004368 1.75991212 -0.19046779 0.39797142 0.01130287 Cu 7.13351612 7.09060176 0.01704895 0.04044681 0.19444902 -0.19739887 Cu 8.88580707 8.89825145 0.01953645 -0.49934527 -0.52134816 0.50909665 Cu 8.86940212 7.09794219 1.79163146 0.17719578 0.06582130 -0.10366935 Cu 7.11110458 8.85776326 1.80056444 0.10317532 0.29693275 -0.27664161 Cu 0.03892929 0.01128914 3.55146154 -0.08098465 -0.12034035 0.15066866 Cu 1.76953342 1.78582779 3.54264737 0.11640083 -0.08365582 0.17687193 Cu 1.80086645 0.00613680 5.35437566 -0.15443310 -0.20651191 -0.20118915 Cu 0.01515109 1.76613483 5.29803201 -0.33431520 -0.03559967 0.08508271 Cu 3.53368643 0.03209543 3.51279862 0.02697807 -0.49750427 0.32573560 Cu 5.30668645 1.76006328 3.57118288 0.27805186 0.19731311 -0.22886902 Cu 5.28978997 0.02145424 5.35327284 0.24514989 -0.50086641 -0.24302560 Cu 3.57666427 1.76744598 5.34585056 -0.29451276 0.23613526 -0.23763291 Cu 7.09322498 0.01094046 3.55333299 0.10524037 -0.06744772 0.09237585 Cu 8.89997621 1.76511963 3.56501646 0.07552744 -0.05934093 -0.01011986 Cu 8.90845583 0.02316451 5.33783403 -0.32507644 0.15320562 0.02430406 Cu 7.07790422 1.80055666 5.36032386 0.36269778 -0.41417800 -0.47516516 Cu 0.00424866 3.57643811 3.54327074 -0.30799774 -0.14775940 -0.07821593 Cu 1.79661242 5.29175043 3.57855427 -0.13137525 0.57942543 -0.33791980 Cu 1.76144503 3.52887326 5.30716746 0.08164037 0.09207335 0.16154572 Cu 0.01466629 5.34848834 5.30318233 -0.25681674 -0.09452318 0.15468826 Cu 3.51801628 3.55167312 3.56556277 0.30171332 -0.24824399 -0.09103149 Cu 5.30116596 5.29238465 3.56738729 0.18738132 0.29133698 -0.17342733 Cu 5.34773481 3.53666470 5.27854874 -0.12784660 0.16908975 0.38104042 Cu 3.55101380 5.29486160 5.32100439 -0.07121236 0.27509005 0.25321934 Cu 7.13296581 3.52844887 3.51461896 -0.16895191 0.08857464 0.26116555 Cu 8.90189090 5.35012236 3.58499318 0.09447706 -0.14000033 -0.23371418 Cu 8.85487606 3.52100310 5.35742022 0.46358353 0.30736446 -0.32085333 Cu 7.12343339 5.32683404 5.29211652 -0.00542259 -0.14103395 0.07750161 Cu 0.01675050 7.13192423 3.56838205 -0.22911761 -0.33243970 -0.11968222 Cu 1.77208144 8.86384404 3.57274463 0.16065047 0.32741578 -0.08468310 Cu 1.77280132 7.12380109 5.35332298 0.27452911 -0.32808115 -0.21348155 Cu 0.01220694 8.85018350 5.34535714 -0.09482691 0.07004238 0.00933902 Cu 3.56279148 7.12928783 3.53988603 -0.23248907 -0.29462431 0.24826670 Cu 5.29522259 8.90368571 3.52573843 0.14261004 0.25544976 0.22172919 Cu 5.34819020 7.07072909 5.33274184 -0.40031577 0.28105440 -0.20824295 Cu 3.57946649 8.90989170 5.35033537 -0.12060501 0.12833010 -0.18070219 Cu 7.07013399 7.11973127 3.58264073 0.23028177 -0.23605611 -0.31610356 Cu 8.87263410 8.87168396 3.53612714 -0.10587753 -0.11641028 0.12519458 Cu 8.89320344 7.10267127 5.32719944 0.11895136 0.20560393 0.05528175 Cu 7.06165516 8.86173023 5.31675503 0.19401129 0.29968023 0.13468460 Cu 0.00833334 0.02689850 7.10125418 0.20004720 0.23060260 0.10134572 Cu 1.76921153 1.80156252 7.08915124 -0.11722609 -0.25989556 0.23434626 Cu 1.79479041 0.01116785 8.86607768 -0.13229761 0.21163004 -0.19706558 Cu 0.03134921 1.80912704 8.90433792 0.20585462 -0.11103502 -0.25856514 Cu 3.53643942 0.03358900 7.08519847 0.11173855 -0.42557420 0.28230621 Cu 5.37662726 1.76893967 7.07725206 -0.36845874 0.37927418 0.44265526 Cu 5.32494595 0.02330392 8.88339266 0.07057973 0.04333940 -0.10273665 Cu 3.58211271 1.74447559 8.84483910 -0.07471657 0.23514819 0.30229193 Cu 7.07673204 0.01848659 7.12729628 0.42745578 -0.24693333 0.03575839 Cu 8.89539159 1.79610594 7.07370278 0.08281500 -0.30900406 0.46300696 Cu 8.85884415 0.02807234 8.85730437 -0.43434300 0.46244630 -0.42911844 Cu 7.09993249 1.82626734 8.90148934 0.17623881 -0.25269030 0.01938678 Cu 0.02022975 3.53621259 7.07970344 -0.34318770 0.05489421 0.14507066 Cu 1.76215131 5.29718810 7.12167903 0.21867055 0.20086249 -0.31037376 Cu 1.80662472 3.55431027 8.89844875 -0.19292963 -0.17451785 0.21983594 Cu 0.02172866 5.33322416 8.84767576 0.01975892 -0.10475030 0.08005342 Cu 3.52272753 3.51976475 7.08733717 0.48366610 0.21061892 -0.00501483 Cu 5.35912228 5.34896509 7.07013985 -0.35990299 -0.48656703 0.20728712 Cu 5.33358077 3.57451082 8.88714278 -0.04729908 -0.05725438 -0.04512849 Cu 3.53594269 5.29798736 8.85693151 0.17913458 0.19316150 0.12986422 Cu 7.12985364 3.57815109 7.07002396 -0.27559461 0.03645290 0.39018655 Cu 8.89426842 5.36329525 7.13180343 0.21378781 -0.18611816 -0.24051404 Cu 8.85105134 3.58262637 8.88018621 0.07103606 -0.13783118 -0.10412319 Cu 7.12696484 5.31759751 8.89231831 -0.13556779 0.15069292 0.17596113 Cu 0.01178846 7.07469369 7.10982105 -0.30994671 0.22334028 0.17683592 Cu 1.75103636 8.84566711 7.09933762 0.04224050 0.44369092 0.27727241 Cu 1.80352029 7.10644332 8.88036257 -0.23765589 0.00377051 0.17872313 Cu 0.02784524 8.88191327 8.88258214 0.42892035 -0.47987889 -0.44057897 Cu 3.56331471 7.13325134 7.07649405 -0.09294593 -0.40502135 0.18406066 Cu 5.29226137 8.88204274 7.12161396 0.33591824 0.13063217 0.18407582 Cu 5.30442768 7.06742430 8.89160164 0.14196160 0.18788931 0.10336923 Cu 3.52758681 8.84747535 8.90565073 0.06230241 -0.02194130 -0.14381475 Cu 7.08189828 7.06587099 7.08278996 0.26852194 0.50015280 0.32261342 Cu 8.86344820 8.87115220 7.09891181 -0.28727372 -0.21653902 -0.00559367 Cu 8.89991556 7.10066609 8.84305110 -0.25138518 0.16946945 -0.06161950 Cu 7.12125491 8.88500015 8.88552573 -0.07120036 -0.41850189 -0.36703622