1372 Lattice="25.08069677675651 0.0 0.0 0.0 25.08069677675651 0.0 0.0 0.0 25.08069677675651" Properties=species:S:1:pos:R:3:forces:R:3 energy=-4558.214583768799 stress="-37.38637567599346 1.2156007316734563 -0.35476017819291883 1.2156007316734563 -36.990909484960525 0.44774717226636085 -0.35476017819291883 0.44774717226636085 -37.18909255592885" pbc="F F F" Cu 0.01915138 0.03382314 0.02071023 0.65961550 0.65503193 0.69141331 Cu 1.78624297 1.81801671 0.00001380 -0.12684520 -0.24279494 0.18642280 Cu 1.81213875 -0.01782295 1.81993773 -0.38355146 0.14094790 -0.25280336 Cu 0.00059219 1.81159703 1.81795766 0.19286136 -0.21694714 -0.14149155 Cu 3.55905946 0.01363914 0.02237044 -0.01313839 0.41385102 0.35258091 Cu 5.40988912 1.75641214 -0.00549789 -0.17452361 0.20143082 0.10974043 Cu 5.36264595 0.01787999 1.76866397 0.05251125 -0.04323530 0.12629354 Cu 3.55533700 1.77364641 1.81840356 0.23141137 0.14477871 -0.42096252 Cu 7.13676733 -0.03130521 0.02603564 0.21984354 0.47819500 0.41461427 Cu 8.97537010 1.81645187 -0.01612275 -0.16757039 -0.22721285 0.13570771 Cu 8.97671286 -0.02280067 1.80148826 -0.29996623 0.03344685 -0.24063405 Cu 7.16813227 1.78047503 1.80988992 0.01356450 0.07178440 -0.20338310 Cu 10.72000282 0.02009238 0.02080233 0.12013108 0.32055051 0.24218478 Cu 12.57579727 1.80610703 -0.02915966 -0.25797815 -0.16036999 0.12586200 Cu 12.52632653 -0.00550632 1.77409641 0.04717219 0.00695717 -0.13718182 Cu 10.71898282 1.74684684 1.78030409 0.28581056 0.25900399 -0.30261543 Cu 14.31619412 -0.00724658 -0.03182404 0.09262037 0.48132388 0.54910891 Cu 16.13955773 1.79042976 0.00444482 -0.17200426 -0.07366459 0.09626101 Cu 16.13407045 -0.02941650 1.81492568 -0.16275482 0.09789722 -0.41523206 Cu 14.30513714 1.77140178 1.77438035 0.27137696 0.05865711 -0.21969584 Cu 17.94627119 0.02471342 0.00166083 -0.11315416 0.23555852 0.39683418 Cu 19.67263973 1.78193252 0.00474403 0.19693215 0.11012320 -0.02991324 Cu 19.73879963 0.03135302 1.79534405 -0.15353623 -0.21728612 -0.00886144 Cu 17.90148753 1.77282612 1.76707791 0.07099469 0.08969217 0.17314827 Cu 21.48901780 0.00885519 0.03162229 0.12801931 0.55740112 0.42031815 Cu 23.31784963 1.82089828 0.02702175 -0.62706118 -0.10995765 0.52523798 Cu 23.29403115 0.02783159 1.78621317 -0.57665713 0.55712071 0.01797853 Cu 21.46592608 1.78671758 1.79399105 0.54179386 0.04039414 -0.18572334 Cu -0.01214747 3.54553147 0.03441978 0.44452477 0.09392301 0.37203941 Cu 1.79835153 5.37008594 -0.02671171 -0.18074130 -0.00941056 0.09900601 Cu 1.81876631 3.61724755 1.79684135 -0.46514991 -0.19386189 -0.19792197 Cu 0.01291862 5.39352973 1.75793742 0.05583193 -0.03098915 0.07038774 Cu 3.55854375 3.60125699 0.02297347 0.18346830 -0.18066968 -0.10795028 Cu 5.37361372 5.37442295 0.00631092 0.03313558 -0.04522178 -0.13076310 Cu 5.34848265 3.61801473 1.79131054 0.23836769 -0.46183669 -0.17312446 Cu 3.59284406 5.38379493 1.81504905 -0.10983681 0.16444437 -0.23355039 Cu 7.21541089 3.59043111 -0.02135338 -0.23518462 -0.16945783 0.08246784 Cu 8.93758533 5.39236164 0.01029673 0.23612431 -0.11941650 -0.28896560 Cu 8.98141494 3.59536471 1.82162693 -0.08261074 -0.15775666 -0.43535809 Cu 7.19755886 5.36032131 1.74043510 -0.35430293 0.03395630 0.29466706 Cu 10.75850116 3.61317690 0.00257833 0.01786391 -0.13467595 -0.00600908 Cu 12.56370761 5.40820619 0.01383022 -0.07563492 -0.07994702 -0.14164242 Cu 12.50735410 3.57202762 1.82489714 0.22115005 0.10625697 -0.46168478 Cu 10.76592553 5.40754557 1.75276961 -0.06844345 -0.08194037 0.21087289 Cu 14.30561959 3.60289836 -0.01539666 0.15390661 -0.12035299 0.12967298 Cu 16.09228663 5.39897789 0.02526202 0.22040762 -0.11811631 -0.20145062 Cu 16.14063810 3.60517006 1.82537851 -0.19013900 -0.22516548 -0.32845750 Cu 14.35604806 5.39015776 1.76393689 -0.22570341 -0.16905795 0.18842808 Cu 17.91714845 3.61877453 0.01965856 -0.07155300 -0.14703397 -0.12223814 Cu 19.69888254 5.38851667 -0.00757012 0.13990751 -0.03144175 -0.06038675 Cu 19.69747382 3.61483909 1.80911379 0.09800257 -0.23525741 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5.40324630 0.18169817 -0.20934756 -0.37249448 Cu 3.60940774 16.12500241 5.39494747 -0.24123599 0.18681834 -0.13447824 Cu 7.20322714 14.29885515 3.57095582 -0.29695005 0.25803228 0.19662040 Cu 8.97399485 16.14123553 3.54939557 -0.06858552 -0.03826568 0.28855766 Cu 8.99209314 14.32766324 5.36303711 -0.14785755 0.09483463 0.05536166 Cu 7.15278012 16.09025905 5.36099398 0.12614523 0.25948351 -0.14918543 Cu 10.72131487 14.28608226 3.56738289 0.24840813 0.28315962 0.18460168 Cu 12.52579246 16.09537465 3.57648284 0.24294470 0.02783399 0.21378260 Cu 12.53607665 14.33285359 5.40982864 0.19569796 0.06681076 -0.37453508 Cu 10.76647588 16.13180647 5.37634692 -0.08103009 -0.17146693 -0.12922100 Cu 14.36099453 14.32976191 3.57609715 -0.38302125 -0.12317699 0.14047538 Cu 16.12639539 16.10076412 3.55573568 0.06924883 0.24389631 0.19490687 Cu 16.09252108 14.30999315 5.36813022 0.16952253 0.15643862 0.07110776 Cu 14.36518876 16.11427222 5.39067204 -0.32883735 0.13609447 -0.15006069 Cu 17.89340014 14.34309812 3.63060182 0.24977210 -0.20965429 -0.26870196 Cu 19.68285691 16.11318075 3.55756611 0.24936402 0.10534747 0.19684138 Cu 19.67640630 14.36457782 5.41993343 0.32236473 -0.27204558 -0.28971641 Cu 17.94128708 16.15210151 5.37989546 -0.23360956 -0.22132135 -0.17278336 Cu 21.50498789 14.36603684 3.58124842 -0.11433671 -0.23884797 0.20356886 Cu 23.28437254 16.09543101 3.57849662 0.24309938 0.15978799 0.21962744 Cu 23.26269342 14.27752252 5.40110433 0.17202765 0.29763267 -0.30496506 Cu 21.50387975 16.15146470 5.39338722 -0.06686997 -0.11048810 -0.18518746 Cu 0.04182256 17.88091442 3.59610791 -0.14333096 0.20051523 -0.07919771 Cu 1.77584341 19.71172112 3.58850407 -0.03462838 -0.16210437 -0.10492567 Cu 1.80030028 17.94837632 5.39768293 -0.17858524 -0.28651771 -0.26733892 Cu -0.02542602 19.71277986 5.34437075 0.02831691 0.08672424 0.12778260 Cu 3.58210369 17.89826620 3.57708331 -0.12098390 0.07469430 -0.13064039 Cu 5.40081958 19.72283185 3.60332575 -0.37386367 -0.23333047 -0.30400768 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