864 Lattice="15.337149064139876 0.0 0.0 15.337149064139878 18.78409465807362 0.0 0.0 0.0 70.83925712626059" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2997.8122386835453 stress="0.001861916331189947 -2.1261866658525812e-07 -5.094082259485237e-07 -2.1261866658525812e-07 0.0012140183278739564 2.4084353191474274e-06 -5.094082259485237e-07 2.4084353191474274e-06 3.2876830849351485e-07" pbc="T T F" Cu 0.00130532 0.01936033 17.79713260 -0.00000188 0.00000778 0.00000075 Cu 3.83559248 2.07504614 18.48284455 -0.00000165 0.00000758 0.00000158 Cu 2.55749680 0.01936031 17.79713259 -0.00000156 0.00000763 0.00000120 Cu 6.39178400 2.07504623 18.48284453 -0.00000175 0.00000772 0.00000092 Cu 17.89464541 16.70392154 19.17342802 -0.00000192 0.00000801 0.00000054 Cu 6.39178317 0.00281344 19.94070107 -0.00000082 0.00000735 0.00000112 Cu 20.45083687 16.70392170 19.17342790 -0.00000143 0.00000695 0.00000111 Cu 8.94797482 0.00281342 19.94070100 -0.00000262 0.00000833 0.00000116 Cu 20.45083590 14.61892950 20.65838902 -0.00000171 0.00000865 0.00000088 Cu 24.28512217 16.69675917 21.39262798 -0.00000048 0.00000715 0.00000173 Cu 23.00702739 14.61892980 20.65838888 -0.00000147 0.00000599 0.00000108 Cu 26.84131383 16.69675910 21.39262804 -0.00000265 0.00000760 0.00000120 Cu 23.00702489 12.52359987 22.15021372 -0.00000137 0.00000747 -0.00000148 Cu 26.84131103 14.61193844 22.87660687 -0.00000117 0.00000722 0.00000120 Cu 10.22606734 12.52359997 22.15021342 -0.00000163 0.00000650 0.00000188 Cu 14.06035352 14.61193830 22.87660699 -0.00000172 0.00000747 0.00000094 Cu 10.22606473 10.43621160 23.61320843 -0.00000197 0.00000741 0.00000075 Cu 14.06034977 12.52379864 24.35851603 0.00000054 0.00000665 0.00000139 Cu 12.78225616 10.43621165 23.61320852 -0.00000091 0.00000545 0.00000065 Cu 16.61654159 12.52379853 24.35851611 -0.00000325 0.00000704 0.00000148 Cu 12.78225252 8.35001660 25.09125210 -0.00000086 0.00000623 -0.00000009 Cu 16.61653763 10.43647647 25.82931418 -0.00000148 0.00000647 0.00000128 Cu 15.33844412 8.35001650 25.09125213 -0.00000176 0.00000597 0.00000091 Cu 19.17272910 10.43647655 25.82931420 -0.00000102 0.00000627 0.00000069 Cu 15.33843961 6.26250766 26.57005245 -0.00000211 0.00000565 0.00000057 Cu 19.17272435 8.34979279 27.30564043 -0.00000059 0.00000528 0.00000084 Cu 17.89463097 6.26250768 26.57005249 -0.00000025 0.00000520 0.00000022 Cu 21.72891593 8.34979288 27.30564026 -0.00000156 0.00000589 0.00000146 Cu 17.89462597 4.17530638 28.04385601 -0.00000060 0.00000450 0.00000033 Cu 6.39176147 6.26257156 28.78282865 -0.00000133 0.00000479 0.00000134 Cu 5.11366847 4.17530646 28.04385593 -0.00000141 0.00000486 0.00000039 Cu 8.94795292 6.26257167 28.78282865 -0.00000048 0.00000452 0.00000038 Cu 5.11366286 2.08839192 29.51973080 -0.00000142 0.00000354 0.00000049 Cu 8.94794719 4.17543010 30.25785781 -0.00000112 0.00000332 0.00000050 Cu 7.66985427 2.08839201 29.51973075 -0.00000007 0.00000408 0.00000019 Cu 11.50413865 4.17542999 30.25785780 -0.00000029 0.00000406 0.00000104 Cu 7.66984825 0.00126913 30.99616076 -0.00000046 0.00000254 0.00000065 Cu 11.50413255 2.08842215 31.73365316 -0.00000106 0.00000268 0.00000089 Cu 10.22603979 0.00126910 30.99616083 -0.00000064 0.00000318 -0.00000006 Cu 14.06032398 2.08842203 31.73365330 0.00000015 0.00000255 0.00000037 Cu 25.56318264 16.69825426 32.47166843 -0.00000031 0.00000117 0.00000021 Cu 14.06031771 0.00133673 33.20973010 -0.00000099 0.00000160 0.00000021 Cu 28.11937416 16.69825407 32.47166854 -0.00000042 0.00000230 -0.00000029 Cu 1.27936003 0.00133664 33.20973012 0.00000050 0.00000161 0.00000035 Cu 12.78221871 14.61120741 33.94749431 -0.00000030 0.00000031 0.00000047 Cu 16.61650274 16.69833597 34.68540195 -0.00000075 0.00000041 0.00000007 Cu 15.33841019 14.61120721 33.94749444 -0.00000001 0.00000127 -0.00000039 Cu 19.17269413 16.69833602 34.68540187 0.00000066 0.00000029 0.00000043 Cu 15.33840370 12.52414125 35.42340425 0.00000055 -0.00000089 -0.00000006 Cu 19.17268780 14.61126996 36.16131176 -0.00000059 -0.00000045 -0.00000012 Cu 17.89459530 12.52414113 35.42340430 -0.00000049 0.00000036 -0.00000060 Cu 21.72887919 14.61127014 36.16131169 0.00000093 -0.00000112 -0.00000010 Cu 17.89458876 10.43704588 36.89907601 0.00000019 -0.00000192 0.00000032 Cu 21.72887286 12.52422339 37.63713755 -0.00000003 -0.00000189 -0.00000047 Cu 20.45078028 10.43704592 36.89907602 0.00000026 -0.00000106 -0.00000050 Cu 24.28506432 12.52422349 37.63713747 0.00000070 -0.00000222 0.00000006 Cu 20.45077384 8.34996068 38.37515276 0.00000105 -0.00000286 -0.00000027 Cu 8.94790909 10.43711387 39.11264512 0.00000002 -0.00000277 -0.00000066 Cu 7.66981638 8.34996073 38.37515270 -0.00000007 -0.00000205 -0.00000052 Cu 11.50410050 10.43711386 39.11264515 0.00000114 -0.00000331 -0.00000070 Cu 7.66981022 6.26295290 39.85094796 0.00000062 -0.00000364 0.00000005 Cu 11.50409451 8.34999093 40.58907516 0.00000069 -0.00000418 -0.00000088 Cu 10.22600171 6.26295288 39.85094797 0.00000081 -0.00000323 -0.00000048 Cu 14.06028599 8.34999081 40.58907520 0.00000094 -0.00000424 -0.00000038 Cu 10.22599598 4.17581132 41.32597711 0.00000124 -0.00000450 -0.00000029 Cu 14.06028049 6.26307622 42.06495012 0.00000075 -0.00000488 -0.00000099 Cu 12.78218754 4.17581118 41.32597718 0.00000053 -0.00000403 -0.00000034 Cu 16.61647197 6.26307619 42.06495019 0.00000123 -0.00000536 -0.00000116 Cu 12.78218216 2.08858986 42.80316561 0.00000120 -0.00000509 -0.00000031 Cu 16.61646702 4.17587486 43.53875377 0.00000141 -0.00000574 -0.00000136 Cu 15.33837369 2.08858976 42.80316574 0.00000095 -0.00000513 -0.00000056 Cu 3.83550953 4.17587492 43.53875372 0.00000084 -0.00000591 -0.00000096 Cu 0.00121984 0.00190597 44.27949202 0.00000131 -0.00000563 -0.00000049 Cu 3.83550497 2.08836610 45.01755408 0.00000123 -0.00000650 -0.00000131 Cu 2.55741136 0.00190596 44.27949204 0.00000113 -0.00000568 -0.00000038 Cu 6.39169648 2.08836623 45.01755397 0.00000125 -0.00000671 -0.00000110 Cu 17.89455646 16.69867856 45.75029012 0.00000150 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10.43556937 50.16810490 0.00000154 -0.00000763 -0.00000051 Cu 16.61645254 12.51855564 50.93537835 0.00000152 -0.00000788 -0.00000123 Cu 12.78216505 8.36333651 51.62596144 0.00000176 -0.00000745 -0.00000117 Cu 16.61645226 10.41902213 52.31167361 0.00000181 -0.00000754 -0.00000126 Cu 15.33835660 8.36333642 51.62596146 0.00000155 -0.00000764 -0.00000077 Cu 19.17264378 10.41902218 52.31167357 0.00000155 -0.00000756 -0.00000129 Cu 5.11368807 6.28072547 17.79713245 -0.00000173 0.00000774 0.00000098 Cu 8.94797519 8.33641129 18.48284456 -0.00000102 0.00000758 0.00000116 Cu 7.66987957 6.28072558 17.79713239 -0.00000153 0.00000748 0.00000097 Cu 11.50416683 8.33641125 18.48284460 -0.00000226 0.00000775 0.00000123 Cu 7.66987946 4.18119200 19.17342756 -0.00000161 0.00000756 0.00000082 Cu 11.50416613 6.26417836 19.94070093 -0.00000169 0.00000754 0.00000172 Cu 10.22607100 4.18119204 19.17342753 -0.00000174 0.00000737 0.00000122 Cu 14.06035763 6.26417825 19.94070109 -0.00000158 0.00000778 0.00000085 Cu 10.22607023 2.09619992 20.65838866 -0.00000320 0.00000778 0.00000067 Cu 14.06035631 4.17402930 21.39262796 -0.00000080 0.00000670 0.00000112 Cu 12.78226150 2.09619993 20.65838871 -0.00000011 0.00000669 0.00000084 Cu 16.61654795 4.17402911 21.39262797 -0.00000239 0.00000826 0.00000137 Cu 12.78225906 0.00087005 22.15021345 -0.00000159 0.00000753 0.00000030 Cu 16.61654526 2.08920850 22.87660669 -0.00000117 0.00000720 0.00000220 Cu 0.00130151 0.00087004 22.15021344 -0.00000152 0.00000631 0.00000137 Cu 3.83558777 2.08920853 22.87660679 -0.00000192 0.00000740 0.00000058 Cu 15.33844777 16.69757630 23.61320859 -0.00000190 0.00000725 -0.00000010 Cu 3.83558402 0.00106890 24.35851587 -0.00000093 0.00000628 0.00000108 Cu 17.89463922 16.69757636 23.61320853 -0.00000089 0.00000628 0.00000100 Cu 21.72892468 18.78516360 24.35851580 -0.00000185 0.00000740 0.00000115 Cu 17.89463545 14.61138132 25.09125223 -0.00000149 0.00000677 0.00000066 Cu 21.72892055 16.69784162 25.82931392 -0.00000055 0.00000599 0.00000154 Cu 20.45082694 14.61138155 25.09125216 -0.00000107 0.00000523 0.00000071 Cu 24.28511216 16.69784168 25.82931390 -0.00000187 0.00000625 0.00000109 Cu 20.45082234 12.52387264 26.57005267 -0.00000094 0.00000555 -0.00000057 Cu 24.28510726 14.61115789 27.30564028 -0.00000127 0.00000554 0.00000106 Cu 23.00701388 12.52387279 26.57005245 -0.00000134 0.00000532 0.00000082 Cu 26.84129872 14.61115782 27.30564032 -0.00000081 0.00000574 0.00000075 Cu 23.00700897 10.43667146 28.04385603 -0.00000154 0.00000480 0.00000067 Cu 11.50414427 12.52393651 28.78282879 -0.00000042 0.00000439 0.00000100 Cu 10.22605132 10.43667151 28.04385603 -0.00000038 0.00000437 0.00000024 Cu 14.06033584 12.52393632 28.78282885 -0.00000127 0.00000495 0.00000137 Cu 10.22604587 8.34975694 29.51973087 -0.00000027 0.00000345 0.00000015 Cu 14.06033021 10.43679472 30.25785809 -0.00000140 0.00000411 0.00000092 Cu 12.78223747 8.34975677 29.51973096 -0.00000137 0.00000415 0.00000011 Cu 16.61652161 10.43679467 30.25785821 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19.17266911 14.61135571 40.58907516 0.00000112 -0.00000441 -0.00000071 Cu 15.33837900 10.43717599 41.32597734 0.00000090 -0.00000446 -0.00000008 Cu 19.17266355 12.52444109 42.06495011 0.00000096 -0.00000494 -0.00000102 Cu 17.89457051 10.43717596 41.32597736 0.00000091 -0.00000426 -0.00000037 Cu 21.72885506 12.52444123 42.06495000 0.00000102 -0.00000523 -0.00000058 Cu 17.89456503 8.34995460 42.80316585 0.00000153 -0.00000497 -0.00000068 Cu 21.72884999 10.43723990 43.53875369 0.00000116 -0.00000570 -0.00000128 Cu 20.45075662 8.34995469 42.80316577 0.00000067 -0.00000495 -0.00000047 Cu 8.94789243 10.43724000 43.53875365 0.00000122 -0.00000612 -0.00000118 Cu 5.11360274 6.26327091 44.27949207 0.00000122 -0.00000559 -0.00000035 Cu 8.94788779 8.34973116 45.01755404 0.00000175 -0.00000649 -0.00000129 Cu 7.66979426 6.26327106 44.27949200 0.00000121 -0.00000605 -0.00000043 Cu 11.50407936 8.34973113 45.01755405 0.00000091 -0.00000669 -0.00000084 Cu 7.66979042 4.17594897 45.75029005 0.00000147 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Cu 15.33845287 8.35756465 20.65838900 -0.00000126 0.00000739 0.00000011 Cu 19.17273914 10.43539403 21.39262827 -0.00000160 0.00000790 0.00000131 Cu 17.89464444 8.35756467 20.65838892 -0.00000199 0.00000686 0.00000127 Cu 21.72893063 10.43539416 21.39262817 -0.00000149 0.00000770 0.00000091 Cu 17.89464216 6.26223478 22.15021349 -0.00000262 0.00000776 0.00000052 Cu 21.72892805 8.35057355 22.87660681 -0.00000028 0.00000676 0.00000116 Cu 5.11368443 6.26223497 22.15021341 -0.00000040 0.00000645 0.00000060 Cu 8.94797068 8.35057355 22.87660670 -0.00000267 0.00000772 0.00000172 Cu 5.11368188 4.17484666 23.61320832 -0.00000111 0.00000676 0.00000038 Cu 8.94796712 6.26243394 24.35851566 -0.00000136 0.00000678 0.00000195 Cu 7.66987345 4.17484681 23.61320820 -0.00000182 0.00000633 0.00000103 Cu 11.50415864 6.26243389 24.35851581 -0.00000136 0.00000674 0.00000060 Cu 7.66986971 2.08865183 25.09125186 -0.00000249 0.00000629 0.00000043 Cu 11.50415473 4.17511190 25.82931381 -0.00000088 0.00000566 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