504 Lattice="15.337146756606897 0.0 0.0 0.0 10.84500047565 0.0 0.0 0.0 35.7866757654161" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1754.8372813722344 stress="20.59208586482758 1.8761097919650638e-07 -0.025612901264999266 1.8761097919650638e-07 23.348181154603594 0.0016056493769225355 -0.025612901264999266 0.0016056493769225355 2.651118798802088e-05" pbc="T T F" Cu 0.00673960 0.00653115 0.06708154 -0.00000921 0.00000034 0.00000196 Cu 2.56293240 0.00653158 0.06708300 -0.00000974 -0.00000000 0.00000193 Cu 1.28482714 1.81403144 1.28405482 -0.00000882 0.00000003 0.00000232 Cu 3.84101849 1.81403163 1.28405983 -0.00000964 -0.00000014 0.00000066 Cu 2.56290243 0.00653148 2.56416398 -0.00000887 0.00000037 0.00000129 Cu 5.11909349 0.00653161 2.56417058 -0.00000877 0.00000026 -0.00000000 Cu 3.84096979 1.81403179 3.83517212 -0.00000778 -0.00000013 0.00000072 Cu 6.39716098 1.81403183 3.83517872 -0.00000868 -0.00000017 -0.00000152 Cu 5.11902820 0.00653183 5.11642183 -0.00000751 0.00000059 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0.00000469 -0.00000050 -0.00000119 Cu 3.83989737 1.81405142 31.95086385 0.00000453 -0.00000057 -0.00000105 Cu 2.56179218 0.00655147 33.23097193 0.00000439 -0.00000025 -0.00000140 Cu 5.11798335 0.00655157 33.23096965 0.00000458 -0.00000033 -0.00000025 Cu 3.83988426 1.81405171 34.44794477 0.00000421 -0.00000042 -0.00000085 Cu 6.39607570 1.81405174 34.44794157 0.00000411 -0.00000044 0.00000035 Cu 0.00673958 3.62153143 0.06708154 -0.00000918 0.00000025 0.00000195 Cu 2.56293239 3.62153142 0.06708298 -0.00000973 0.00000023 0.00000194 Cu 1.28482727 5.42903156 1.28405474 -0.00000893 0.00000005 0.00000238 Cu 3.84101854 5.42903167 1.28405956 -0.00000967 -0.00000005 0.00000087 Cu 2.56290242 3.62153166 2.56416398 -0.00000886 0.00000034 0.00000129 Cu 5.11909351 3.62153177 2.56417058 -0.00000879 0.00000025 -0.00000001 Cu 3.84096980 5.42903195 3.83517197 -0.00000779 -0.00000013 0.00000082 Cu 6.39716103 5.42903199 3.83517860 -0.00000873 -0.00000016 -0.00000144 Cu 5.11902820 3.62153209 5.11642184 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14.06227130 0.00000061 -0.00000006 0.00000088 Cu 1.28432782 5.42903693 14.06227090 -0.00000020 -0.00000006 0.00000080 Cu 15.34331168 3.62153805 15.34036992 0.00000109 0.00000089 0.00000034 Cu 2.56235552 3.62153807 15.34037113 0.00000153 0.00000086 0.00000094 Cu 1.28419396 5.42903958 16.61846478 0.00000263 -0.00000029 0.00000068 Cu 3.84038470 5.42903960 16.61846689 0.00000189 -0.00000030 -0.00000015 Cu 2.56222527 3.62154087 17.89656289 0.00000286 0.00000058 -0.00000029 Cu 5.11841613 3.62154090 17.89656471 0.00000324 0.00000056 0.00000012 Cu 3.84025956 5.42904248 19.17465817 0.00000409 -0.00000057 -0.00000005 Cu 6.39645075 5.42904250 19.17465909 0.00000322 -0.00000059 -0.00000051 Cu 5.11829761 3.62154377 20.45275758 0.00000401 0.00000025 -0.00000072 Cu 7.67448897 3.62154378 20.45275724 0.00000421 0.00000023 0.00000026 Cu 6.39633981 5.42904528 21.73084567 0.00000487 -0.00000079 -0.00000001 Cu 8.95253140 5.42904528 21.73084456 0.00000398 -0.00000078 0.00000007 Cu 7.67438663 3.62154643 23.00895729 0.00000460 -0.00000003 -0.00000018 Cu 10.23057818 3.62154640 23.00895602 0.00000473 -0.00000000 0.00000084 Cu 8.95243821 5.42904770 24.28701204 0.00000520 -0.00000091 0.00000069 Cu 11.50862975 5.42904766 24.28701155 0.00000444 -0.00000087 0.00000041 Cu 10.23049480 3.62154857 25.56520002 0.00000480 -0.00000017 0.00000046 Cu 12.78668610 3.62154851 25.56520070 0.00000504 -0.00000012 0.00000060 Cu 11.50855646 5.42904952 26.84307516 0.00000518 -0.00000082 0.00000083 Cu 14.06474761 5.42904947 26.84307711 0.00000468 -0.00000078 -0.00000029 Cu 12.78662313 3.62155007 28.12168212 0.00000475 -0.00000017 0.00000010 Cu 15.34281409 3.62155004 28.12168470 0.00000508 -0.00000015 -0.00000048 Cu 14.06469497 5.42905072 29.39861019 0.00000494 -0.00000062 -0.00000013 Cu 1.28373911 5.42905073 29.39861258 0.00000470 -0.00000064 -0.00000122 Cu 15.34277149 3.62155105 30.67985817 0.00000454 -0.00000016 -0.00000103 Cu 2.56181563 3.62155111 30.67985938 0.00000487 -0.00000021 -0.00000107 Cu 1.28370637 5.42905149 31.95086427 0.00000467 -0.00000048 -0.00000112 Cu 3.83989740 5.42905157 31.95086384 0.00000451 -0.00000056 -0.00000104 Cu 2.56179220 3.62155167 33.23097193 0.00000436 -0.00000028 -0.00000140 Cu 5.11798336 3.62155170 33.23096967 0.00000457 -0.00000031 -0.00000026 Cu 3.83988430 5.42905190 34.44794476 0.00000420 -0.00000044 -0.00000085 Cu 6.39607571 5.42905185 34.44794162 0.00000410 -0.00000041 0.00000029 Cu 0.00673965 7.23653152 0.06708154 -0.00000924 0.00000030 0.00000195 Cu 2.56293245 7.23653169 0.06708292 -0.00000978 0.00000016 0.00000198 Cu 1.28482729 9.04403175 1.28405473 -0.00000893 0.00000004 0.00000240 Cu 3.84101854 9.04403199 1.28405955 -0.00000967 -0.00000017 0.00000087 Cu 2.56290248 7.23653178 2.56416386 -0.00000890 0.00000039 0.00000139 Cu 5.11909350 7.23653190 2.56417043 -0.00000879 0.00000028 0.00000012 Cu 3.84096980 9.04403205 3.83517196 -0.00000780 -0.00000008 0.00000083 Cu 6.39716101 9.04403212 3.83517860 -0.00000871 -0.00000014 -0.00000144 Cu 5.11902823 7.23653218 5.11642174 -0.00000756 0.00000056 -0.00000081 Cu 7.67521955 7.23653217 5.11642643 -0.00000752 0.00000056 -0.00000147 Cu 6.39707945 9.04403255 6.39335113 -0.00000610 -0.00000004 -0.00000120 Cu 8.95327096 9.04403255 6.39335290 -0.00000717 -0.00000003 -0.00000200 Cu 7.67512382 7.23653283 7.67195860 -0.00000566 0.00000081 -0.00000220 Cu 10.23131531 7.23653275 7.67195716 -0.00000562 0.00000089 -0.00000087 Cu 8.95316250 9.04403347 8.94983343 -0.00000397 0.00000004 -0.00000153 Cu 11.50935404 9.04403342 8.94982973 -0.00000506 0.00000008 -0.00000059 Cu 10.23119672 7.23653397 10.22802049 -0.00000342 0.00000104 -0.00000157 Cu 12.78738802 7.23653391 10.22801575 -0.00000329 0.00000108 0.00000085 Cu 11.50922750 9.04403495 11.50607401 -0.00000166 0.00000006 -0.00000025 Cu 14.06541866 9.04403492 11.50606989 -0.00000263 0.00000009 0.00000083 Cu 12.78725620 7.23653578 12.78418432 -0.00000112 0.00000106 -0.00000013 Cu 15.34344705 7.23653578 12.78418178 -0.00000080 0.00000106 0.00000162 Cu 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7.67438663 7.23654658 23.00895727 0.00000458 -0.00000002 -0.00000017 Cu 10.23057819 7.23654656 23.00895601 0.00000471 -0.00000001 0.00000083 Cu 8.95243821 9.04404785 24.28701203 0.00000519 -0.00000089 0.00000070 Cu 11.50862975 9.04404782 24.28701155 0.00000443 -0.00000085 0.00000041 Cu 10.23049483 7.23654872 25.56520001 0.00000478 -0.00000017 0.00000050 Cu 12.78668613 7.23654868 25.56520070 0.00000501 -0.00000014 0.00000060 Cu 11.50855646 9.04404967 26.84307516 0.00000518 -0.00000081 0.00000083 Cu 14.06474761 9.04404967 26.84307712 0.00000469 -0.00000082 -0.00000029 Cu 12.78662317 7.23655024 28.12168212 0.00000472 -0.00000018 0.00000010 Cu 15.34281409 7.23655023 28.12168469 0.00000507 -0.00000017 -0.00000047 Cu 14.06469496 9.04405093 29.39861020 0.00000496 -0.00000068 -0.00000014 Cu 1.28373910 9.04405097 29.39861258 0.00000471 -0.00000071 -0.00000122 Cu 15.34277149 7.23655123 30.67985809 0.00000454 -0.00000017 -0.00000098 Cu 2.56181560 7.23655129 30.67985933 0.00000491 -0.00000023 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0.00000008 -0.00000070 Cu 10.23141094 0.00653178 5.11642506 -0.00000770 0.00000062 -0.00000203 Cu 12.78760222 0.00653169 5.11641884 -0.00000763 0.00000071 0.00000087 Cu 11.50946229 1.81403210 6.39334866 -0.00000628 0.00000010 -0.00000053 Cu 14.06565350 1.81403206 6.39334275 -0.00000726 0.00000012 0.00000124 Cu 12.78750659 0.00653240 7.67195175 -0.00000581 0.00000092 -0.00000012 Cu 15.34369750 0.00653238 7.67194759 -0.00000559 0.00000094 0.00000220 Cu 14.06554508 1.81403304 8.94982462 -0.00000408 0.00000014 0.00000121 Cu 1.28458915 1.81403308 8.94982327 -0.00000492 0.00000010 0.00000154 Cu 15.34357891 0.00653361 10.22801250 -0.00000339 0.00000106 0.00000096 Cu 2.56262282 0.00653365 10.22801377 -0.00000304 0.00000103 0.00000160 Cu 1.28446256 1.81403462 11.50606896 -0.00000151 0.00000007 0.00000141 Cu 3.84065335 1.81403467 11.50607217 -0.00000234 0.00000003 0.00000025 Cu 2.56249094 0.00653550 12.78418315 -0.00000085 0.00000103 0.00000032 Cu 5.11868182 0.00653554 12.78418687 -0.00000052 0.00000100 0.00000015 Cu 3.84051845 1.81403681 14.06227352 0.00000092 -0.00000009 0.00000031 Cu 6.39670965 1.81403684 14.06227663 -0.00000004 -0.00000012 -0.00000089 Cu 5.11854643 0.00653796 15.34037403 0.00000134 0.00000082 -0.00000080 Cu 7.67473781 0.00653796 15.34037554 0.00000151 0.00000082 -0.00000034 Cu 6.39657578 1.81403947 16.61846887 0.00000279 -0.00000033 -0.00000041 Cu 8.95276742 1.81403947 16.61846880 0.00000171 -0.00000034 -0.00000068 Cu 7.67460755 0.00654077 17.89656541 0.00000284 0.00000053 -0.00000091 Cu 10.23079916 0.00654074 17.89656410 0.00000295 0.00000055 0.00000030 Cu 8.95264226 1.81404235 19.17465846 0.00000391 -0.00000059 -0.00000001 Cu 11.50883388 1.81404231 19.17465695 0.00000292 -0.00000057 0.00000007 Cu 10.23068061 0.00654362 20.45275605 0.00000374 0.00000024 -0.00000021 Cu 12.78687196 0.00654357 20.45275505 0.00000394 0.00000028 0.00000073 Cu 11.50872288 1.81404509 21.73084355 0.00000459 -0.00000077 0.00000053 Cu 14.06491405 1.81404507 21.73084369 0.00000384 -0.00000074 0.00000005 Cu 12.78676955 0.00654621 23.00895599 0.00000435 0.00000002 -0.00000002 Cu 0.00581368 0.00654620 23.00895710 0.00000473 0.00000004 0.00000019 Cu 14.06482081 1.81404747 24.28701262 0.00000509 -0.00000083 0.00000016 Cu 1.28386487 1.81404749 24.28701425 0.00000456 -0.00000085 -0.00000068 Cu 15.34287706 0.00654837 25.56520268 0.00000481 -0.00000014 -0.00000072 Cu 2.56192102 0.00654839 25.56520386 0.00000523 -0.00000016 -0.00000047 Cu 1.28379164 1.81404935 26.84307912 0.00000529 -0.00000082 -0.00000069 Cu 3.83998250 1.81404939 26.84307922 0.00000489 -0.00000086 -0.00000083 Cu 2.56185817 0.00654999 28.12168595 0.00000491 -0.00000023 -0.00000121 Cu 5.11804911 0.00654999 28.12168453 0.00000524 -0.00000024 -0.00000009 Cu 3.83993000 1.81405067 29.39861232 0.00000511 -0.00000073 -0.00000067 Cu 6.39612114 1.81405070 29.39860970 0.00000477 -0.00000075 0.00000015 Cu 5.11800664 0.00655102 30.67985747 0.00000466 -0.00000027 -0.00000045 Cu 7.67419785 0.00655100 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