504 Lattice="14.815842407781906 0.0 0.0 0.0 10.476382635533811 0.0 0.0 0.0 69.14059790298222" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1651.7583894098116 stress="0.0022941467593141276 4.903841103209117e-10 -1.7481840265875032e-06 4.903841103209117e-10 0.002119419847490126 1.8154541756441972e-07 -1.7481840265875032e-06 1.8154541756441972e-07 2.293210353840195e-09" pbc="T T F" Cu 0.00688506 0.00652052 17.39477532 -0.00000850 -0.00000059 0.00000254 Cu 2.47619540 0.00652052 17.39477639 -0.00000924 -0.00000057 0.00000294 Cu 1.24152740 1.75258407 18.53057774 -0.00000825 -0.00000046 0.00000335 Cu 3.71083462 1.75258408 18.53058592 -0.00000900 -0.00000052 0.00000145 Cu 2.47614792 0.00651979 19.77007452 -0.00000817 -0.00000017 0.00000211 Cu 4.94545486 0.00651979 19.77008685 -0.00000804 -0.00000011 0.00000032 Cu 3.71075973 1.75258302 20.98824749 -0.00000696 0.00000011 0.00000146 Cu 6.18006688 1.75258303 20.98826089 -0.00000783 0.00000004 -0.00000172 Cu 4.94536095 0.00651874 22.22824484 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30.86955806 0.00000128 0.00000095 0.00000050 Cu 1.24085872 1.75259350 30.86955653 0.00000172 0.00000127 0.00000096 Cu 0.00612368 0.00653392 32.10421452 0.00000228 0.00000072 0.00000069 Cu 2.47542932 0.00653393 32.10421545 0.00000278 0.00000067 0.00000054 Cu 1.24069813 1.75260220 33.33886824 0.00000331 0.00000034 0.00000040 Cu 3.71000400 1.75260221 33.33886997 0.00000339 0.00000021 0.00000001 Cu 2.47527755 0.00654307 34.57352467 0.00000403 -0.00000021 -0.00000005 Cu 4.94458393 0.00654308 34.57352549 0.00000413 -0.00000029 -0.00000012 Cu 3.70986304 1.75261136 35.80817811 0.00000441 -0.00000073 -0.00000030 Cu 6.17917011 1.75261135 35.80817714 0.00000451 -0.00000065 -0.00000007 Cu 4.94445532 0.00655178 37.04283433 0.00000470 -0.00000124 -0.00000025 Cu 7.41376309 0.00655177 37.04283183 0.00000460 -0.00000120 0.00000054 Cu 6.17905488 1.75261918 38.27747835 0.00000493 -0.00000147 0.00000036 Cu 8.64836312 1.75261918 38.27747577 0.00000448 -0.00000140 0.00000083 Cu 7.41366175 0.00655839 39.51214831 0.00000457 -0.00000169 0.00000090 Cu 9.88297006 0.00655839 39.51214749 0.00000452 -0.00000170 0.00000110 Cu 8.64827582 1.75262436 40.74675015 0.00000435 -0.00000154 0.00000166 Cu 11.11758391 1.75262438 40.74675261 0.00000403 -0.00000167 0.00000090 Cu 9.88289627 0.00656207 41.98152747 0.00000390 -0.00000148 0.00000164 Cu 12.35220390 0.00656208 41.98153349 0.00000369 -0.00000148 0.00000020 Cu 11.11752319 1.75262662 43.21586647 0.00000345 -0.00000137 0.00000115 Cu 13.58683025 1.75262661 43.21587495 0.00000344 -0.00000128 -0.00000092 Cu 12.35215434 0.00656304 44.45137536 0.00000286 -0.00000090 0.00000006 Cu 0.00561849 0.00656304 44.45138392 0.00000299 -0.00000091 -0.00000192 Cu 13.58679207 1.75262659 45.68415507 0.00000268 -0.00000047 -0.00000114 Cu 1.24025621 1.75262660 45.68416085 0.00000276 -0.00000053 -0.00000250 Cu 0.00559024 0.00656235 46.92415019 0.00000236 -0.00000025 -0.00000226 Cu 2.47489683 0.00656234 46.92415096 0.00000247 -0.00000014 -0.00000240 Cu 1.24023438 1.75262557 48.14231977 0.00000210 0.00000023 -0.00000267 Cu 3.70954125 1.75262557 48.14231479 0.00000204 0.00000022 -0.00000148 Cu 2.47488119 0.00656129 49.38181282 0.00000174 0.00000050 -0.00000250 Cu 4.94418830 0.00656130 49.38180297 0.00000187 0.00000040 -0.00000005 Cu 3.70953446 1.75262486 50.51761289 0.00000115 0.00000058 -0.00000141 Cu 6.17884170 1.75262486 50.51760173 0.00000115 0.00000056 0.00000123 Cu 0.00688505 3.49864808 17.39477533 -0.00000845 -0.00000061 0.00000248 Cu 2.47619540 3.49864806 17.39477638 -0.00000924 -0.00000051 0.00000300 Cu 1.24152739 5.24471163 18.53057775 -0.00000812 -0.00000057 0.00000335 Cu 3.71083465 5.24471164 18.53058592 -0.00000924 -0.00000062 0.00000145 Cu 2.47614793 3.49864733 19.77007453 -0.00000820 -0.00000010 0.00000209 Cu 4.94545486 3.49864734 19.77008685 -0.00000804 -0.00000019 0.00000036 Cu 3.71075974 5.24471057 20.98824749 -0.00000704 0.00000016 0.00000145 Cu 6.18006687 5.24471058 20.98826090 -0.00000773 0.00000002 -0.00000175 Cu 4.94536096 3.49864629 22.22824486 -0.00000653 0.00000054 -0.00000067 Cu 7.41466831 3.49864628 22.22825513 -0.00000655 0.00000066 -0.00000221 Cu 6.17995820 5.24470985 23.46102510 -0.00000497 0.00000090 -0.00000149 Cu 8.64926632 5.24470985 23.46103006 -0.00000621 0.00000090 -0.00000268 Cu 7.41453922 3.49864625 24.69653298 -0.00000431 0.00000135 -0.00000254 Cu 9.88384727 3.49864627 24.69653187 -0.00000454 0.00000115 -0.00000187 Cu 8.64911722 5.24471078 25.93086996 -0.00000299 0.00000155 -0.00000223 Cu 11.11842528 5.24471077 25.93086416 -0.00000355 0.00000157 -0.00000086 Cu 9.88368907 3.49864847 27.16564505 -0.00000190 0.00000170 -0.00000163 Cu 12.35299673 3.49864846 27.16563706 -0.00000221 0.00000173 0.00000043 Cu 11.11825852 5.24471447 28.40024518 -0.00000070 0.00000148 -0.00000086 Cu 13.58756558 5.24471446 28.40023780 -0.00000082 0.00000160 0.00000095 Cu 12.35282658 3.49865365 29.63491419 0.00000032 0.00000145 0.00000000 Cu 0.00629055 3.49865364 29.63490941 0.00000056 0.00000158 0.00000133 Cu 13.58739526 5.24472106 30.86955804 0.00000145 0.00000113 0.00000067 Cu 1.24085874 5.24472107 30.86955652 0.00000148 0.00000100 0.00000100 Cu 0.00612365 3.49866144 32.10421452 0.00000250 0.00000095 0.00000067 Cu 2.47542934 3.49866148 32.10421546 0.00000255 0.00000060 0.00000042 Cu 1.24069815 5.24472976 33.33886824 0.00000307 0.00000022 0.00000037 Cu 3.71000397 5.24472973 33.33886996 0.00000366 0.00000049 0.00000005 Cu 2.47527757 3.49867063 34.57352467 0.00000379 -0.00000039 0.00000003 Cu 4.94458392 3.49867061 34.57352548 0.00000424 -0.00000022 -0.00000005 Cu 3.70986302 5.24473890 35.80817812 0.00000463 -0.00000070 -0.00000034 Cu 6.17917014 5.24473890 35.80817714 0.00000428 -0.00000071 -0.00000012 Cu 4.94445532 3.49867931 37.04283433 0.00000477 -0.00000116 -0.00000028 Cu 7.41376308 3.49867933 37.04283183 0.00000471 -0.00000132 0.00000048 Cu 6.17905490 5.24474672 38.27747834 0.00000475 -0.00000136 0.00000044 Cu 8.64836311 5.24474673 38.27747577 0.00000459 -0.00000147 0.00000088 Cu 7.41366174 3.49868593 39.51214830 0.00000468 -0.00000166 0.00000098 Cu 9.88297008 3.49868593 39.51214748 0.00000431 -0.00000160 0.00000122 Cu 8.64827581 5.24475193 40.74675016 0.00000443 -0.00000172 0.00000153 Cu 11.11758390 5.24475192 40.74675261 0.00000410 -0.00000165 0.00000089 Cu 9.88289628 3.49868962 41.98152748 0.00000379 -0.00000154 0.00000151 Cu 12.35220388 3.49868962 41.98153350 0.00000380 -0.00000145 0.00000009 Cu 11.11752318 5.24475415 43.21586647 0.00000351 -0.00000123 0.00000115 Cu 13.58683026 5.24475415 43.21587496 0.00000328 -0.00000123 -0.00000095 Cu 12.35215433 3.49869057 44.45137535 0.00000292 -0.00000088 0.00000016 Cu 0.00561848 3.49869058 44.45138392 0.00000306 -0.00000098 -0.00000189 Cu 13.58679208 5.24475413 45.68415506 0.00000257 -0.00000052 -0.00000110 Cu 1.24025620 5.24475414 45.68416084 0.00000285 -0.00000055 -0.00000256 Cu 0.00559025 3.49868989 46.92415020 0.00000229 -0.00000023 -0.00000226 Cu 2.47489684 3.49868988 46.92415096 0.00000245 -0.00000015 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20.98825889 -0.00000791 0.00000031 -0.00000138 Cu 9.88397596 0.00651876 22.22825407 -0.00000678 0.00000037 -0.00000271 Cu 12.35328330 0.00651875 22.22824254 -0.00000666 0.00000049 0.00000056 Cu 11.11857422 1.75258228 23.46102319 -0.00000559 0.00000108 -0.00000111 Cu 13.58788133 1.75258230 23.46101137 -0.00000632 0.00000091 0.00000159 Cu 12.35315481 0.00651870 24.69652198 -0.00000460 0.00000135 0.00000003 Cu 0.00661897 0.00651871 24.69651308 -0.00000452 0.00000123 0.00000256 Cu 13.58773231 1.75258324 25.93085441 -0.00000322 0.00000142 0.00000120 Cu 1.24119601 1.75258322 25.93085043 -0.00000332 0.00000159 0.00000219 Cu 0.00646078 0.00652093 27.16563016 -0.00000194 0.00000161 0.00000160 Cu 2.47576666 0.00652093 27.16563114 -0.00000173 0.00000158 0.00000185 Cu 1.24102912 1.75258691 28.40023498 -0.00000037 0.00000163 0.00000171 Cu 3.71033512 1.75258691 28.40023953 -0.00000043 0.00000162 0.00000066 Cu 2.47559630 0.00652610 29.63491040 0.00000077 0.00000148 0.00000095 Cu 4.94490271 0.00652609 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38.27748065 0.00000434 -0.00000152 -0.00000035 Cu 12.35227777 0.00655839 39.51215145 0.00000414 -0.00000166 0.00000005 Cu 0.00574178 0.00655839 39.51215622 0.00000435 -0.00000160 -0.00000110 Cu 13.58689096 1.75262438 40.74675889 0.00000414 -0.00000160 -0.00000068 Cu 1.24035459 1.75262438 40.74676272 0.00000428 -0.00000161 -0.00000160 Cu 0.00566798 0.00656208 41.98154032 0.00000387 -0.00000151 -0.00000149 Cu 2.47497393 0.00656208 41.98154111 0.00000422 -0.00000156 -0.00000171 Cu 1.24029407 1.75262661 43.21587987 0.00000355 -0.00000125 -0.00000205 Cu 3.70960030 1.75262662 43.21587630 0.00000381 -0.00000135 -0.00000113 Cu 2.47492452 0.00656303 44.45138468 0.00000338 -0.00000081 -0.00000200 Cu 4.94423109 0.00656304 44.45137688 0.00000333 -0.00000088 -0.00000001 Cu 3.70956278 1.75262661 45.68415640 0.00000286 -0.00000068 -0.00000135 Cu 6.17886985 1.75262660 45.68414618 0.00000295 -0.00000059 0.00000114 Cu 4.94420369 0.00656235 46.92414185 0.00000241 -0.00000021 -0.00000022 Cu 7.41351099 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