612 Lattice="15.337146440498554 0.0 0.0 7.668573220249277 13.282358439033827 0.0 0.0 0.0 70.96212323584447" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2129.8068904520424 stress="0.0010778929687919395 -2.391114610525034e-07 -4.1669437238710087e-07 -2.391114610525034e-07 0.0010796429714434136 -1.530217767255895e-06 -4.1669437238710087e-07 -1.530217767255895e-06 2.2175261241727647e-09" pbc="T T F" Cu 0.00394850 0.00394982 17.77868093 0.00000100 -0.00000199 0.00000013 Cu 3.83823544 2.21767663 17.77868086 -0.00000389 -0.00000698 0.00000138 Cu 2.56013983 0.00394995 17.77868102 -0.00000281 -0.00000242 0.00000016 Cu 1.28204423 2.21767657 17.77868081 -0.00000186 -0.00000638 0.00000193 Cu 10.22871160 11.81048623 19.82843982 0.00000095 -0.00000510 -0.00000116 Cu 6.39442511 0.74185407 19.82843959 -0.00000356 -0.00000388 0.00000125 Cu 12.78490299 11.81048618 19.82843968 -0.00000469 -0.00000500 0.00000043 Cu 3.83823398 0.74185394 19.82843983 -0.00000136 -0.00000112 -0.00000106 Cu 12.78489895 10.33465439 21.91895501 -0.00000034 -0.00000327 0.00000043 Cu 16.61918588 12.54838058 21.91895517 -0.00000527 -0.00000204 -0.00000142 Cu 15.34109023 10.33465429 21.91895510 -0.00000432 -0.00000309 -0.00000036 Cu 14.06299455 12.54838083 21.91895497 -0.00000101 -0.00000515 0.00000060 Cu 15.34108446 8.85881606 24.00589458 -0.00000213 -0.00000775 -0.00000014 Cu 19.17537075 11.07254191 24.00589459 0.00000106 -0.00000158 0.00000038 Cu 17.89727553 8.85881569 24.00589460 -0.00000410 -0.00000327 -0.00000031 Cu 16.61917958 11.07254241 24.00589456 0.00000216 -0.00000631 0.00000017 Cu 17.89726931 7.38297339 26.09302606 -0.00000421 -0.00000268 0.00000048 Cu 6.39440937 9.59669983 26.09302601 -0.00000113 -0.00000243 -0.00000006 Cu 5.11631376 7.38297331 26.09302592 -0.00000045 -0.00000151 0.00000217 Cu 19.17536467 9.59669964 26.09302595 0.00000068 -0.00000160 0.00000131 Cu 5.11630625 5.90712670 28.18014685 -0.00000244 -0.00000165 0.00000065 Cu 8.95059263 8.12085313 28.18014710 0.00000053 -0.00000289 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42.78999584 0.00000043 0.00000121 -0.00000026 Cu 17.89719830 8.85852362 42.78999584 0.00000330 0.00000330 -0.00000064 Cu 16.61910297 11.07224987 42.78999594 -0.00000100 0.00000559 -0.00000039 Cu 17.89719223 7.38268133 44.87712739 0.00000084 0.00000145 0.00000036 Cu 6.39433221 9.59640745 44.87712740 0.00000156 0.00000781 0.00000030 Cu 5.11623693 7.38268137 44.87712743 -0.00000085 0.00000136 -0.00000049 Cu 19.17528733 9.59640758 44.87712730 0.00000483 0.00000386 0.00000002 Cu 5.11623105 5.90684286 46.96406694 0.00000297 0.00000175 -0.00000061 Cu 8.95051805 8.12056893 46.96406674 -0.00000275 0.00000639 0.00000115 Cu 7.67242261 5.90684248 46.96406677 -0.00000333 0.00000686 0.00000150 Cu 6.39432657 8.12056910 46.96406692 0.00000368 0.00000209 0.00000055 Cu 7.67241829 4.43101070 49.05458229 0.00000321 0.00000754 -0.00000004 Cu 11.50670532 6.64473721 49.05458225 -0.00000202 0.00000580 0.00000011 Cu 10.22860973 4.43101069 49.05458210 -0.00000169 0.00000827 0.00000183 Cu 8.95051413 6.64473726 49.05458210 -0.00000125 0.00000468 0.00000205 Cu 10.22860810 2.95518839 51.10434076 0.00000131 0.00000594 0.00000145 Cu 14.06289447 5.16891504 51.10434097 0.00000442 0.00000274 -0.00000041 Cu 12.78479914 2.95518818 51.10434099 0.00000268 0.00000758 -0.00000038 Cu 11.50670390 5.16891481 51.10434098 -0.00000175 0.00000560 0.00000018 Cu 2.56014005 4.43140298 17.77868095 -0.00000500 -0.00000633 0.00000042 Cu 6.39442620 6.64512929 17.77868101 0.00000025 -0.00000419 -0.00000010 Cu 5.11633066 4.43140288 17.77868107 0.00000127 -0.00000393 -0.00000132 Cu 19.17538154 6.64512924 17.77868108 0.00000074 -0.00000334 -0.00000100 Cu 5.11632965 2.95558076 19.82843970 -0.00000401 -0.00000851 -0.00000012 Cu 8.95061612 5.16930684 19.82843984 -0.00000125 -0.00000312 -0.00000157 Cu 7.67252062 2.95558044 19.82843986 -0.00000128 -0.00000453 -0.00000167 Cu 6.39442488 5.16930670 19.82843971 0.00000214 -0.00000236 -0.00000027 Cu 7.67251693 1.47974897 21.91895502 -0.00000165 -0.00000804 0.00000092 Cu 11.50680327 3.69347532 21.91895507 0.00000047 -0.00000626 -0.00000024 Cu 10.22870788 1.47974871 21.91895506 -0.00000050 -0.00000298 -0.00000019 Cu 8.95061224 3.69347535 21.91895500 0.00000134 -0.00000594 0.00000069 Cu 10.22870214 0.00391017 24.00589451 0.00000106 -0.00000487 0.00000098 Cu 14.06298893 2.21763641 24.00589467 -0.00000309 -0.00000266 -0.00000111 Cu 12.78489320 0.00391032 24.00589457 -0.00000114 -0.00000735 -0.00000010 Cu 11.50679781 2.21763661 24.00589462 -0.00000084 -0.00000524 -0.00000084 Cu 20.45346032 11.81042611 26.09302614 -0.00000237 -0.00000233 -0.00000060 Cu 1.28202720 0.74179408 26.09302609 -0.00000062 -0.00000147 0.00000055 Cu 7.67250507 11.81042651 26.09302615 -0.00000328 -0.00000606 -0.00000105 Cu 14.06298249 0.74179431 26.09302604 -0.00000053 -0.00000575 0.00000050 Cu 7.67249718 10.33457939 28.18014682 -0.00000047 -0.00000166 0.00000025 Cu 11.50678413 12.54830564 28.18014686 -0.00000471 0.00000052 0.00000042 Cu 10.22868834 10.33457900 28.18014687 -0.00000109 0.00000187 0.00000114 Cu 8.95059266 12.54830567 28.18014681 0.00000214 -0.00000024 0.00000110 Cu 10.22867969 8.85872879 30.26726837 -0.00000085 0.00000183 -0.00000011 Cu 14.06296642 11.07245551 30.26726830 -0.00000283 -0.00000141 0.00000001 Cu 12.78487062 8.85872899 30.26726828 0.00000169 0.00000021 -0.00000043 Cu 11.50677517 11.07245547 30.26726827 0.00000110 -0.00000070 0.00000029 Cu 12.78486113 7.38287623 32.35438953 0.00000309 -0.00000203 0.00000104 Cu 16.61914812 9.59660237 32.35438945 -0.00000147 0.00000296 0.00000149 Cu 15.34105272 7.38287645 32.35438963 -0.00000382 -0.00000407 0.00000118 Cu 14.06295701 9.59660258 32.35438968 -0.00000220 -0.00000057 -0.00000048 Cu 15.34104274 5.90702171 34.44151116 0.00000040 0.00000401 -0.00000135 Cu 19.17532944 8.12074870 34.44151086 -0.00000150 -0.00000194 0.00000105 Cu 17.89723382 5.90702226 34.44151089 -0.00000005 -0.00000176 0.00000061 Cu 16.61913844 8.12074860 34.44151105 -0.00000297 -0.00000092 -0.00000068 Cu 2.56007755 4.43116797 36.52863242 0.00000146 0.00000170 -0.00000123 Cu 6.39436428 6.64489412 36.52863230 -0.00000036 0.00000428 0.00000052 Cu 5.11626875 4.43116752 36.52863236 -0.00000072 0.00000548 -0.00000068 Cu 3.83817302 6.64489439 36.52863236 0.00000303 0.00000141 -0.00000115 Cu 5.11625925 2.95531515 38.61575359 0.00000029 -0.00000120 0.00000068 Cu 8.95054578 5.16904131 38.61575361 0.00000165 0.00000539 0.00000013 Cu 7.67245030 2.95531531 38.61575351 0.00000027 -0.00000197 0.00000153 Cu 6.39435460 5.16904125 38.61575372 0.00000200 0.00000495 -0.00000026 Cu 7.67244163 1.47946460 40.70287501 0.00000366 0.00000449 0.00000014 Cu 11.50672857 3.69319117 40.70287505 -0.00000275 0.00000118 0.00000027 Cu 10.22863299 1.47946475 40.70287492 -0.00000207 0.00000262 0.00000125 Cu 8.95053732 3.69319134 40.70287497 0.00000013 -0.00000080 -0.00000006 Cu 10.22862545 0.00361789 42.78999596 -0.00000312 0.00000580 -0.00000067 Cu 14.06291179 2.21734453 42.78999583 0.00000144 0.00000060 -0.00000008 Cu 12.78481638 0.00361775 42.78999585 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11.50670383 0.74146205 51.10434085 0.00000027 0.00000359 0.00000129 Cu 17.89718146 11.81009413 51.10434103 0.00000111 0.00000337 -0.00000068 Cu 8.95051288 0.74146205 51.10434089 -0.00000144 0.00000500 0.00000041 Cu 5.11633081 0.00395014 17.77868104 -0.00000246 -0.00000606 -0.00000039 Cu 8.95061747 2.21767645 17.77868110 -0.00000152 -0.00000344 -0.00000059 Cu 7.67252176 0.00395013 17.77868105 0.00000071 -0.00000455 -0.00000099 Cu 6.39442627 2.21767653 17.77868093 0.00000007 -0.00000443 0.00000027 Cu 15.34109362 11.81048605 19.82843948 0.00000222 -0.00000338 0.00000239 Cu 11.50680725 0.74185435 19.82843979 -0.00000208 -0.00000876 -0.00000108 Cu 17.89728475 11.81048615 19.82843995 0.00000152 -0.00000624 -0.00000255 Cu 8.95061597 0.74185424 19.82843961 0.00000112 -0.00000742 0.00000111 Cu 17.89728114 10.33465444 21.91895512 -0.00000256 -0.00000609 -0.00000034 Cu 21.73156751 12.54838067 21.91895502 0.00000187 -0.00000235 0.00000019 Cu 20.45347206 10.33465446 21.91895508 0.00000032 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