612 Lattice="15.33714612439719 0.0 0.0 7.668573062198595 13.282358165282016 0.0 0.0 0.0 70.96212177330231" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2135.592474070308 stress="0.0013905149521767353 -4.0601204695887367e-07 -6.235369460491043e-07 -4.0601204695887367e-07 0.001393438311183403 -2.244302921727508e-06 -6.235369460491043e-07 -2.244302921727508e-06 3.5214398608636955e-10" pbc="T T F" Cu 0.00398251 0.00406182 17.77026160 -0.00000204 -0.00000736 -0.00000037 Cu 3.83826904 2.21778818 17.77026158 -0.00000201 -0.00000741 -0.00000005 Cu 2.56017353 0.00406182 17.77026158 -0.00000205 -0.00000742 -0.00000008 Cu 1.28207803 2.21778818 17.77026157 -0.00000212 -0.00000740 0.00000014 Cu 10.22874383 11.81059261 19.83228597 -0.00000162 -0.00000759 -0.00000013 Cu 6.39445728 0.74196071 19.83228595 -0.00000136 -0.00000616 0.00000024 Cu 12.78493490 11.81059264 19.83228595 -0.00000238 -0.00000812 0.00000023 Cu 3.83826634 0.74196074 19.83228594 -0.00000251 -0.00000669 0.00000033 Cu 12.78492909 10.33475415 21.91872959 -0.00000200 -0.00000643 -0.00000092 Cu 16.61921559 12.54848055 21.91872953 -0.00000163 -0.00000702 0.00000008 Cu 15.34112009 10.33475415 21.91872955 -0.00000168 -0.00000640 -0.00000027 Cu 14.06302460 12.54848054 21.91872950 -0.00000199 -0.00000679 0.00000050 Cu 15.34111160 8.85890618 24.00590365 -0.00000106 -0.00000677 0.00000007 Cu 19.17539815 11.07263239 24.00590364 -0.00000137 -0.00000448 0.00000026 Cu 17.89730269 8.85890621 24.00590364 -0.00000208 -0.00000722 0.00000021 Cu 16.61920717 11.07263242 24.00590365 -0.00000200 -0.00000497 0.00000000 Cu 17.89729190 7.38304959 26.09302563 -0.00000175 -0.00000438 -0.00000093 Cu 6.39443226 9.59677601 26.09302556 -0.00000113 -0.00000531 0.00000012 Cu 5.11633675 7.38304961 26.09302560 -0.00000108 -0.00000465 -0.00000039 Cu 19.17538739 9.59677600 26.09302552 -0.00000143 -0.00000514 0.00000077 Cu 5.11632396 5.90718610 28.18014666 -0.00000017 -0.00000481 0.00000027 Cu 8.95061052 8.12091227 28.18014664 -0.00000050 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34.44151023 0.00000076 -0.00000089 0.00000052 Cu 7.67245336 13.28605269 36.52863137 0.00000150 0.00000052 0.00000147 Cu 3.83816688 2.21742072 36.52863145 0.00000079 0.00000311 0.00000023 Cu 2.56007147 0.00369456 36.52863142 -0.00000083 -0.00000009 0.00000064 Cu 1.28197591 2.21742080 36.52863152 -0.00000011 0.00000181 -0.00000082 Cu 10.22862907 11.81017969 38.61575271 -0.00000063 0.00000362 -0.00000074 Cu 6.39434252 0.74154815 38.61575271 -0.00000041 -0.00000037 -0.00000075 Cu 12.78481989 11.81017959 38.61575269 0.00000242 0.00000519 -0.00000041 Cu 3.83815136 0.74154801 38.61575264 0.00000181 0.00000166 0.00000026 Cu 12.78480549 10.33431067 40.70287372 0.00000269 0.00000340 0.00000204 Cu 16.61909208 12.54803689 40.70287384 0.00000176 0.00000560 0.00000020 Cu 15.34099672 10.33431073 40.70287382 -0.00000045 0.00000259 0.00000058 Cu 14.06290115 12.54803701 40.70287394 0.00000043 0.00000378 -0.00000130 Cu 15.34098394 8.85844698 42.78999499 -0.00000051 0.00000597 -0.00000053 Cu 19.17527044 11.07217359 42.78999501 -0.00000012 0.00000215 -0.00000077 Cu 17.89717472 8.85844687 42.78999501 0.00000310 0.00000775 -0.00000080 Cu 16.61907921 11.07217347 42.78999494 0.00000299 0.00000405 0.00000025 Cu 17.89716398 7.38259061 44.87711676 0.00000292 0.00000518 0.00000183 Cu 6.39430445 9.59631684 44.87711687 0.00000204 0.00000705 0.00000004 Cu 5.11620904 7.38259061 44.87711684 0.00000049 0.00000509 0.00000059 Cu 19.17525960 9.59631692 44.87711693 0.00000130 0.00000589 -0.00000088 Cu 5.11620065 5.90674245 46.96429101 0.00000103 0.00000762 -0.00000017 Cu 8.95048718 8.12046900 46.96429105 0.00000103 0.00000484 -0.00000079 Cu 7.67239157 5.90674240 46.96429100 0.00000263 0.00000846 -0.00000015 Cu 6.39429606 8.12046894 46.96429100 0.00000263 0.00000571 0.00000000 Cu 7.67238591 4.43090411 49.05073451 0.00000242 0.00000704 0.00000082 Cu 11.50667248 6.64463043 49.05073457 0.00000185 0.00000768 -0.00000005 Cu 10.22857700 4.43090411 49.05073457 0.00000141 0.00000706 -0.00000004 Cu 8.95048144 6.64463049 49.05073460 0.00000204 0.00000688 -0.00000049 Cu 10.22857430 2.95507669 51.11275895 0.00000184 0.00000749 0.00000009 Cu 14.06286083 5.16880308 51.11275896 0.00000185 0.00000703 -0.00000013 Cu 12.78476530 2.95507668 51.11275895 0.00000220 0.00000772 -0.00000003 Cu 11.50666979 5.16880307 51.11275895 0.00000217 0.00000727 0.00000008 Cu 2.56017353 4.43151454 17.77026160 -0.00000205 -0.00000731 -0.00000032 Cu 6.39446006 6.64524091 17.77026157 -0.00000201 -0.00000742 0.00000005 Cu 5.11636456 4.43151454 17.77026158 -0.00000207 -0.00000737 -0.00000002 Cu 3.83826905 6.64524091 17.77026156 -0.00000211 -0.00000744 0.00000022 Cu 5.11636179 2.95568716 19.83228597 -0.00000159 -0.00000752 -0.00000005 Cu 8.95064830 5.16941342 19.83228594 -0.00000139 -0.00000604 0.00000033 Cu 7.67255286 2.95568721 19.83228594 -0.00000243 -0.00000833 0.00000033 Cu 6.39445736 5.16941346 19.83228595 -0.00000255 -0.00000659 0.00000022 Cu 7.67254705 1.47984870 21.91872962 -0.00000204 -0.00000630 -0.00000126 Cu 11.50683356 3.69357509 21.91872955 -0.00000173 -0.00000680 -0.00000016 Cu 10.22873804 1.47984872 21.91872957 -0.00000162 -0.00000658 -0.00000057 Cu 8.95064255 3.69357508 21.91872950 -0.00000196 -0.00000659 0.00000052 Cu 10.22872957 0.00400074 24.00590364 -0.00000113 -0.00000685 0.00000012 Cu 14.06301611 2.21772695 24.00590361 -0.00000126 -0.00000445 0.00000064 Cu 12.78492064 0.00400076 24.00590362 -0.00000203 -0.00000717 0.00000050 Cu 11.50682514 2.21772698 24.00590362 -0.00000209 -0.00000499 0.00000053 Cu 20.45348292 11.81050232 26.09302564 -0.00000173 -0.00000452 -0.00000110 Cu 1.28205021 0.74187056 26.09302558 -0.00000101 -0.00000521 -0.00000010 Cu 7.67252778 11.81050236 26.09302562 -0.00000113 -0.00000498 -0.00000068 Cu 14.06300536 0.74187055 26.09302554 -0.00000166 -0.00000494 0.00000047 Cu 7.67251499 10.33463883 28.18014667 -0.00000020 -0.00000491 0.00000013 Cu 11.50680154 12.54836499 28.18014665 -0.00000045 -0.00000192 0.00000028 Cu 10.22870612 10.33463888 28.18014665 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