504 Lattice="15.439096242622336 0.0 0.0 0.0 10.91708964855 0.0 0.0 0.0 36.02455789945212" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1698.1883949761373 stress="30.168531825104548 1.2511516933599864e-08 -0.02334463776073914 1.2511516933599864e-08 24.75188583585154 0.0009016202296829867 -0.02334463776073914 0.0009016202296829867 0.0015768336488333201" pbc="T T F" Cu 0.00661314 0.00653262 0.09796316 -0.00000770 0.00000069 0.00000112 Cu 2.57979614 0.00653274 0.09796324 -0.00000772 0.00000064 0.00000063 Cu 1.29319819 1.82604777 1.30061063 -0.00000784 0.00000111 0.00000113 Cu 3.86638098 1.82604762 1.30061147 -0.00000735 0.00000142 0.00000046 Cu 2.57977475 0.00653336 2.57811446 -0.00000742 0.00000031 0.00000141 Cu 5.15295747 0.00653328 2.57811559 -0.00000683 -0.00000012 0.00000021 Cu 3.86634679 1.82604872 3.86262903 -0.00000706 0.00000140 0.00000026 Cu 6.43952949 1.82604862 3.86263000 -0.00000613 0.00000236 0.00000004 Cu 5.15291212 0.00653477 5.14947403 -0.00000645 -0.00000112 0.00000043 Cu 7.72609484 0.00653476 5.14947482 -0.00000591 -0.00000191 -0.00000122 Cu 6.43947085 1.82605031 6.43620217 -0.00000693 0.00000317 0.00000031 Cu 9.01265338 1.82605041 6.43620255 -0.00000399 0.00000264 -0.00000026 Cu 7.72602372 0.00653681 7.72276208 -0.00000489 -0.00000265 0.00000198 Cu 10.29920649 0.00653676 7.72276239 -0.00000509 -0.00000137 -0.00000205 Cu 9.01257206 1.82605256 9.00936590 -0.00000565 0.00000198 0.00000061 Cu 11.58575467 1.82605259 9.00936565 -0.00000299 0.00000216 0.00000039 Cu 10.29911626 0.00653896 10.29595431 -0.00000365 -0.00000162 0.00000247 Cu 12.87229902 0.00653906 10.29595406 -0.00000371 -0.00000291 -0.00000151 Cu 11.58565768 1.82605467 11.58254595 -0.00000519 0.00000208 -0.00000048 Cu 14.15884001 1.82605463 11.58254530 0.00000013 0.00000242 0.00000095 Cu 12.87219640 0.00654109 12.86913742 -0.00000092 -0.00000343 0.00000198 Cu 0.00628294 0.00654102 12.86913727 -0.00000230 -0.00000353 -0.00000190 Cu 14.15873431 1.82605648 14.15572889 -0.00000269 0.00000280 0.00000006 Cu 1.29282035 1.82605645 14.15572863 0.00000168 0.00000342 0.00000127 Cu 15.44527123 0.00654278 15.44232046 0.00000038 -0.00000344 0.00000211 Cu 2.57935762 0.00654281 15.44232082 -0.00000026 -0.00000434 -0.00000234 Cu 1.29271233 1.82605803 16.72891239 -0.00000158 0.00000310 -0.00000085 Cu 3.86589464 1.82605792 16.72891247 0.00000294 0.00000397 -0.00000007 Cu 2.57924997 0.00654417 18.01550406 0.00000171 -0.00000424 0.00000214 Cu 5.15243267 0.00654414 18.01550426 0.00000100 -0.00000485 -0.00000127 Cu 3.86578934 1.82605907 19.30209594 0.00000060 0.00000268 0.00000003 Cu 6.43897183 1.82605897 19.30209567 0.00000364 0.00000307 0.00000121 Cu 5.15233040 0.00654481 20.58868756 0.00000383 -0.00000323 0.00000066 Cu 7.72551328 0.00654477 20.58868743 0.00000231 -0.00000360 -0.00000208 Cu 6.43887475 1.82605950 21.87527898 0.00000205 0.00000292 -0.00000108 Cu 9.01205724 1.82605951 21.87527869 0.00000555 0.00000323 0.00000011 Cu 7.72542208 0.00654507 23.16187042 0.00000461 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0.00000440 0.00000125 -0.00000056 Cu 3.86545708 1.82605796 32.16630171 0.00000589 0.00000217 -0.00000033 Cu 2.57885653 0.00654297 33.44380562 0.00000475 -0.00000040 -0.00000052 Cu 5.15203919 0.00654303 33.44380478 0.00000523 -0.00000027 -0.00000061 Cu 3.86544406 1.82605771 34.64645297 0.00000472 0.00000085 -0.00000074 Cu 6.43862680 1.82605776 34.64645195 0.00000481 0.00000055 -0.00000040 Cu 0.00661318 3.64556260 0.09796308 -0.00000780 0.00000051 0.00000107 Cu 2.57979617 3.64556227 0.09796329 -0.00000775 0.00000095 0.00000065 Cu 1.29319831 5.46507758 1.30061064 -0.00000772 0.00000132 0.00000099 Cu 3.86638095 5.46507746 1.30061138 -0.00000739 0.00000155 0.00000064 Cu 2.57977479 3.64556309 2.57811449 -0.00000728 0.00000026 0.00000097 Cu 5.15295747 3.64556306 2.57811559 -0.00000684 0.00000005 0.00000014 Cu 3.86634670 5.46507856 3.86262895 -0.00000669 0.00000173 0.00000024 Cu 6.43952936 5.46507856 3.86262994 -0.00000646 0.00000212 0.00000008 Cu 5.15291206 3.64556459 5.14947397 -0.00000571 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0.00000427 -0.00000365 0.00000187 Cu 10.29860484 3.64557518 23.16187071 0.00000392 -0.00000450 -0.00000201 Cu 9.01197351 5.46508953 24.44846205 0.00000156 0.00000292 -0.00000023 Cu 11.58515592 5.46508958 24.44846242 0.00000687 0.00000221 0.00000007 Cu 10.29852845 3.64557483 25.73505055 0.00000478 -0.00000333 0.00000188 Cu 12.87171126 3.64557482 25.73505156 0.00000376 -0.00000303 -0.00000284 Cu 11.58508776 5.46508915 27.02165477 0.00000248 0.00000210 -0.00000036 Cu 14.15827017 5.46508916 27.02165542 0.00000652 0.00000249 -0.00000012 Cu 12.87165099 3.64557419 28.30821485 0.00000472 -0.00000213 0.00000134 Cu 0.00573742 3.64557426 28.30821569 0.00000427 -0.00000251 -0.00000155 Cu 14.15821901 5.46508869 29.59494316 0.00000366 0.00000123 -0.00000068 Cu 1.29230525 5.46508866 29.59494352 0.00000616 0.00000198 -0.00000024 Cu 15.44479228 3.64557355 30.88178789 0.00000505 -0.00000116 0.00000018 Cu 2.57887859 3.64557357 30.88178812 0.00000555 -0.00000159 -0.00000145 Cu 1.29227451 5.46508809 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