612 Lattice="15.356421416581195 0.0 0.0 7.678210708290598 13.299051057978732 0.0 0.0 0.0 71.05130496423516" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2084.3396836098564 stress="0.004098798627836849 -4.214400643689676e-07 -6.953088907715077e-07 -4.214400643689676e-07 0.004101919919437912 -2.5740275071151467e-06 -6.953088907715077e-07 -2.5740275071151467e-06 3.0279729455491063e-10" free_energy=-2084.3396836098564 pbc="T T F" Cu 0.00398581 0.00408328 17.78421240 -0.00000233 -0.00000888 0.00000013 Cu 3.84309117 2.22059174 17.78421241 -0.00000229 -0.00000799 -0.00000005 Cu 2.56338939 0.00408328 17.78421240 -0.00000235 -0.00000891 -0.00000000 Cu 1.28368759 2.22059175 17.78421240 -0.00000223 -0.00000804 0.00000001 Cu 10.24159680 11.82544978 19.88423902 -0.00000214 -0.00000776 -0.00000033 Cu 6.40249147 0.74290728 19.88423900 -0.00000263 -0.00000890 0.00000016 Cu 12.80100037 11.82544975 19.88423903 -0.00000213 -0.00000735 -0.00000034 Cu 3.84308786 0.74290728 19.88423899 -0.00000192 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8.13112430 28.22799774 -0.00000075 -0.00000439 -0.00000024 Cu 7.68215414 5.91461583 28.22799771 -0.00000062 -0.00000517 0.00000032 Cu 6.40245241 8.13112426 28.22799773 -0.00000165 -0.00000362 -0.00000005 Cu 7.68213935 4.43688857 30.31359530 -0.00000040 -0.00000223 -0.00000030 Cu 11.52124470 6.65339713 30.31359526 -0.00000048 -0.00000315 0.00000047 Cu 10.24154297 4.43688859 30.31359528 -0.00000146 -0.00000262 0.00000008 Cu 8.96184117 6.65339718 30.31359529 -0.00000111 -0.00000409 -0.00000018 Cu 10.24152706 2.95915738 32.39919282 -0.00000094 -0.00000195 -0.00000015 Cu 14.08063238 5.17566587 32.39919283 -0.00000028 -0.00000162 -0.00000037 Cu 12.80093057 2.95915738 32.39919281 0.00000009 -0.00000194 0.00000001 Cu 11.52122882 5.17566584 32.39919281 -0.00000054 -0.00000094 0.00000001 Cu 12.80091413 1.48142404 34.48479034 0.00000004 -0.00000023 0.00000006 Cu 16.64001950 3.69793252 34.48479033 -0.00000027 0.00000020 0.00000020 Cu 15.36031770 1.48142402 34.48479034 -0.00000002 0.00000002 0.00000013 Cu 14.08061591 3.69793253 34.48479034 0.00000014 0.00000016 0.00000000 Cu 0.00387982 0.00369066 36.57038787 0.00000041 0.00000213 -0.00000001 Cu 3.84298517 2.22019923 36.57038786 0.00000049 0.00000094 0.00000010 Cu 2.56328338 0.00369066 36.57038789 0.00000057 0.00000210 -0.00000036 Cu 1.28358161 2.22019923 36.57038787 0.00000028 0.00000099 -0.00000005 Cu 10.24147820 11.82501052 38.65598538 0.00000076 0.00000243 0.00000048 Cu 6.40237283 0.74246789 38.65598541 0.00000088 0.00000404 -0.00000026 Cu 12.80088177 11.82501053 38.65598538 0.00000060 0.00000232 0.00000032 Cu 3.84296926 0.74246791 38.65598542 0.00000102 0.00000374 -0.00000035 Cu 12.80086697 10.34728327 40.74158297 0.00000095 0.00000538 -0.00000027 Cu 16.63997233 12.56379188 40.74158295 0.00000082 0.00000338 0.00000015 Cu 15.36027052 10.34728325 40.74158297 0.00000140 0.00000566 -0.00000027 Cu 14.08056872 12.56379187 40.74158293 0.00000156 0.00000352 0.00000043 Cu 15.36025729 8.86956211 42.82718087 0.00000232 0.00000515 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10.34763284 28.22799772 -0.00000070 -0.00000496 0.00000012 Cu 8.96185598 12.56414130 28.22799774 -0.00000153 -0.00000392 -0.00000020 Cu 10.24154290 8.86990560 30.31359530 -0.00000012 -0.00000241 -0.00000034 Cu 14.08064828 11.08641415 30.31359526 -0.00000056 -0.00000304 0.00000045 Cu 12.80094655 8.86990563 30.31359527 -0.00000168 -0.00000283 0.00000023 Cu 11.52124473 11.08641419 30.31359529 -0.00000095 -0.00000387 -0.00000016 Cu 12.80093063 7.39217438 32.39919283 -0.00000108 -0.00000167 -0.00000023 Cu 16.64003595 9.60868288 32.39919283 -0.00000026 -0.00000150 -0.00000029 Cu 15.36033414 7.39217440 32.39919281 0.00000019 -0.00000195 0.00000010 Cu 14.08063239 9.60868286 32.39919280 -0.00000058 -0.00000093 0.00000022 Cu 15.36031770 5.91444106 34.48479034 0.00000014 -0.00000032 -0.00000002 Cu 19.19942306 8.13094954 34.48479033 -0.00000008 0.00000022 0.00000022 Cu 17.91972127 5.91444105 34.48479033 -0.00000003 -0.00000007 0.00000019 Cu 16.64001948 8.13094955 34.48479034 0.00000005 0.00000013 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Cu 3.84304883 3.69810726 28.22799774 -0.00000138 -0.00000391 -0.00000012 Cu 5.12273577 0.00387157 30.31359529 -0.00000035 -0.00000259 -0.00000005 Cu 8.96184113 2.22038013 30.31359526 -0.00000048 -0.00000341 0.00000060 Cu 7.68213939 0.00387158 30.31359529 -0.00000135 -0.00000277 -0.00000001 Cu 6.40243759 2.22038015 30.31359528 -0.00000102 -0.00000381 0.00000006 Cu 15.36033420 11.82519142 32.39919282 -0.00000107 -0.00000191 -0.00000017 Cu 11.52122882 0.74264884 32.39919283 -0.00000042 -0.00000143 -0.00000027 Cu 17.91973770 11.82519143 32.39919281 0.00000026 -0.00000213 0.00000014 Cu 8.96182524 0.74264881 32.39919281 -0.00000042 -0.00000075 0.00000000 Cu 17.91972126 10.34745808 34.48479035 0.00000024 -0.00000029 -0.00000017 Cu 21.75882664 12.56396657 34.48479033 -0.00000018 0.00000011 0.00000026 Cu 20.47912484 10.34745807 34.48479034 -0.00000009 -0.00000010 0.00000006 Cu 19.19942305 12.56396656 34.48479035 0.00000009 0.00000014 -0.00000014 Cu 5.12268695 8.86972469 36.57038788 0.00000046 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