612 Lattice="15.439340304477982 0.0 0.0 7.719670152238991 13.370860921350902 0.0 0.0 0.0 71.43495523218681" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1986.007398004357 stress="0.0028236051524165185 -5.206278290633813e-07 -7.938436005442878e-07 -5.206278290633813e-07 0.0028273522182654578 -2.8571826280315736e-06 -7.938436005442878e-07 -2.8571826280315736e-06 -1.027563591433619e-08" free_energy=-1986.007398004357 pbc="T T F" Cu 0.00399920 0.00412239 17.91958665 -0.00000253 -0.00000916 0.00000018 Cu 3.86383429 2.23259921 17.91958667 -0.00000270 -0.00000927 -0.00000018 Cu 2.57722259 0.00412238 17.91958666 -0.00000264 -0.00000903 -0.00000006 Cu 1.29061089 2.23259922 17.91958666 -0.00000247 -0.00000934 -0.00000007 Cu 10.29688982 11.88932174 19.96408112 -0.00000235 -0.00000887 0.00000047 Cu 6.43705478 0.74693766 19.96408117 -0.00000290 -0.00000924 -0.00000039 Cu 12.87011323 11.88932171 19.96408116 -0.00000271 -0.00000843 -0.00000009 Cu 3.86383135 0.74693767 19.96408116 -0.00000215 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8.17503341 28.36788933 -0.00000250 -0.00000602 -0.00000111 Cu 7.72362164 5.94655644 28.36788927 -0.00000194 -0.00000374 -0.00000020 Cu 6.43700984 8.17503345 28.36788927 -0.00000036 -0.00000661 -0.00000028 Cu 7.72360423 4.46084283 30.46891727 -0.00000040 -0.00000333 0.00000168 Cu 11.58343942 6.68931972 30.46891746 -0.00000214 -0.00000447 -0.00000121 Cu 10.29682769 4.46084274 30.46891740 -0.00000154 -0.00000198 -0.00000021 Cu 9.01021588 6.68931977 30.46891740 0.00000021 -0.00000512 -0.00000030 Cu 10.29680898 2.97512413 32.56994536 0.00000013 -0.00000151 0.00000178 Cu 14.15664418 5.20360103 32.56994556 -0.00000172 -0.00000270 -0.00000128 Cu 12.87003245 2.97512404 32.56994549 -0.00000108 -0.00000007 -0.00000022 Cu 11.58342063 5.20360108 32.56994549 0.00000077 -0.00000339 -0.00000031 Cu 12.87001310 1.48940287 34.67097344 0.00000065 0.00000042 0.00000183 Cu 16.72984830 3.71787977 34.67097365 -0.00000125 -0.00000080 -0.00000130 Cu 15.44323656 1.48940277 34.67097358 -0.00000059 0.00000189 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0.00000701 0.00000144 Cu 19.30300130 11.14588051 43.07508498 0.00000078 0.00000608 -0.00000098 Cu 18.01638957 8.91740355 43.07508493 0.00000129 0.00000815 -0.00000015 Cu 16.72977778 11.14588055 43.07508493 0.00000276 0.00000553 -0.00000021 Cu 18.01637653 7.43170608 45.17611015 0.00000250 0.00000802 0.00000120 Cu 6.43687138 9.66018295 45.17611029 0.00000128 0.00000724 -0.00000080 Cu 5.15025966 7.43170601 45.17611024 0.00000170 0.00000898 -0.00000012 Cu 19.30298819 9.66018298 45.17611024 0.00000293 0.00000678 -0.00000017 Cu 5.15024946 5.94601898 47.27738992 0.00000267 0.00000873 0.00000094 Cu 9.01008460 8.17449583 47.27739002 0.00000175 0.00000815 -0.00000061 Cu 7.72347288 5.94601893 47.27738999 0.00000207 0.00000945 -0.00000008 Cu 6.43686113 8.17449586 47.27738999 0.00000300 0.00000780 -0.00000012 Cu 7.72346635 4.46034496 49.37786593 0.00000275 0.00000914 0.00000058 Cu 11.58330147 6.68882180 49.37786599 0.00000214 0.00000875 -0.00000035 Cu 10.29668976 4.46034492 49.37786597 0.00000235 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10.29684502 10.40351008 28.36788927 -0.00000194 -0.00000374 -0.00000020 Cu 9.01023322 12.63198709 28.36788927 -0.00000036 -0.00000661 -0.00000028 Cu 10.29682761 8.91779647 30.46891727 -0.00000040 -0.00000333 0.00000168 Cu 14.15666281 11.14627336 30.46891746 -0.00000214 -0.00000447 -0.00000121 Cu 12.87005107 8.91779638 30.46891740 -0.00000154 -0.00000198 -0.00000021 Cu 11.58343927 11.14627341 30.46891740 0.00000021 -0.00000512 -0.00000030 Cu 12.87003236 7.43207777 32.56994536 0.00000013 -0.00000150 0.00000178 Cu 16.72986756 9.66055467 32.56994556 -0.00000172 -0.00000270 -0.00000128 Cu 15.44325583 7.43207768 32.56994549 -0.00000108 -0.00000006 -0.00000022 Cu 14.15664401 9.66055472 32.56994549 0.00000078 -0.00000339 -0.00000031 Cu 15.44323648 5.94635651 34.67097344 0.00000065 0.00000041 0.00000183 Cu 19.30307168 8.17483341 34.67097365 -0.00000125 -0.00000080 -0.00000130 Cu 18.01645995 5.94635641 34.67097358 -0.00000059 0.00000189 -0.00000022 Cu 16.72984813 8.17483346 34.67097358 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15.44316619 4.46044991 43.07508493 0.00000129 0.00000815 -0.00000015 Cu 14.15655440 6.68892691 43.07508493 0.00000276 0.00000552 -0.00000021 Cu 15.44315315 2.97475244 45.17611015 0.00000250 0.00000802 0.00000120 Cu 3.86364800 5.20322931 45.17611029 0.00000127 0.00000724 -0.00000080 Cu 2.57703628 2.97475237 45.17611024 0.00000170 0.00000898 -0.00000012 Cu 16.72976481 5.20322934 45.17611025 0.00000293 0.00000678 -0.00000017 Cu 2.57702608 1.48906534 47.27738992 0.00000267 0.00000873 0.00000094 Cu 6.43686121 3.71754220 47.27739002 0.00000175 0.00000815 -0.00000061 Cu 5.15024950 1.48906529 47.27738999 0.00000207 0.00000945 -0.00000008 Cu 3.86363775 3.71754222 47.27738999 0.00000300 0.00000780 -0.00000012 Cu 5.15024296 0.00339132 49.37786594 0.00000275 0.00000913 0.00000057 Cu 9.01007808 2.23186816 49.37786599 0.00000214 0.00000875 -0.00000035 Cu 7.72346637 0.00339129 49.37786597 0.00000236 0.00000961 -0.00000003 Cu 6.43685464 2.23186818 49.37786597 0.00000297 0.00000851 -0.00000006 Cu 15.44313354 11.88859068 51.42236044 0.00000270 0.00000925 0.00000026 Cu 11.58329848 0.74620658 51.42236047 0.00000252 0.00000913 -0.00000013 Cu 18.01635693 11.88859067 51.42236046 0.00000258 0.00000939 0.00000001 Cu 9.01007508 0.74620659 51.42236046 0.00000276 0.00000906 -0.00000001 Cu 5.15044597 0.00412238 17.91958665 -0.00000253 -0.00000916 0.00000017 Cu 9.01028106 2.23259922 17.91958667 -0.00000270 -0.00000928 -0.00000019 Cu 7.72366936 0.00412238 17.91958666 -0.00000264 -0.00000903 -0.00000005 Cu 6.43705766 2.23259922 17.91958666 -0.00000248 -0.00000934 -0.00000007 Cu 15.44333659 11.88932174 19.96408112 -0.00000235 -0.00000887 0.00000047 Cu 11.58350155 0.74693767 19.96408118 -0.00000290 -0.00000925 -0.00000039 Cu 18.01656000 11.88932171 19.96408115 -0.00000271 -0.00000843 -0.00000008 Cu 9.01027812 0.74693768 19.96408116 -0.00000215 -0.00000945 -0.00000012 Cu 18.01655356 10.40364772 22.06455708 -0.00000211 -0.00000833 0.00000082 Cu 21.87638869 12.63212458 22.06455718 -0.00000296 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