864 Lattice="15.356421479820735 0.0 0.0 15.356421479820737 18.807698450338084 0.0 0.0 0.0 35.46413630065542" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2934.51366342 stress="0.008636581762001688 -5.4733970246423605e-08 -1.2950898076495797e-07 -5.4733970246423605e-08 0.0060633129500184115 5.68075344077406e-06 -1.2950898076495797e-07 5.68075344077406e-06 7.778020968437245e-07" pbc="T T F" Cu 0.00126198 0.02553776 0.11898984 -0.00000010 0.00000910 0.00000129 Cu 3.84036733 2.11099727 0.78607390 -0.00000026 0.00000925 0.00000135 Cu 2.56066557 0.02553776 0.11898985 -0.00000033 0.00000914 0.00000113 Cu 6.39977091 2.11099729 0.78607390 -0.00000016 0.00000910 0.00000133 Cu 17.91708699 16.74655455 1.39990161 -0.00000035 0.00000885 0.00000087 Cu 6.39977078 0.02783292 2.32904194 -0.00000070 0.00000893 0.00000110 Cu 20.47649056 16.74655454 1.39990158 -0.00000006 0.00000926 0.00000129 Cu 8.95917431 0.02783292 2.32904190 0.00000029 0.00000890 0.00000169 Cu 20.47649032 14.65654283 2.99879854 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17.91708125 12.53942062 17.73702864 -0.00000175 -0.00000032 -0.00000046 Cu 21.75618614 14.62804032 18.47226714 0.00000052 -0.00000110 -0.00000008 Cu 17.91708051 10.44761737 19.20667171 -0.00000176 -0.00000224 -0.00000074 Cu 21.75618543 12.53650979 19.94890639 0.00000006 -0.00000205 -0.00000065 Cu 20.47648392 10.44761739 19.20667169 0.00000183 -0.00000235 -0.00000042 Cu 24.31558901 12.53650974 19.94890628 0.00000004 -0.00000100 0.00000160 Cu 20.47648317 8.35566415 20.68404654 0.00000238 -0.00000221 -0.00000093 Cu 8.95916678 10.44470675 21.41655101 0.00000099 -0.00000207 0.00000106 Cu 7.67946550 8.35566420 20.68404656 -0.00000226 -0.00000302 -0.00000144 Cu 11.51857045 10.44470684 21.41655112 -0.00000084 -0.00000403 -0.00000110 Cu 7.67946476 6.26440397 22.16199382 -0.00000139 -0.00000484 -0.00000130 Cu 11.51856976 8.35242113 22.89580636 -0.00000059 -0.00000418 -0.00000106 Cu 10.23886820 6.26440396 22.16199378 0.00000156 -0.00000457 -0.00000044 Cu 14.07797327 8.35242107 22.89580625 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