864 Lattice="15.358359307609208 0.0 0.0 15.358359307609208 18.810071794983656 0.0 0.0 0.0 35.468611522236685" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3000.64298392 stress="0.0016074702810253971 -3.946516517806253e-07 -9.672475033463864e-07 -3.946516517806253e-07 0.0008354236290331734 5.5422096456240306e-06 -9.672475033463864e-07 5.5422096456240306e-06 7.545774622591556e-07" pbc="T T F" Cu 0.00130234 0.02469648 0.05530452 -0.00000124 0.00000833 0.00000115 Cu 3.84089214 2.10517951 0.76361930 -0.00000202 0.00000864 0.00000150 Cu 2.56102898 0.02469633 0.05530447 -0.00000192 0.00000848 0.00000134 Cu 6.40061870 2.10517945 0.76361951 -0.00000132 0.00000828 0.00000089 Cu 17.91938736 16.73321868 1.43976303 -0.00000178 0.00000846 0.00000102 Cu 6.40061731 -0.00114925 2.23702938 -0.00000138 0.00000823 0.00000033 Cu 20.47911392 16.73321854 1.43976297 -0.00000130 0.00000848 0.00000114 Cu 8.96034386 -0.00114924 2.23702939 -0.00000170 0.00000869 0.00000145 Cu 20.47911225 14.63457487 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