864 Lattice="15.335992733732683 0.0 0.0 15.335992733732681 18.782678448337776 0.0 0.0 0.0 35.41695813244284" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2997.524129694563 stress="29.024690645158508 -0.024822469289702553 -0.05453548518150164 -0.024822469289702553 19.46180337717735 0.025164631675696825 -0.05453548518150164 0.025164631675696825 0.003464063119343219" pbc="T T F" Cu 0.00152557 -0.02258234 0.06300338 -0.00000881 0.00000403 0.00000069 Cu 3.83552087 2.07014092 0.74319153 -0.00000869 0.00000392 0.00000054 Cu 2.55752436 -0.02258241 0.06300338 -0.00000877 0.00000407 0.00000069 Cu 6.39151965 2.07014096 0.74319150 -0.00000875 0.00000397 0.00000057 Cu 17.89351004 16.69067934 1.45934478 -0.00000870 0.00000412 0.00000048 Cu 6.39151351 0.00123066 2.24215698 -0.00000871 0.00000375 0.00000028 Cu 20.44950883 16.69067935 1.45934474 -0.00000857 0.00000426 0.00000053 Cu 24.28350499 18.78390911 2.24215698 -0.00000832 0.00000375 0.00000039 Cu 20.44950242 14.61243765 2.94943688 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