612 Lattice="15.33714644048774 0.0 0.0 -7.66857322024387 13.282358439024462 0.0 0.0 0.0 35.481061617897225" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-2129.8068902363502 pbc="T T F" Cu 0.00397362 0.00407529 0.03814879 29 -0.00000198 -0.00000787 0.00000010 Cu 2.56016467 0.00407530 0.03814878 29 -0.00000109 -0.00000907 -0.00000004 Cu 1.28206917 2.21780166 0.03814878 29 -0.00000332 -0.00000765 0.00000014 Cu -1.27412190 2.21780168 0.03814879 29 -0.00000194 -0.00000781 0.00000007 Cu 2.56016289 1.47988547 2.08790753 29 -0.00000210 -0.00000752 -0.00000003 Cu 5.11635391 1.47988546 2.08790750 29 -0.00000008 -0.00000769 0.00000018 Cu 3.83825843 3.69361186 2.08790750 29 -0.00000279 -0.00000709 0.00000016 Cu 1.28206733 3.69361188 2.08790750 29 -0.00000174 -0.00000769 -0.00000000 Cu 5.11634864 2.95568123 4.17842291 29 -0.00000210 -0.00000721 -0.00000005 Cu 7.67253966 2.95568123 4.17842288 29 -0.00000018 -0.00000646 0.00000007 Cu 6.39444416 5.16940759 4.17842291 29 -0.00000174 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