612 Lattice="15.337291531035204 0.0 0.0 -7.668645765517603 13.282484091124413 0.0 0.0 0.0 35.48139727138237" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-2136.484557798241 pbc="T T F" Cu 0.00399533 0.00416311 0.03248066 29 -0.00000232 -0.00000965 -0.00000004 Cu 2.56021058 0.00416311 0.03248065 29 -0.00000232 -0.00000961 0.00000013 Cu 1.28210295 2.21791046 0.03248065 29 -0.00000229 -0.00000959 0.00000000 Cu -1.27411230 2.21791046 0.03248065 29 -0.00000236 -0.00000960 -0.00000000 Cu 2.56020736 1.47998137 2.09164936 29 -0.00000224 -0.00000956 -0.00000010 Cu 5.11642261 1.47998135 2.09164934 29 -0.00000222 -0.00000921 0.00000025 Cu 3.83831497 3.69372870 2.09164936 29 -0.00000196 -0.00000921 -0.00000005 Cu 1.28209975 3.69372870 2.09164936 29 -0.00000254 -0.00000921 -0.00000007 Cu 5.11641598 2.95578547 4.17822911 29 -0.00000211 -0.00000899 -0.00000017 Cu 7.67263124 2.95578545 4.17822908 29 -0.00000207 -0.00000861 0.00000036 Cu 6.39452359 5.16953279 4.17822911 29 -0.00000172 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