4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=6.50776458668 pbc="F T F" Cu 0.05983134 -0.28756333 -0.04983987 29 -9.46433249 15.47173949 -15.84191604 Cu 1.39723558 1.52755171 0.36560160 29 33.85581532 -12.68441096 -23.67877155 Cu 1.46972104 -0.28427050 1.74717822 29 7.32854416 10.98438388 12.72105448 Cu 0.07352368 1.51001630 1.23012412 29 -31.72002700 -13.77171241 26.79963311