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=1.1356918711256956 pbc="F T F" Cu 0.25978669 -0.27407488 -0.21495266 29 -12.11513754 12.86670261 -12.39643509 Cu 1.68365717 1.70288723 0.08343331 29 18.14869836 -9.36278913 -5.73018808 Cu 1.29585403 -0.05190546 1.72094491 29 14.44626918 13.36740869 9.93906944 Cu 0.23171545 1.68190327 1.32183498 29 -20.47983000 -16.87132217 8.18755373