5 Lattice="4.008569038081674 0.0 0.0 0.0 4.008569038081674 0.0 0.0 0.0 4.008569038081674" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:magmoms:R:1 energy=-36.52931618665794 pbc="T T T" Zr 0.82360846 0.00000000 -0.00000000 -0.02604493 -0.02604493 Ru 1.97158916 2.00428452 2.00428452 0.40001228 0.40001228 N 1.92721862 0.00000000 2.00428452 0.00635456 0.00635456 O 1.67609241 2.00428452 -0.00000000 0.00119988 0.00119988 O -0.04387255 2.00428452 2.00428452 0.10638068 0.10638068