# generated using pymatgen data_Nd2FeNiO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.65775800 _cell_length_b 5.44062100 _cell_length_c 9.46811134 _cell_angle_alpha 55.07354277 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2FeNiO6 _chemical_formula_sum 'Nd4 Fe2 Ni2 O12' _cell_volume 238.95191247 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Nd Nd0 1 0.94092400 0.23632500 0.75048200 1.0 Nd Nd1 1 0.44092400 0.76367500 0.74951800 1.0 Nd Nd2 1 0.05907600 0.76367500 0.24951800 1.0 Nd Nd3 1 0.55907600 0.23632500 0.25048200 1.0 Fe Fe4 1 0.00000000 0.50000000 0.00000000 1.0 Fe Fe5 1 0.50000000 0.50000000 0.50000000 1.0 Ni Ni6 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni7 1 0.50000000 0.00000000 0.00000000 1.0 O O8 1 0.52167200 0.33745800 0.74782300 1.0 O O9 1 0.02167200 0.66254200 0.75217700 1.0 O O10 1 0.47832800 0.66254200 0.25217700 1.0 O O11 1 0.97832800 0.33745800 0.24782300 1.0 O O12 1 0.69903200 0.16309500 0.54439600 1.0 O O13 1 0.19903200 0.83690500 0.95560400 1.0 O O14 1 0.29365800 0.25422400 0.04540800 1.0 O O15 1 0.79365800 0.74577600 0.45459200 1.0 O O16 1 0.30096800 0.83690500 0.45560400 1.0 O O17 1 0.80096800 0.16309500 0.04439600 1.0 O O18 1 0.70634200 0.74577600 0.95459200 1.0 O O19 1 0.20634200 0.25422400 0.54540800 1.0