# generated using pymatgen data_Nd2CoNiO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.61993400 _cell_length_b 5.42834700 _cell_length_c 9.39619848 _cell_angle_alpha 54.86985012 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2CoNiO6 _chemical_formula_sum 'Nd4 Co2 Ni2 O12' _cell_volume 234.43533920 _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 0.55541800 0.73596100 0.75040100 1.0 Nd Nd1 1 0.05541800 0.26403900 0.74959900 1.0 Nd Nd2 1 0.44458200 0.26403900 0.24959900 1.0 Nd Nd3 1 0.94458200 0.73596100 0.25040100 1.0 Co Co4 1 0.50000000 0.00000000 0.00000000 1.0 Co Co5 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni6 1 0.50000000 0.50000000 0.50000000 1.0 Ni Ni7 1 0.00000000 0.50000000 0.00000000 1.0 O O8 1 0.79207200 0.25404300 0.95416300 1.0 O O9 1 0.29207200 0.74595700 0.54583700 1.0 O O10 1 0.20005000 0.32400500 0.45753200 1.0 O O11 1 0.70005000 0.67599500 0.04246800 1.0 O O12 1 0.20792800 0.74595700 0.04583700 1.0 O O13 1 0.70792800 0.25404300 0.45416300 1.0 O O14 1 0.79995000 0.67599500 0.54246800 1.0 O O15 1 0.29995000 0.32400500 0.95753200 1.0 O O16 1 0.97961600 0.83885700 0.74325000 1.0 O O17 1 0.47961600 0.16114300 0.75675000 1.0 O O18 1 0.02038400 0.16114300 0.25675000 1.0 O O19 1 0.52038400 0.83885700 0.24325000 1.0