# generated using pymatgen data_CoNi5N4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.95476800 _cell_length_b 5.75865000 _cell_length_c 3.96960300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural CoNi5N4 _chemical_formula_sum 'Co2 Ni10 N8' _cell_volume 204.70200548 _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 Co Co0 1 0.75000000 0.25000000 0.71209600 1.0 Co Co1 1 0.25000000 0.75000000 0.28790400 1.0 Ni Ni2 1 0.59509600 0.53410200 0.30197900 1.0 Ni Ni3 1 0.90490400 0.53410200 0.30197900 1.0 Ni Ni4 1 0.59509600 0.96589800 0.30197900 1.0 Ni Ni5 1 0.90490400 0.96589800 0.30197900 1.0 Ni Ni6 1 0.40490400 0.46589800 0.69802100 1.0 Ni Ni7 1 0.09509600 0.46589800 0.69802100 1.0 Ni Ni8 1 0.40490400 0.03410200 0.69802100 1.0 Ni Ni9 1 0.09509600 0.03410200 0.69802100 1.0 Ni Ni10 1 0.75000000 0.75000000 0.81362400 1.0 Ni Ni11 1 0.25000000 0.25000000 0.18637600 1.0 N N12 1 0.75000000 0.02532800 0.02245300 1.0 N N13 1 0.75000000 0.47467200 0.02245300 1.0 N N14 1 0.25000000 0.97467200 0.97754700 1.0 N N15 1 0.25000000 0.52532800 0.97754700 1.0 N N16 1 0.44691300 0.75000000 0.45612700 1.0 N N17 1 0.05308700 0.75000000 0.45612700 1.0 N N18 1 0.55308700 0.25000000 0.54387300 1.0 N N19 1 0.94691300 0.25000000 0.54387300 1.0