# generated using pymatgen data_Co(NiS2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.67046901 _cell_length_b 6.78799071 _cell_length_c 6.06194582 _cell_angle_alpha 73.05340294 _cell_angle_beta 57.83557049 _cell_angle_gamma 49.11102658 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co(NiS2)2 _chemical_formula_sum 'Co2 Ni4 S8' _cell_volume 201.18481331 _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 0.77352900 0.72647100 0.72647100 1.0 Co Co1 1 0.52352900 0.47647100 0.47647100 1.0 Ni Ni2 1 0.46613500 0.03673800 0.45901800 1.0 Ni Ni3 1 0.03810900 0.45901800 0.03673800 1.0 Ni Ni4 1 0.21326200 0.78386500 0.21189100 1.0 Ni Ni5 1 0.79098200 0.21189100 0.78386500 1.0 S S6 1 0.50343800 0.33792000 0.21000900 1.0 S S7 1 0.03999100 0.30136700 0.74656200 1.0 S S8 1 0.04858000 0.75921300 0.72725300 1.0 S S9 1 0.52274700 0.78504600 0.20142000 1.0 S S10 1 0.49078700 0.20142000 0.78504600 1.0 S S11 1 0.94863300 0.21000900 0.33792000 1.0 S S12 1 0.91208000 0.74656200 0.30136700 1.0 S S13 1 0.46495400 0.72725300 0.75921300 1.0