# generated using pymatgen data_Ti3Ga2CoN _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.94837456 _cell_length_b 7.94984167 _cell_length_c 7.94837456 _cell_angle_alpha 119.99389546 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99389546 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3Ga2CoN _chemical_formula_sum 'Ti12 Ga8 Co4 N4' _cell_volume 355.20596916 _cell_formula_units_Z 4 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 Ti Ti0 1 0.93484586 0.36969271 0.18484586 1.0 Ti Ti1 1 0.31509978 0.75000000 0.18490022 1.0 Ti Ti2 1 0.93490022 0.75000000 0.18490022 1.0 Ti Ti3 1 0.68490022 0.25000000 0.43490022 1.0 Ti Ti4 1 0.68484586 0.86969271 0.43484586 1.0 Ti Ti5 1 0.06509978 0.25000000 0.43490022 1.0 Ti Ti6 1 0.31515414 0.13030729 0.56515414 1.0 Ti Ti7 1 0.31509978 0.75000000 0.56509978 1.0 Ti Ti8 1 0.93490022 0.75000000 0.56509978 1.0 Ti Ti9 1 0.06509978 0.25000000 0.81509978 1.0 Ti Ti10 1 0.68490022 0.25000000 0.81509978 1.0 Ti Ti11 1 0.06515414 0.63030729 0.81515414 1.0 Ga Ga12 1 0.70913879 0.91827857 0.12759461 1.0 Ga Ga13 1 0.29086121 0.08172143 0.20931603 1.0 Ga Ga14 1 0.29068397 0.41827857 0.20913879 1.0 Ga Ga15 1 0.62759461 0.41827857 0.20913879 1.0 Ga Ga16 1 0.37240539 0.58172143 0.79086121 1.0 Ga Ga17 1 0.70931603 0.58172143 0.79086121 1.0 Ga Ga18 1 0.70913879 0.91827857 0.79068397 1.0 Ga Ga19 1 0.29086121 0.08172143 0.87240539 1.0 Co Co20 1 0.00000000 0.00000000 0.00000000 1.0 Co Co21 1 0.50000000 0.00000000 0.00000000 1.0 Co Co22 1 0.50000000 0.50000000 0.00000000 1.0 Co Co23 1 0.50000000 0.50000000 0.50000000 1.0 N N24 1 0.00000000 0.50000000 0.00000000 1.0 N N25 1 0.00000000 0.00000000 0.50000000 1.0 N N26 1 0.50000000 0.00000000 0.50000000 1.0 N N27 1 0.00000000 0.50000000 0.50000000 1.0