# generated using pymatgen data_Nb3Zn2GaIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.43098215 _cell_length_b 7.42617158 _cell_length_c 2.90971788 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.97858715 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb3Zn2GaIr3 _chemical_formula_sum 'Nb3 Zn2 Ga1 Ir3' _cell_volume 139.08694863 _cell_formula_units_Z 1 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 Nb Nb0 1 0.37206213 0.00464030 0.50000100 1.0 Nb Nb1 1 0.00000000 0.36099879 0.50000100 1.0 Nb Nb2 1 0.62793787 0.63257817 0.50000100 1.0 Zn Zn3 1 0.70426042 0.99960773 0.00000000 1.0 Zn Zn4 1 0.29573858 0.29534731 0.00000000 1.0 Ga Ga5 1 1.00000000 0.70596074 0.00000000 1.0 Ir Ir6 1 0.66943181 0.33685535 0.00000000 1.0 Ir Ir7 1 0.33056919 0.66742354 0.00000000 1.0 Ir Ir8 1 0.00000000 0.99659107 0.50000100 1.0