# generated using pymatgen data_ZrNi3MoIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.48161988 _cell_length_b 5.48161950 _cell_length_c 4.24033741 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00001407 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZrNi3MoIr3 _chemical_formula_sum 'Zr1 Ni3 Mo1 Ir3' _cell_volume 110.34401665 _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 Zr Zr0 1 0.33333300 0.66666700 0.25000000 1.0 Ni Ni1 1 0.15506509 0.84493491 0.75000000 1.0 Ni Ni2 1 0.68987082 0.84493491 0.75000000 1.0 Ni Ni3 1 0.15506509 0.31012918 0.75000000 1.0 Mo Mo4 1 0.66666700 0.33333300 0.75000000 1.0 Ir Ir5 1 0.83682355 0.67364909 0.25000000 1.0 Ir Ir6 1 0.32635091 0.16317645 0.25000000 1.0 Ir Ir7 1 0.83682355 0.16317645 0.25000000 1.0