# generated using pymatgen data_ZnIn3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.06381027 _cell_length_b 7.06381027 _cell_length_c 5.05886700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 127.40303693 _symmetry_Int_Tables_number 1 _chemical_formula_structural ZnIn3 _chemical_formula_sum 'Zn2 In6' _cell_volume 200.52149848 _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 Zn Zn0 1 0.83082700 0.16917300 0.75000000 1.0 Zn Zn1 1 0.16917300 0.83082700 0.25000000 1.0 In In2 1 0.16824700 0.32837900 0.25000000 1.0 In In3 1 0.68665800 0.31334200 0.25000000 1.0 In In4 1 0.67162100 0.83175300 0.25000000 1.0 In In5 1 0.83175300 0.67162100 0.75000000 1.0 In In6 1 0.31334200 0.68665800 0.75000000 1.0 In In7 1 0.32837900 0.16824700 0.75000000 1.0