# generated using pymatgen data_Sn7Ir5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.51473241 _cell_length_b 6.89222127 _cell_length_c 6.89222144 _cell_angle_alpha 77.09325860 _cell_angle_beta 61.79584336 _cell_angle_gamma 61.79582633 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sn7Ir5 _chemical_formula_sum 'Sn7 Ir5' _cell_volume 240.34334357 _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 Sn Sn0 1 0.72380992 -0.00000000 0.57041159 1.0 Sn Sn1 1 0.29422151 0.42958841 0.00000000 1.0 Sn Sn2 1 0.72380992 0.57041159 0.00000000 1.0 Sn Sn3 1 0.29422151 -0.00000000 0.42958841 1.0 Sn Sn4 1 0.41697711 0.50000000 0.50000000 1.0 Sn Sn5 1 0.90260851 0.00000000 -0.00000000 1.0 Sn Sn6 1 0.91697711 0.50000000 0.50000000 1.0 Ir Ir7 1 0.93279004 0.24482700 0.24482700 1.0 Ir Ir8 1 0.17761704 0.75517300 0.24482700 1.0 Ir Ir9 1 0.17761704 0.24482700 0.75517300 1.0 Ir Ir10 1 0.42244304 0.75517300 0.75517300 1.0 Ir Ir11 1 0.50290426 0.00000000 -0.00000000 1.0