# generated using pymatgen data_Ag15Bi7I40 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.61663839 _cell_length_b 7.61663839 _cell_length_c 73.68613552 _cell_angle_alpha 89.61606504 _cell_angle_beta 89.61606504 _cell_angle_gamma 34.77118685 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ag15Bi7I40 _chemical_formula_sum 'Ag15 Bi7 I40' _cell_volume 2437.84192502 _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 Ag Ag0 1 0.00460700 0.00460700 0.99778900 1.0 Ag Ag1 1 0.90782900 0.90782900 0.09770700 1.0 Ag Ag2 1 0.14026300 0.14026300 0.35290500 1.0 Ag Ag3 1 0.04232500 0.04232500 0.45221200 1.0 Ag Ag4 1 0.94377800 0.94377800 0.55379400 1.0 Ag Ag5 1 0.40215600 0.40215600 0.59989900 1.0 Ag Ag6 1 0.85020200 0.85020200 0.65005500 1.0 Ag Ag7 1 0.75021200 0.75021200 0.74998400 1.0 Ag Ag8 1 0.29976300 0.29976300 0.70007100 1.0 Ag Ag9 1 0.19849100 0.19849100 0.80009400 1.0 Ag Ag10 1 0.10407500 0.10407500 0.89739700 1.0 Ag Ag11 1 0.64651000 0.64651000 0.84942200 1.0 Ag Ag12 1 0.55366700 0.55366700 0.94928800 1.0 Ag Ag13 1 0.82836900 0.82836900 0.92283800 1.0 Ag Ag14 1 0.27254900 0.27254900 0.97339200 1.0 Bi Bi15 1 0.44959800 0.44959800 0.04925600 1.0 Bi Bi16 1 0.35375000 0.35375000 0.14655000 1.0 Bi Bi17 1 0.80502700 0.80502700 0.19913500 1.0 Bi Bi18 1 0.69675600 0.69675600 0.30364700 1.0 Bi Bi19 1 0.24441600 0.24441600 0.25095800 1.0 Bi Bi20 1 0.60118300 0.60118300 0.40101900 1.0 Bi Bi21 1 0.50173900 0.50173900 0.50106300 1.0 I I22 1 0.36529000 0.36529000 0.01246900 1.0 I I23 1 0.81072300 0.81072300 0.06213200 1.0 I I24 1 0.08637800 0.08637800 0.03766900 1.0 I I25 1 0.26368000 0.26368000 0.11185000 1.0 I I26 1 0.53268000 0.53268000 0.08912400 1.0 I I27 1 0.71132200 0.71132200 0.16188700 1.0 I I28 1 0.98931400 0.98931400 0.13735200 1.0 I I29 1 0.16045500 0.16045500 0.21348700 1.0 I I30 1 0.44680700 0.44680700 0.18696300 1.0 I I31 1 0.60329300 0.60329300 0.26276900 1.0 I I32 1 0.88868800 0.88868800 0.23658800 1.0 I I33 1 0.06119400 0.06119400 0.31250300 1.0 I I34 1 0.33918000 0.33918000 0.28812400 1.0 I I35 1 0.51765700 0.51765700 0.36056900 1.0 I I36 1 0.78706400 0.78706400 0.33799800 1.0 I I37 1 0.96304900 0.96304900 0.41145600 1.0 I I38 1 0.24041300 0.24041300 0.38785500 1.0 I I39 1 0.41869900 0.41869900 0.46082000 1.0 I I40 1 0.68465000 0.68465000 0.43715200 1.0 I I41 1 0.86397300 0.86397300 0.51227600 1.0 I I42 1 0.14015700 0.14015700 0.48791200 1.0 I I43 1 0.32328600 0.32328600 0.56404300 1.0 I I44 1 0.58469900 0.58469900 0.53742100 1.0 I I45 1 0.77377200 0.77377200 0.61429100 1.0 I I46 1 0.03055400 0.03055400 0.58903100 1.0 I I47 1 0.22390800 0.22390800 0.66369100 1.0 I I48 1 0.47488300 0.47488300 0.63661700 1.0 I I49 1 0.67411600 0.67411600 0.71384300 1.0 I I50 1 0.92561200 0.92561200 0.68607500 1.0 I I51 1 0.12439500 0.12439500 0.76383100 1.0 I I52 1 0.37653100 0.37653100 0.73634100 1.0 I I53 1 0.57174800 0.57174800 0.81179900 1.0 I I54 1 0.82590400 0.82590400 0.78623700 1.0 I I55 1 0.02506900 0.02506900 0.86157700 1.0 I I56 1 0.27421700 0.27421700 0.83611400 1.0 I I57 1 0.46255800 0.46255800 0.91496000 1.0 I I58 1 0.72996300 0.72996300 0.88867800 1.0 I I59 1 0.90459400 0.90459400 0.96389100 1.0 I I60 1 0.18853700 0.18853700 0.93750700 1.0 I I61 1 0.63372400 0.63372400 0.98662200 1.0