# generated using pymatgen data_Ca6P19Rh30 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 15.67797557 _cell_length_b 15.67797557 _cell_length_c 3.83216200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999819 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca6P19Rh30 _chemical_formula_sum 'Ca6 P19 Rh30' _cell_volume 815.74508633 _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 Ca Ca0 1 0.42971200 0.36953600 0.25016000 1.0 Ca Ca1 1 0.93982400 0.57028800 0.25016000 1.0 Ca Ca2 1 0.63046400 0.06017600 0.25016000 1.0 Ca Ca3 1 0.23712500 0.96342200 0.75011100 1.0 Ca Ca4 1 0.72629700 0.76287500 0.75011100 1.0 Ca Ca5 1 0.03657800 0.27370300 0.75011100 1.0 P P6 1 0.58996300 0.78238700 0.24645400 1.0 P P7 1 0.19242400 0.41003700 0.24645400 1.0 P P8 1 0.21761300 0.80757600 0.24645400 1.0 P P9 1 0.07698600 0.55012600 0.75229100 1.0 P P10 1 0.47313900 0.92301400 0.75229100 1.0 P P11 1 0.44987400 0.52686100 0.75229100 1.0 P P12 1 0.70430400 0.60463500 0.24924400 1.0 P P13 1 0.90033100 0.29569600 0.24924400 1.0 P P14 1 0.39536500 0.09966900 0.24924400 1.0 P P15 1 0.96244900 0.72887200 0.75039800 1.0 P P16 1 0.76642300 0.03755100 0.75039800 1.0 P P17 1 0.27112800 0.23357700 0.75039800 1.0 P P18 1 0.10251600 0.98417100 0.25047100 1.0 P P19 1 0.88165500 0.89748400 0.25047100 1.0 P P20 1 0.01582900 0.11834500 0.25047100 1.0 P P21 1 0.56453800 0.34935100 0.74943400 1.0 P P22 1 0.78481300 0.43546200 0.74943400 1.0 P P23 1 0.65064900 0.21518700 0.74943400 1.0 P P24 1 0.33333300 0.66666700 0.42072200 1.0 Rh Rh25 1 0.56224900 0.61852700 0.24629700 1.0 Rh Rh26 1 0.05627900 0.43775100 0.24629700 1.0 Rh Rh27 1 0.38147300 0.94372100 0.24629700 1.0 Rh Rh28 1 0.10332600 0.71443300 0.75260800 1.0 Rh Rh29 1 0.61110700 0.89667400 0.75260800 1.0 Rh Rh30 1 0.28556700 0.38889300 0.75260800 1.0 Rh Rh31 1 0.55664600 0.23792900 0.24954500 1.0 Rh Rh32 1 0.68128300 0.44335400 0.24954500 1.0 Rh Rh33 1 0.76207100 0.31871700 0.24954500 1.0 Rh Rh34 1 0.10921900 0.09430300 0.75098700 1.0 Rh Rh35 1 0.98508400 0.89078100 0.75098700 1.0 Rh Rh36 1 0.90569700 0.01491600 0.75098700 1.0 Rh Rh37 1 0.35688600 0.53754000 0.25156000 1.0 Rh Rh38 1 0.18065400 0.64311400 0.25156000 1.0 Rh Rh39 1 0.46246000 0.81934600 0.25156000 1.0 Rh Rh40 1 0.31005000 0.79061600 0.74290300 1.0 Rh Rh41 1 0.48056600 0.68995000 0.74290300 1.0 Rh Rh42 1 0.20938400 0.51943400 0.74290300 1.0 Rh Rh43 1 0.74911000 0.92641800 0.25023700 1.0 Rh Rh44 1 0.17730800 0.25089000 0.25023700 1.0 Rh Rh45 1 0.07358200 0.82269200 0.25023700 1.0 Rh Rh46 1 0.91744300 0.40685700 0.74958500 1.0 Rh Rh47 1 0.48941500 0.08255700 0.74958500 1.0 Rh Rh48 1 0.59314300 0.51058500 0.74958500 1.0 Rh Rh49 1 0.25913900 0.12737400 0.25121400 1.0 Rh Rh50 1 0.86823500 0.74086100 0.25121400 1.0 Rh Rh51 1 0.87262600 0.13176500 0.25121400 1.0 Rh Rh52 1 0.40785800 0.20699700 0.74859100 1.0 Rh Rh53 1 0.79913900 0.59214200 0.74859100 1.0 Rh Rh54 1 0.79300300 0.20086100 0.74859100 1.0