# generated using pymatgen data_Ca(Pr3Rh2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.28472127 _cell_length_b 11.28472127 _cell_length_c 6.57854721 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca(Pr3Rh2)3 _chemical_formula_sum 'Ca2 Pr18 Rh12' _cell_volume 837.74466183 _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 Ca Ca0 1 0.00000000 0.00000000 0.50000000 1.0 Ca Ca1 1 0.00000000 0.00000000 0.00000000 1.0 Pr Pr2 1 0.28863799 0.09008142 0.39177834 1.0 Pr Pr3 1 0.28863799 0.90991858 0.89177834 1.0 Pr Pr4 1 0.71136201 0.09008142 0.89177834 1.0 Pr Pr5 1 0.71136201 0.90991858 0.39177834 1.0 Pr Pr6 1 0.59038117 0.79193432 0.89023103 1.0 Pr Pr7 1 0.59038117 0.20806568 0.39023103 1.0 Pr Pr8 1 0.40961883 0.79193432 0.39023103 1.0 Pr Pr9 1 0.40961883 0.20806568 0.89023103 1.0 Pr Pr10 1 0.20806568 0.40961883 0.60976897 1.0 Pr Pr11 1 0.20806568 0.59038117 0.10976897 1.0 Pr Pr12 1 0.79193432 0.40961883 0.10976897 1.0 Pr Pr13 1 0.79193432 0.59038117 0.60976897 1.0 Pr Pr14 1 0.90991858 0.71136201 0.10822166 1.0 Pr Pr15 1 0.90991858 0.28863799 0.60822166 1.0 Pr Pr16 1 0.09008142 0.71136201 0.60822166 1.0 Pr Pr17 1 0.09008142 0.28863799 0.10822166 1.0 Pr Pr18 1 0.50000000 0.50000000 0.00000000 1.0 Pr Pr19 1 0.50000000 0.50000000 0.50000000 1.0 Rh Rh20 1 0.84077902 0.15922098 0.25000000 1.0 Rh Rh21 1 0.84077902 0.84077902 0.75000000 1.0 Rh Rh22 1 0.15922098 0.15922098 0.75000000 1.0 Rh Rh23 1 0.15922098 0.84077902 0.25000000 1.0 Rh Rh24 1 0.65492355 0.34507645 0.75000000 1.0 Rh Rh25 1 0.65492355 0.65492355 0.25000000 1.0 Rh Rh26 1 0.34507645 0.34507645 0.25000000 1.0 Rh Rh27 1 0.34507645 0.65492355 0.75000000 1.0 Rh Rh28 1 0.50000000 0.00000000 0.12641870 1.0 Rh Rh29 1 0.50000000 0.00000000 0.62641870 1.0 Rh Rh30 1 0.00000000 0.50000000 0.87358130 1.0 Rh Rh31 1 0.00000000 0.50000000 0.37358130 1.0