# generated using pymatgen data_CaTh2(InRh)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.49046289 _cell_length_b 7.71975877 _cell_length_c 3.98831490 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.02448312 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaTh2(InRh)3 _chemical_formula_sum 'Ca1 Th2 In3 Rh3' _cell_volume 201.65925847 _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 0.40834893 0.99999947 0.50000000 1.0 Th Th1 1 0.00020146 0.41323595 0.50000000 1.0 Th Th2 1 0.58698397 0.58678655 0.50000000 1.0 In In3 1 0.24908703 0.23192404 0.00000000 1.0 In In4 1 0.01719510 0.76808138 0.00000000 1.0 In In5 1 0.73075075 0.00000833 0.00000000 1.0 Rh Rh6 1 0.32843834 0.63074751 0.00000000 1.0 Rh Rh7 1 0.98131386 0.99999164 0.50000000 1.0 Rh Rh8 1 0.69767856 0.36922512 0.00000000 1.0