# generated using pymatgen data_CaCd3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.70323070 _cell_length_b 6.70323070 _cell_length_c 4.99886457 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999469 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaCd3 _chemical_formula_sum 'Ca2 Cd6' _cell_volume 194.52273135 _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 0.33333300 0.66666700 0.75000000 1.0 Ca Ca1 1 0.66666700 0.33333300 0.25000000 1.0 Cd Cd2 1 0.15740260 0.31480420 0.25000000 1.0 Cd Cd3 1 0.68519580 0.84259740 0.25000000 1.0 Cd Cd4 1 0.15740260 0.84259740 0.25000000 1.0 Cd Cd5 1 0.84259740 0.68519580 0.75000000 1.0 Cd Cd6 1 0.31480420 0.15740260 0.75000000 1.0 Cd Cd7 1 0.84259740 0.15740260 0.75000000 1.0