# generated using pymatgen data_NdCd3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.78574754 _cell_length_b 6.78574870 _cell_length_c 4.94943799 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000439 _symmetry_Int_Tables_number 1 _chemical_formula_structural NdCd3 _chemical_formula_sum 'Nd2 Cd6' _cell_volume 197.37037662 _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 Nd Nd0 1 0.66666600 0.33333200 0.25000000 1.0 Nd Nd1 1 0.33333300 0.66666700 0.74999900 1.0 Cd Cd2 1 0.84324034 0.15675966 0.74999900 1.0 Cd Cd3 1 0.31351832 0.15675966 0.74999900 1.0 Cd Cd4 1 0.84324034 0.68647968 0.74999900 1.0 Cd Cd5 1 0.15675866 0.84324134 0.25000000 1.0 Cd Cd6 1 0.68648068 0.84324134 0.25000000 1.0 Cd Cd7 1 0.15675966 0.31351932 0.25000000 1.0