# generated using pymatgen data_MgCd2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.81943656 _cell_length_b 3.09258209 _cell_length_c 7.30845871 _cell_angle_alpha 90.00000000 _cell_angle_beta 107.19992971 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgCd2 _chemical_formula_sum 'Mg4 Cd8' _cell_volume 255.19602993 _cell_formula_units_Z 4 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 Mg Mg0 1 0.36310483 -0.00000000 0.47113151 1.0 Mg Mg1 1 0.13689617 0.50000000 0.52887049 1.0 Mg Mg2 1 0.86310483 0.50000000 0.47113151 1.0 Mg Mg3 1 0.63689617 0.00000000 0.52887049 1.0 Cd Cd4 1 0.19484586 0.50000000 0.14669074 1.0 Cd Cd5 1 0.46889200 0.50000000 0.19353795 1.0 Cd Cd6 1 0.03110800 -0.00000000 0.80646205 1.0 Cd Cd7 1 0.30515314 0.00000000 0.85330726 1.0 Cd Cd8 1 0.69484586 0.00000000 0.14669074 1.0 Cd Cd9 1 0.96889200 0.00000000 0.19353795 1.0 Cd Cd10 1 0.53110800 0.50000000 0.80646205 1.0 Cd Cd11 1 0.80515314 0.50000000 0.85330726 1.0