# generated using pymatgen data_Nd6Mg2Cd21P _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.96072599 _cell_length_b 9.95500164 _cell_length_c 9.95500138 _cell_angle_alpha 60.15971874 _cell_angle_beta 59.98097375 _cell_angle_gamma 59.98097664 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd6Mg2Cd21P _chemical_formula_sum 'Nd6 Mg2 Cd21 P1' _cell_volume 698.64232480 _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 Nd Nd0 1 0.79431462 0.79621053 0.20378947 1.0 Nd Nd1 1 0.20568538 0.79621053 0.20378947 1.0 Nd Nd2 1 0.79449288 0.20550712 0.20550712 1.0 Nd Nd3 1 0.20568538 0.20378947 0.79621053 1.0 Nd Nd4 1 0.79431462 0.20378947 0.79621053 1.0 Nd Nd5 1 0.20550712 0.79449288 0.79449288 1.0 Mg Mg6 1 0.00000000 0.50000000 0.50000000 1.0 Mg Mg7 1 0.50000000 0.50000000 0.50000000 1.0 Cd Cd8 1 0.83238816 0.82944310 0.50577958 1.0 Cd Cd9 1 0.83238816 0.50577958 0.82944310 1.0 Cd Cd10 1 0.50697935 0.83070403 0.83070403 1.0 Cd Cd11 1 0.83161159 0.83070403 0.83070403 1.0 Cd Cd12 1 0.16761184 0.17055690 0.49422042 1.0 Cd Cd13 1 0.16761184 0.49422042 0.17055690 1.0 Cd Cd14 1 0.49302065 0.16929597 0.16929597 1.0 Cd Cd15 1 0.16838841 0.16929597 0.16929597 1.0 Cd Cd16 1 0.62220711 0.62067704 0.13490673 1.0 Cd Cd17 1 0.62220711 0.13490673 0.62067704 1.0 Cd Cd18 1 0.13497450 0.62016064 0.62016064 1.0 Cd Cd19 1 0.62470323 0.62016064 0.62016064 1.0 Cd Cd20 1 0.37779289 0.37932296 0.86509327 1.0 Cd Cd21 1 0.37779289 0.86509327 0.37932296 1.0 Cd Cd22 1 0.86502550 0.37983936 0.37983936 1.0 Cd Cd23 1 0.37529677 0.37983936 0.37983936 1.0 Cd Cd24 1 0.00000000 0.00000000 0.50000000 1.0 Cd Cd25 1 0.50000000 0.00000000 0.50000000 1.0 Cd Cd26 1 0.50000000 0.50000000 0.00000000 1.0 Cd Cd27 1 0.00000000 0.50000000 0.00000000 1.0 Cd Cd28 1 0.50000000 0.00000000 0.00000000 1.0 P P29 1 0.00000000 0.00000000 0.00000000 1.0