# generated using pymatgen data_NaAc(NdB12)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.18322878 _cell_length_b 7.18322880 _cell_length_c 5.88644442 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 109.29875207 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaAc(NdB12)2 _chemical_formula_sum 'Na1 Ac1 Nd2 B24' _cell_volume 286.66598855 _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 Na Na0 1 0.00057953 0.99942057 0.00000000 1.0 Ac Ac1 1 0.75220065 0.24779937 0.50000000 1.0 Nd Nd2 1 0.49790876 0.50209131 0.00000000 1.0 Nd Nd3 1 0.24839664 0.75160332 0.50000000 1.0 B B4 1 0.17683467 0.32545611 0.65019988 1.0 B B5 1 0.92565610 0.57636046 0.14820310 1.0 B B6 1 0.67454387 0.82316532 0.65019986 1.0 B B7 1 0.42363954 0.07434389 0.14820310 1.0 B B8 1 0.17683467 0.32545611 0.34980012 1.0 B B9 1 0.92565610 0.57636046 0.85179690 1.0 B B10 1 0.67454387 0.82316532 0.34980014 1.0 B B11 1 0.42363954 0.07434389 0.85179690 1.0 B B12 1 0.39991852 0.39945155 0.50000000 1.0 B B13 1 0.14866065 0.65179406 0.00000000 1.0 B B14 1 0.89932541 0.89901929 0.50000000 1.0 B B15 1 0.65006278 0.14744474 0.00000000 1.0 B B16 1 0.32386634 0.17498169 0.65017721 1.0 B B17 1 0.07704001 0.42627046 0.14818110 1.0 B B18 1 0.82501831 0.67613365 0.65017720 1.0 B B19 1 0.57372952 0.92296000 0.14818109 1.0 B B20 1 0.10098070 0.10067458 0.50000000 1.0 B B21 1 0.85255527 0.34993723 0.00000000 1.0 B B22 1 0.60054843 0.60008146 0.50000000 1.0 B B23 1 0.34820594 0.85133933 0.00000000 1.0 B B24 1 0.32386634 0.17498169 0.34982279 1.0 B B25 1 0.07704001 0.42627046 0.85181890 1.0 B B26 1 0.82501831 0.67613365 0.34982280 1.0 B B27 1 0.57372952 0.92296000 0.85181891 1.0