# generated using pymatgen data_PrNdFe14B _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.77054200 _cell_length_b 8.77054200 _cell_length_c 12.09891500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrNdFe14B _chemical_formula_sum 'Pr4 Nd4 Fe56 B4' _cell_volume 930.67766357 _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 Pr Pr0 1 0.64246700 0.64246700 0.50000000 1.0 Pr Pr1 1 0.35753300 0.35753300 0.50000000 1.0 Pr Pr2 1 0.85753300 0.14246700 0.00000000 1.0 Pr Pr3 1 0.14246700 0.85753300 0.00000000 1.0 Nd Nd4 1 0.23134800 0.76865200 0.50000000 1.0 Nd Nd5 1 0.76865200 0.23134800 0.50000000 1.0 Nd Nd6 1 0.26865200 0.26865200 0.00000000 1.0 Nd Nd7 1 0.73134800 0.73134800 0.00000000 1.0 Fe Fe8 1 0.18270800 0.81729200 0.25429200 1.0 Fe Fe9 1 0.81729200 0.18270800 0.25429200 1.0 Fe Fe10 1 0.31729200 0.31729200 0.75429200 1.0 Fe Fe11 1 0.68270800 0.68270800 0.75429200 1.0 Fe Fe12 1 0.81729200 0.18270800 0.74570800 1.0 Fe Fe13 1 0.18270800 0.81729200 0.74570800 1.0 Fe Fe14 1 0.68270800 0.68270800 0.24570800 1.0 Fe Fe15 1 0.31729200 0.31729200 0.24570800 1.0 Fe Fe16 1 0.40202300 0.59797700 0.29442200 1.0 Fe Fe17 1 0.59797700 0.40202300 0.29442200 1.0 Fe Fe18 1 0.09797700 0.09797700 0.79442200 1.0 Fe Fe19 1 0.90202300 0.90202300 0.79442200 1.0 Fe Fe20 1 0.59797700 0.40202300 0.70557800 1.0 Fe Fe21 1 0.40202300 0.59797700 0.70557800 1.0 Fe Fe22 1 0.90202300 0.90202300 0.20557800 1.0 Fe Fe23 1 0.09797700 0.09797700 0.20557800 1.0 Fe Fe24 1 0.13944700 0.53652700 0.32364000 1.0 Fe Fe25 1 0.86055300 0.46347300 0.32364000 1.0 Fe Fe26 1 0.36055300 0.03652700 0.82364000 1.0 Fe Fe27 1 0.63944700 0.96347300 0.82364000 1.0 Fe Fe28 1 0.86055300 0.46347300 0.67636000 1.0 Fe Fe29 1 0.13944700 0.53652700 0.67636000 1.0 Fe Fe30 1 0.63944700 0.96347300 0.17636000 1.0 Fe Fe31 1 0.36055300 0.03652700 0.17636000 1.0 Fe Fe32 1 0.53652700 0.13944700 0.32364000 1.0 Fe Fe33 1 0.46347300 0.86055300 0.32364000 1.0 Fe Fe34 1 0.03652700 0.36055300 0.82364000 1.0 Fe Fe35 1 0.96347300 0.63944700 0.82364000 1.0 Fe Fe36 1 0.46347300 0.86055300 0.67636000 1.0 Fe Fe37 1 0.53652700 0.13944700 0.67636000 1.0 Fe Fe38 1 0.96347300 0.63944700 0.17636000 1.0 Fe Fe39 1 0.03652700 0.36055300 0.17636000 1.0 Fe Fe40 1 0.50000000 0.50000000 0.11390000 1.0 Fe Fe41 1 0.00000000 0.00000000 0.61390000 1.0 Fe Fe42 1 0.50000000 0.50000000 0.88610000 1.0 Fe Fe43 1 0.00000000 0.00000000 0.38610000 1.0 Fe Fe44 1 0.93310500 0.72458400 0.37259600 1.0 Fe Fe45 1 0.06689500 0.27541600 0.37259600 1.0 Fe Fe46 1 0.56689500 0.22458400 0.87259600 1.0 Fe Fe47 1 0.43310500 0.77541600 0.87259600 1.0 Fe Fe48 1 0.06689500 0.27541600 0.62740400 1.0 Fe Fe49 1 0.93310500 0.72458400 0.62740400 1.0 Fe Fe50 1 0.43310500 0.77541600 0.12740400 1.0 Fe Fe51 1 0.56689500 0.22458400 0.12740400 1.0 Fe Fe52 1 0.72458400 0.93310500 0.37259600 1.0 Fe Fe53 1 0.27541600 0.06689500 0.37259600 1.0 Fe Fe54 1 0.22458400 0.56689500 0.87259600 1.0 Fe Fe55 1 0.77541600 0.43310500 0.87259600 1.0 Fe Fe56 1 0.27541600 0.06689500 0.62740400 1.0 Fe Fe57 1 0.72458400 0.93310500 0.62740400 1.0 Fe Fe58 1 0.77541600 0.43310500 0.12740400 1.0 Fe Fe59 1 0.22458400 0.56689500 0.12740400 1.0 Fe Fe60 1 0.00000000 0.50000000 0.50000000 1.0 Fe Fe61 1 0.50000000 0.00000000 0.00000000 1.0 Fe Fe62 1 0.50000000 0.00000000 0.50000000 1.0 Fe Fe63 1 0.00000000 0.50000000 0.00000000 1.0 B B64 1 0.87607900 0.87607900 0.50000000 1.0 B B65 1 0.12392100 0.12392100 0.50000000 1.0 B B66 1 0.62392100 0.37607900 0.00000000 1.0 B B67 1 0.37607900 0.62392100 0.00000000 1.0