# generated using pymatgen data_Pr6Fe13Cu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.05565800 _cell_length_b 8.05565800 _cell_length_c 12.78155756 _cell_angle_alpha 108.36855221 _cell_angle_beta 108.36855221 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr6Fe13Cu _chemical_formula_sum 'Pr12 Fe26 Cu2' _cell_volume 742.51864208 _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 Pr Pr0 1 0.97564500 0.47564500 0.62306500 1.0 Pr Pr1 1 0.64742100 0.14742100 0.62306500 1.0 Pr Pr2 1 0.14742100 0.97564500 0.62306500 1.0 Pr Pr3 1 0.47564500 0.64742100 0.62306500 1.0 Pr Pr4 1 0.02435500 0.52435500 0.37693500 1.0 Pr Pr5 1 0.35257900 0.85257900 0.37693500 1.0 Pr Pr6 1 0.85257900 0.02435500 0.37693500 1.0 Pr Pr7 1 0.52435500 0.35257900 0.37693500 1.0 Pr Pr8 1 0.60976600 0.60976600 0.21953100 1.0 Pr Pr9 1 0.10976600 0.10976600 0.21953100 1.0 Pr Pr10 1 0.39023400 0.39023400 0.78046900 1.0 Pr Pr11 1 0.89023400 0.89023400 0.78046900 1.0 Fe Fe12 1 0.11843000 0.61843000 0.88077200 1.0 Fe Fe13 1 0.76234200 0.26234200 0.88077200 1.0 Fe Fe14 1 0.26234200 0.11843000 0.88077200 1.0 Fe Fe15 1 0.61843000 0.76234200 0.88077200 1.0 Fe Fe16 1 0.88157000 0.38157000 0.11922800 1.0 Fe Fe17 1 0.23765800 0.73765800 0.11922800 1.0 Fe Fe18 1 0.73765800 0.88157000 0.11922800 1.0 Fe Fe19 1 0.38157000 0.23765800 0.11922800 1.0 Fe Fe20 1 0.71104900 0.56689600 0.00000000 1.0 Fe Fe21 1 0.28895100 0.43310400 0.00000000 1.0 Fe Fe22 1 0.78895100 0.06689600 0.00000000 1.0 Fe Fe23 1 0.21104900 0.93310400 0.00000000 1.0 Fe Fe24 1 0.56689600 0.28895100 0.00000000 1.0 Fe Fe25 1 0.43310400 0.71104900 0.00000000 1.0 Fe Fe26 1 0.06689600 0.21104900 0.00000000 1.0 Fe Fe27 1 0.93310400 0.78895100 0.00000000 1.0 Fe Fe28 1 0.29066200 0.79066200 0.80928600 1.0 Fe Fe29 1 0.51862400 0.01862400 0.80928600 1.0 Fe Fe30 1 0.01862400 0.29066200 0.80928600 1.0 Fe Fe31 1 0.79066200 0.51862400 0.80928600 1.0 Fe Fe32 1 0.70933800 0.20933800 0.19071400 1.0 Fe Fe33 1 0.48137600 0.98137600 0.19071400 1.0 Fe Fe34 1 0.98137600 0.70933800 0.19071400 1.0 Fe Fe35 1 0.20933800 0.48137600 0.19071400 1.0 Fe Fe36 1 0.00000000 0.50000000 0.00000000 1.0 Fe Fe37 1 0.50000000 0.00000000 0.00000000 1.0 Cu Cu38 1 0.25000000 0.25000000 0.50000000 1.0 Cu Cu39 1 0.75000000 0.75000000 0.50000000 1.0