# generated using pymatgen data_PrInCu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.64597066 _cell_length_b 7.64597270 _cell_length_c 4.07112958 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00002450 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrInCu _chemical_formula_sum 'Pr3 In3 Cu3' _cell_volume 206.11557992 _cell_formula_units_Z 3 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 0.41558451 0.41558451 0.50000000 1.0 Pr Pr1 1 0.58441549 0.00000000 0.50000000 1.0 Pr Pr2 1 0.00000000 0.58441549 0.50000000 1.0 In In3 1 0.75525379 0.75525379 -0.00000000 1.0 In In4 1 0.24474621 -0.00000000 -0.00000000 1.0 In In5 1 -0.00000000 0.24474621 0.00000000 1.0 Cu Cu6 1 0.66666700 0.33333300 -0.00000000 1.0 Cu Cu7 1 0.33333300 0.66666700 0.00000000 1.0 Cu Cu8 1 0.00000000 -0.00000000 0.50000000 1.0