# generated using pymatgen data_PrNi3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.01960227 _cell_length_b 5.01960227 _cell_length_c 8.70414000 _cell_angle_alpha 73.24105786 _cell_angle_beta 73.24105786 _cell_angle_gamma 59.99998725 _symmetry_Int_Tables_number 1 _chemical_formula_structural PrNi3 _chemical_formula_sum 'Pr3 Ni9' _cell_volume 179.09386326 _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 0.13847477 0.13847477 0.58457670 1.0 Pr Pr1 1 0.86152523 0.86152523 0.41542330 1.0 Pr Pr2 1 -0.00000000 -0.00000000 0.00000000 1.0 Ni Ni3 1 0.08069065 0.57943071 0.76044993 1.0 Ni Ni4 1 0.57943071 0.57943071 0.76044993 1.0 Ni Ni5 1 0.57943071 0.08069065 0.76044993 1.0 Ni Ni6 1 0.91930935 0.42056929 0.23955007 1.0 Ni Ni7 1 0.42056929 0.42056929 0.23955007 1.0 Ni Ni8 1 0.42056929 0.91930935 0.23955007 1.0 Ni Ni9 1 0.33279999 0.33279999 0.00160104 1.0 Ni Ni10 1 0.66720001 0.66720001 0.99839896 1.0 Ni Ni11 1 0.50000000 0.50000000 0.50000000 1.0