# generated using pymatgen data_Pr3Ni13B2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.04814355 _cell_length_b 5.04627845 _cell_length_c 10.95981500 _cell_angle_alpha 89.99972793 _cell_angle_beta 90.00054409 _cell_angle_gamma 120.01224449 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr3Ni13B2 _chemical_formula_sum 'Pr3 Ni13 B2' _cell_volume 241.75928578 _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 Pr Pr0 1 0.99998500 0.00000000 0.99994200 1.0 Pr Pr1 1 0.99997400 0.00000000 0.32957100 1.0 Pr Pr2 1 0.00000900 0.00000000 0.67048900 1.0 Ni Ni3 1 0.50000200 0.00000000 0.50001000 1.0 Ni Ni4 1 0.50000200 0.50000100 0.50000300 1.0 Ni Ni5 1 0.00000100 0.49999900 0.50000300 1.0 Ni Ni6 1 0.33331900 0.66666300 0.31900500 1.0 Ni Ni7 1 0.66665600 0.33333700 0.31900500 1.0 Ni Ni8 1 0.66668900 0.33335700 0.68099500 1.0 Ni Ni9 1 0.33333300 0.66664300 0.68099500 1.0 Ni Ni10 1 0.49998800 0.00000000 0.13314000 1.0 Ni Ni11 1 0.49998900 0.49999900 0.13312900 1.0 Ni Ni12 1 0.99999000 0.50000100 0.13312900 1.0 Ni Ni13 1 0.49999200 0.00000000 0.86685700 1.0 Ni Ni14 1 0.49999200 0.49999900 0.86685600 1.0 Ni Ni15 1 0.99999300 0.50000100 0.86685600 1.0 B B16 1 0.33330500 0.66662500 0.00000700 1.0 B B17 1 0.66668000 0.33337500 0.00000700 1.0