# generated using pymatgen data_Pr(BC)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.89270627 _cell_length_b 5.38781869 _cell_length_c 5.38781869 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr(BC)2 _chemical_formula_sum 'Pr2 B4 C4' _cell_volume 112.99977522 _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 0.00000000 0.50000000 0.50000000 1.0 Pr Pr1 1 0.00000000 -0.00000000 -0.00000000 1.0 B B2 1 0.50000000 0.63779183 0.13779183 1.0 B B3 1 0.50000000 0.86220817 0.63779183 1.0 B B4 1 0.50000000 0.36220917 0.86220817 1.0 B B5 1 0.50000000 0.13779183 0.36220917 1.0 C C6 1 0.50000000 0.66080392 0.83919608 1.0 C C7 1 0.50000000 0.83919608 0.33919608 1.0 C C8 1 0.50000000 0.16080392 0.66080392 1.0 C C9 1 0.50000000 0.33919608 0.16080392 1.0