# generated using pymatgen data_Co3ReB4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.03195400 _cell_length_b 4.12595100 _cell_length_c 5.41483763 _cell_angle_alpha 88.58867759 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Co3ReB4 _chemical_formula_sum 'Co3 Re1 B4' _cell_volume 67.71741105 _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 Co Co0 1 0.00000000 0.86976900 0.82653800 1.0 Co Co1 1 0.50000000 0.37156400 0.67992200 1.0 Co Co2 1 0.50000000 0.12718100 0.17373700 1.0 Re Re3 1 0.00000000 0.63062600 0.32078400 1.0 B B4 1 0.00000000 0.12835600 0.47960800 1.0 B B5 1 0.00000000 0.36690100 0.95529400 1.0 B B6 1 0.50000000 0.90009300 0.54969100 1.0 B B7 1 0.50000000 0.60550900 0.01442600 1.0