# generated using pymatgen data_Ce5Re2BC6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.54889343 _cell_length_b 8.54889347 _cell_length_c 3.47984550 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 124.93573426 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce5Re2BC6 _chemical_formula_sum 'Ce5 Re2 B1 C6' _cell_volume 208.48987711 _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 Ce Ce0 1 0.50000000 0.50000000 0.00000000 1.0 Ce Ce1 1 0.06166548 0.31867667 0.50000000 1.0 Ce Ce2 1 0.93833452 0.68132333 0.50000000 1.0 Ce Ce3 1 0.68132333 0.93833452 0.50000000 1.0 Ce Ce4 1 0.31867667 0.06166548 0.50000000 1.0 Re Re5 1 0.71293797 0.28706203 0.00000000 1.0 Re Re6 1 0.28706203 0.71293797 0.00000000 1.0 B B7 1 0.00000000 0.00000000 0.00000000 1.0 C C8 1 0.63315635 0.36684365 0.50000000 1.0 C C9 1 0.36684365 0.63315635 0.50000000 1.0 C C10 1 0.18706629 0.18706629 0.00000000 1.0 C C11 1 0.81293371 0.81293371 0.00000000 1.0 C C12 1 0.00000000 0.50000000 0.00000000 1.0 C C13 1 0.50000000 0.00000000 0.00000000 1.0