# generated using pymatgen data_Tb6Cr3FeC12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.11795496 _cell_length_b 8.11795604 _cell_length_c 4.99589224 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999561 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tb6Cr3FeC12 _chemical_formula_sum 'Tb6 Cr3 Fe1 C12' _cell_volume 285.12614714 _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 Tb Tb0 1 0.62403876 0.68523905 0.75000000 1.0 Tb Tb1 1 0.93488334 0.61902965 0.25000000 1.0 Tb Tb2 1 0.68414532 0.06511666 0.25000000 1.0 Tb Tb3 1 0.31476095 0.93879971 0.75000000 1.0 Tb Tb4 1 0.06120029 0.37596124 0.75000000 1.0 Tb Tb5 1 0.38097035 0.31585468 0.25000000 1.0 Cr Cr6 1 0.00000000 0.00000000 0.49911111 1.0 Cr Cr7 1 0.00000000 0.00000000 0.00088889 1.0 Cr Cr8 1 0.66666700 0.33333300 0.75000000 1.0 Fe Fe9 1 0.33333300 0.66666700 0.25000000 1.0 C C10 1 0.96365796 0.77444806 0.75000000 1.0 C C11 1 0.19376919 0.95955451 0.25000000 1.0 C C12 1 0.76578732 0.80623081 0.25000000 1.0 C C13 1 0.22555194 0.18921090 0.75000000 1.0 C C14 1 0.81078910 0.03634204 0.75000000 1.0 C C15 1 0.04044549 0.23421268 0.25000000 1.0 C C16 1 0.86368635 0.57826872 0.75000000 1.0 C C17 1 0.29030091 0.86377670 0.25000000 1.0 C C18 1 0.57347479 0.70969909 0.25000000 1.0 C C19 1 0.42173128 0.28541764 0.75000000 1.0 C C20 1 0.13622330 0.42652521 0.25000000 1.0 C C21 1 0.71458236 0.13631365 0.75000000 1.0