# generated using pymatgen data_Ce3MnCrC6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.23868852 _cell_length_b 8.23868785 _cell_length_c 5.15419338 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999862 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce3MnCrC6 _chemical_formula_sum 'Ce6 Mn2 Cr2 C12' _cell_volume 302.97547781 _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 Ce Ce0 1 0.61651787 0.69048077 0.75000000 1.0 Ce Ce1 1 0.92603810 0.61651787 0.25000000 1.0 Ce Ce2 1 0.69048077 0.07396190 0.25000000 1.0 Ce Ce3 1 0.30951923 0.92603810 0.75000000 1.0 Ce Ce4 1 0.07396190 0.38348213 0.75000000 1.0 Ce Ce5 1 0.38348213 0.30951923 0.25000000 1.0 Mn Mn6 1 0.66666700 0.33333300 0.75000000 1.0 Mn Mn7 1 0.33333300 0.66666700 0.25000000 1.0 Cr Cr8 1 0.00000000 0.00000000 0.50000000 1.0 Cr Cr9 1 0.00000000 0.00000000 0.00000000 1.0 C C10 1 0.95520219 0.77274661 0.75000000 1.0 C C11 1 0.18245558 0.95520219 0.25000000 1.0 C C12 1 0.77274661 0.81754442 0.25000000 1.0 C C13 1 0.22725339 0.18245558 0.75000000 1.0 C C14 1 0.81754442 0.04479781 0.75000000 1.0 C C15 1 0.04479781 0.22725339 0.25000000 1.0 C C16 1 0.86632813 0.58059851 0.75000000 1.0 C C17 1 0.28572862 0.86632813 0.25000000 1.0 C C18 1 0.58059851 0.71427138 0.25000000 1.0 C C19 1 0.41940149 0.28572862 0.75000000 1.0 C C20 1 0.13367187 0.41940149 0.25000000 1.0 C C21 1 0.71427138 0.13367187 0.75000000 1.0