# generated using pymatgen data_CaCeC4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.14465339 _cell_length_b 4.14465339 _cell_length_c 5.40762032 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 80.27556201 _symmetry_Int_Tables_number 1 _chemical_formula_structural CaCeC4 _chemical_formula_sum 'Ca1 Ce1 C4' _cell_volume 91.55819174 _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 Ca Ca0 1 0.00000000 0.00000000 0.00000000 1.0 Ce Ce1 1 0.50000000 0.50000000 0.50000000 1.0 C C2 1 0.39897400 0.39897400 0.00000000 1.0 C C3 1 0.89737000 0.89737000 0.50000000 1.0 C C4 1 0.10263000 0.10263000 0.50000000 1.0 C C5 1 0.60102600 0.60102600 0.00000000 1.0