data_[Ce8Fe6C10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Fe  1.8300  1.4000  0.8525
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.5974]
_cell_length_b [3.7527]
_cell_length_c [9.2820]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.8624]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ce4Fe3C5]
_chemical_formula_sum '[Ce8 Fe6 C10]'
_cell_volume [369.4364]
_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  4  0.0974  0.0000  0.9012  1.0
  Ce  Ce1  4  0.2400  0.5000  0.6658  1.0
  Fe  Fe2  4  0.0459  0.5000  0.3297  1.0
  Fe  Fe3  2  0.0000  0.0000  0.5000  1.0
  C  C4  4  0.1066  0.5000  0.1714  1.0
  C  C5  4  0.2009  0.5000  0.1170  1.0
  C  C6  2  0.0000  0.5000  0.5000  1.0
]