data_[La8Ru4C8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ru  2.2000  1.3000  0.6610
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [6.5918]
_cell_length_b [5.5034]
_cell_length_c [10.3238]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [La2RuC2]
_chemical_formula_sum '[La8 Ru4 C8]'
_cell_volume [374.5179]
_cell_formula_units_Z [4]
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
[
  La  La0  4  0.0190  0.7500  0.7191  1
  La  La1  4  0.1976  0.7500  0.0470  1
  Ru  Ru2  4  0.2331  0.7500  0.3561  1
  C  C3  4  0.0252  0.2500  0.7467  1
  C  C4  4  0.1886  0.2500  0.0367  1
]