data_[Lu16Cr8Sn12C12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Lu  1.2700  1.7500  1.0010
  Cr  1.6600  1.4000  0.9400
  Sn  1.9600  1.4500  0.8300
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.9662]
_cell_length_b [5.8208]
_cell_length_c [14.8501]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.2581]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Lu4Cr2(SnC)3]
_chemical_formula_sum '[Lu16 Cr8 Sn12 C12]'
_cell_volume [844.8978]
_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
[
  Lu  Lu0  8  0.1101  0.0765  0.5899  1
  Lu  Lu1  8  0.2189  0.0855  0.9104  1
  Cr  Cr2  8  0.0722  0.4109  0.4371  1
  Sn  Sn3  8  0.1529  0.4293  0.7529  1
  Sn  Sn4  4  0.0000  0.1305  0.2500  1
  C  C5  8  0.0737  0.2791  0.0003  1
  C  C6  4  0.2500  0.2500  0.5000  1
]