data_[Y8Lu16Sn12C12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Lu  1.2700  1.7500  1.0010
  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 [10.7138]
_cell_length_b [6.1855]
_cell_length_c [15.9036]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.9938]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Y2Lu4(SnC)3]
_chemical_formula_sum '[Y8 Lu16 Sn12 C12]'
_cell_volume [1026.9596]
_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
[
  Y  Y0  8  0.0525  0.4174  0.4098  1
  Lu  Lu1  8  0.1105  0.0847  0.5814  1
  Lu  Lu2  8  0.2236  0.0825  0.9186  1
  Sn  Sn3  8  0.1844  0.3981  0.7502  1
  Sn  Sn4  4  0.0000  0.0481  0.2500  1
  C  C5  8  0.0840  0.2480  1.0000  1
  C  C6  4  0.2500  0.2500  0.5000  1
]