data_[Y16Lu8Ga12C12]
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
  Ga  1.8100  1.3000  0.7600
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.6190]
_cell_length_b [6.1266]
_cell_length_c [16.0066]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.6871]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Y4Lu2(GaC)3]
_chemical_formula_sum '[Y16 Lu8 Ga12 C12]'
_cell_volume [1015.9304]
_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  0.1118  0.0834  0.5857  1
  Y  Y1  8  0.2216  0.0836  0.9143  1
  Lu  Lu2  8  0.0544  0.4183  0.4138  1
  Ga  Ga3  8  0.2368  0.3462  0.7499  1
  Ga  Ga4  4  0.0000  0.0727  0.7500  1
  C  C5  8  0.0797  0.2611  0.0004  1
  C  C6  4  0.2500  0.2500  0.5000  1
]