data_[Y8Bi12Mo16C12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Bi  2.0200  1.6000  1.0350
  Mo  2.1600  1.4500  0.7750
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.1033]
_cell_length_b [5.9912]
_cell_length_c [14.7446]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.4670]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Y2Bi3Mo4C3]
_chemical_formula_sum '[Y8 Bi12 Mo16 C12]'
_cell_volume [889.7977]
_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  0.0652  0.4211  0.3999  1
  Bi  Bi1  8  0.1814  0.3682  0.7264  1
  Bi  Bi2  4  0.0000  0.0579  0.2500  1
  Mo  Mo3  8  0.0850  0.1001  0.5645  1
  Mo  Mo4  8  0.2458  0.0697  0.9417  1
  C  C5  8  0.0891  0.2374  0.0027  1
  C  C6  4  0.2500  0.2500  0.5000  1
]