data_[Mn8Co12W16C12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Co  1.8800  1.3500  0.7683
  W  2.3600  1.3500  0.7667
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.8487]
_cell_length_b [5.1015]
_cell_length_c [13.6537]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.9030]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Mn2Co3W4C3]
_chemical_formula_sum '[Mn8 Co12 W16 C12]'
_cell_volume [600.7917]
_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
[
  Mn  Mn0  8  0.0490  0.4171  0.9008  1
  Co  Co1  8  0.2414  0.3476  0.2500  1
  Co  Co2  4  0.0000  0.0812  0.2500  1
  W  W3  8  0.1134  0.0877  0.0898  1
  W  W4  8  0.2217  0.0831  0.4100  1
  C  C5  8  0.0798  0.2605  0.5000  1
  C  C6  4  0.2500  0.2500  0.0000  1
]