data_[Sc4Si4W4C2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Si  1.9000  1.1000  0.5400
  W  2.3600  1.3500  0.7667
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.0588]
_cell_length_b [3.6354]
_cell_length_c [6.8572]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.5928]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sc2Si2W2C]
_chemical_formula_sum '[Sc4 Si4 W4 C2]'
_cell_volume [226.9408]
_cell_formula_units_Z [2]
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
[
  Sc  Sc0  4  0.0686  0.5000  0.2849  1.0
  Si  Si1  4  0.1289  0.0000  0.6458  1.0
  W  W2  4  0.2060  0.0000  0.0894  1.0
  C  C3  2  0.0000  0.0000  0.0000  1.0
]