data_[Y10Sc2As12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Sc  1.3600  1.6000  0.8850
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.0816]
_cell_length_b [12.2609]
_cell_length_c [7.0787]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.4978]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Y5ScAs6]
_chemical_formula_sum '[Y10 Sc2 As12]'
_cell_volume [579.3744]
_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
[
  Y  Y0  4  0.0000  0.1685  0.5000  1
  Y  Y1  4  0.0000  0.3339  0.0000  1
  Y  Y2  2  0.0000  0.5000  0.5000  1
  Sc  Sc3  2  0.0000  0.0000  0.0000  1
  As  As4  8  0.2441  0.1628  0.2445  1
  As  As5  4  0.2433  0.0000  0.7541  1
]