data_[In4As4Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  As  2.1800  1.1500  0.6600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.7764]
_cell_length_b [5.3962]
_cell_length_c [9.6335]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.1138]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [InAsPd3]
_chemical_formula_sum '[In4 As4 Pd12]'
_cell_volume [356.5565]
_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
[
  In  In0  4  0.1650  0.2376  0.5885  1.0
  As  As1  4  0.3326  0.6715  0.3333  1.0
  Pd  Pd2  4  0.0187  0.5785  0.7175  1.0
  Pd  Pd3  4  0.2466  0.7461  0.5499  1.0
  Pd  Pd4  4  0.3669  0.2002  0.4215  1.0
]