data_[In3Sb1As2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Sb  2.0500  1.4500  0.8300
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [5.3709]
_cell_length_b [5.5428]
_cell_length_c [18.2922]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [In3SbAs2]
_chemical_formula_sum '[In3 Sb1 As2]'
_cell_volume [544.5585]
_cell_formula_units_Z [1]
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  2  0.0000  0.2583  0.4245  1
  In  In1  1  0.5000  0.0000  0.4483  1
  Sb  Sb2  1  0.0000  0.0000  0.5703  1
  As  As3  1  0.5000  0.0000  0.6045  1
  As  As4  1  0.5000  0.5000  0.5280  1
]