data_[In3Sb2As3]
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 [P1]
_cell_length_a [4.4484]
_cell_length_b [7.0268]
_cell_length_c [20.7044]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [104.7409]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [In3Sb2As3]
_chemical_formula_sum '[In3 Sb2 As3]'
_cell_volume [625.8795]
_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  1  0.0027  0.3278  0.3675  1
  In  In1  1  0.0263  0.9317  0.4377  1
  In  In2  1  0.9756  0.4317  0.6430  1
  Sb  Sb3  1  0.3337  0.5467  0.5102  1
  Sb  Sb4  1  0.8573  0.8316  0.5766  1
  As  As5  1  0.4154  0.7137  0.3948  1
  As  As6  1  0.5133  0.0997  0.5895  1
  As  As7  1  0.5633  0.2423  0.4805  1
]