data_InAg2As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.35
_cell_length_b   5.35
_cell_length_c   5.06
_cell_angle_alpha   96.16
_cell_angle_beta   96.16
_cell_angle_gamma   33.88
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InAg2As
_chemical_formula_sum   'In1 Ag2 As1'
_cell_volume   80.18
_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  In3  1  0.15  0.0  0.8  1.0
  Ag  Ag0  1  0.04  0.0  0.04  1.0
  Ag  Ag1  1  0.51  0.0  0.27  1.0
  As  As2  1  0.79  0.0  0.44  1.0

data_InAg2As
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.12
_cell_length_b   5.06
_cell_length_c   5.35
_cell_angle_alpha   96.16
_cell_angle_beta   106.94
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InAg2As
_chemical_formula_sum   'In1 Ag2 As1'
_cell_volume   80.18
_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  0.0  0.8  0.15  1.0
  Ag  Ag1  1  0.0  0.04  0.04  1.0
  Ag  Ag2  1  0.0  0.27  0.51  1.0
  As  As3  1  0.0  0.44  0.79  1.0

In Ag Ag As