data_InGeAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.41
_cell_length_b   5.41
_cell_length_c   3.13
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.41
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InGeAs2
_chemical_formula_sum   'In1 Ge1 As2'
_cell_volume   86.32
_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  0.13  0.0  0.0  1.0
  Ge  Ge2  1  0.0  0.0  0.0  1.0
  As  As0  1  0.56  0.79  0.56  1.0
  As  As1  1  0.56  0.21  0.56  1.0

data_InGeAs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.13
_cell_length_b   5.41
_cell_length_c   5.41
_cell_angle_alpha   109.41
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InGeAs2
_chemical_formula_sum   'In1 Ge1 As2'
_cell_volume   86.32
_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  0.13  0.0  1.0
  Ge  Ge1  1  0.0  0.0  0.0  1.0
  As  As2  1  0.56  0.56  0.21  1.0
  As  As3  1  0.56  0.56  0.79  1.0

In Ge As As