data_ZnInAs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.19
_cell_length_b   5.19
_cell_length_c   5.19
_cell_angle_alpha   135.42
_cell_angle_beta   117.38
_cell_angle_gamma   80.09
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnInAs2
_chemical_formula_sum   'Zn1 In1 As2'
_cell_volume   84.22
_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
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  In  In2  1  0.0  0.0  0.97  1.0
  As  As0  1  0.0  0.7  0.27  1.0
  As  As1  1  0.97  0.0  0.7  1.0

data_ZnInAs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.93
_cell_length_b   5.19
_cell_length_c   5.19
_cell_angle_alpha   62.62
_cell_angle_beta   67.71
_cell_angle_gamma   67.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnInAs2
_chemical_formula_sum   'Zn1 In1 As2'
_cell_volume   84.22
_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
  Zn  Zn0  1  0.0  0.0  0.0  1.0
  In  In1  1  0.0  -0.0  0.97  1.0
  As  As2  1  0.0  0.03  0.7  1.0
  As  As3  1  0.7  0.0  0.58  1.0

Zn In As As