data_Cd2InP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.45
_cell_length_b   5.45
_cell_length_c   5.45
_cell_angle_alpha   137.61
_cell_angle_beta   121.04
_cell_angle_gamma   75.28
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2InP
_chemical_formula_sum   'Cd2 In1 P1'
_cell_volume   91.16
_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
  Cd  Cd0  1  0.97  0.0  0.93  1.0
  Cd  Cd1  1  0.0  0.68  0.39  1.0
  In  In2  1  0.0  0.0  0.31  1.0
  P  P3  1  0.0  0.0  0.0  1.0

data_Cd2InP
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.94
_cell_length_b   5.36
_cell_length_c   5.45
_cell_angle_alpha   119.48
_cell_angle_beta   111.2
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2InP
_chemical_formula_sum   'Cd2 In1 P1'
_cell_volume   91.16
_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
  Cd  Cd0  1  0.04  0.07  0.04  1.0
  Cd  Cd1  1  0.61  0.29  0.29  1.0
  In  In2  1  0.69  0.69  0.69  1.0
  P  P3  1  0.0  0.0  0.0  1.0

Cd Cd In P