data_Cd2InP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.8
_cell_length_b   4.05
_cell_length_c   5.4
_cell_angle_alpha   90.0
_cell_angle_beta   112.72
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2InP
_chemical_formula_sum   'Cd2 In1 P1'
_cell_volume   96.79
_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  0.3  0.02  0.89  1.0
  Cd  Cd1  1  0.41  0.02  0.09  1.0
  In  In2  1  0.36  0.0  0.49  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   4.05
_cell_length_b   4.8
_cell_length_c   5.4
_cell_angle_alpha   112.72
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2InP
_chemical_formula_sum   'Cd2 In1 P1'
_cell_volume   96.79
_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  0.98  0.59  0.91  1.0
  Cd  Cd1  1  0.98  0.7  0.11  1.0
  In  In2  1  0.0  0.64  0.51  1.0
  P  P3  1  0.0  0.0  0.0  1.0

Cd Cd In P