data_Cd2Cu(PO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.87
_cell_length_b   5.71
_cell_length_c   6.87
_cell_angle_alpha   74.24
_cell_angle_beta   87.05
_cell_angle_gamma   69.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2Cu(PO4)2
_chemical_formula_sum   'Cd2 Cu1 P2 O8'
_cell_volume   172.49
_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  Cd11  1  0.11  0.08  0.02  1.0
  Cd  Cd12  1  0.09  0.14  0.58  1.0
  Cu  Cu10  1  0.0  0.0  0.0  1.0
  P  P8  1  0.48  0.06  0.41  1.0
  P  P9  1  0.71  0.16  0.19  1.0
  O  O0  1  0.82  0.29  0.31  1.0
  O  O1  1  0.38  0.93  0.29  1.0
  O  O2  1  0.29  0.2  0.07  1.0
  O  O3  1  0.91  0.02  0.53  1.0
  O  O4  1  0.24  0.22  0.54  1.0
  O  O5  1  0.81  0.74  0.13  1.0
  O  O6  1  0.39  0.48  0.47  1.0
  O  O7  1  0.95  0.0  0.06  1.0

data_Cd2Cu(PO4)2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.87
_cell_length_b   5.71
_cell_length_c   6.87
_cell_angle_alpha   74.24
_cell_angle_beta   87.05
_cell_angle_gamma   69.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cd2Cu(PO4)2
_chemical_formula_sum   'Cd2 Cu1 P2 O8'
_cell_volume   172.49
_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  0.09  0.14  0.58  1.0
  Cd  Cd1  1  0.11  0.08  0.02  1.0
  Cu  Cu2  1  0.0  0.0  0.0  1.0
  P  P3  1  0.48  0.06  0.41  1.0
  P  P4  1  0.71  0.16  0.19  1.0
  O  O5  1  0.24  0.22  0.54  1.0
  O  O6  1  0.29  0.2  0.07  1.0
  O  O7  1  0.38  0.93  0.29  1.0
  O  O8  1  0.39  0.48  0.47  1.0
  O  O9  1  0.81  0.74  0.13  1.0
  O  O10  1  0.82  0.29  0.31  1.0
  O  O11  1  0.91  0.02  0.53  1.0
  O  O12  1  0.95  0.0  0.06  1.0

Cd Cd Cu P P O O O O O O O O