data_Na2DyPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.23
_cell_length_b   7.01
_cell_length_c   9.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.87
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Na2DyPCO7
_chemical_formula_sum   'Na4 Dy2 P2 C2 O14'
_cell_volume   339.97
_cell_formula_units_Z   2
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
  Na  Na0  1  0.9  0.49  0.33  1.0
  Na  Na1  1  0.9  0.01  0.33  1.0
  Na  Na2  1  0.18  0.52  0.95  1.0
  Na  Na3  1  0.18  1.0  0.95  1.0
  Dy  Dy4  1  0.08  0.26  0.85  1.0
  Dy  Dy5  1  0.01  0.75  0.43  1.0
  P  P6  1  0.46  0.75  0.4  1.0
  P  P7  1  0.63  0.26  0.87  1.0
  C  C8  1  0.27  0.26  0.61  1.0
  C  C9  1  0.81  0.75  0.67  1.0
  O  O10  1  0.53  0.75  0.7  1.0
  O  O11  1  0.1  0.26  0.01  1.0
  O  O12  1  0.31  0.26  0.77  1.0
  O  O13  1  0.87  0.48  0.06  1.0
  O  O14  1  0.87  0.02  0.06  1.0
  O  O15  1  1.0  0.26  0.41  1.0
  O  O16  1  0.02  0.75  0.49  1.0
  O  O17  1  0.07  0.26  0.79  1.0
  O  O18  1  0.09  0.75  0.87  1.0
  O  O19  1  0.21  0.99  0.21  1.0
  O  O20  1  0.21  0.53  0.21  1.0
  O  O21  1  0.78  0.75  0.51  1.0
  O  O22  1  0.99  0.75  0.26  1.0
  O  O23  1  0.56  0.26  0.58  1.0

data_Na2DyPCO7
_symmetry_space_group_name_H-M   P2_1/m
_cell_length_a   5.23
_cell_length_b   7.01
_cell_length_c   9.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.87
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   11
_chemical_formula_structural   Na2DyPCO7
_chemical_formula_sum   'Na4 Dy2 P2 C2 O14'
_cell_volume   339.97
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, -z'
  3  '-x, y+1/2, -z'
  4  'x, -y+1/2, 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
  Na  Na0  4  0.14  0.51  0.81  1.0
  Dy  Dy1  2  0.04  0.25  0.71  1.0
  P  P2  2  0.41  0.75  0.26  1.0
  C  C3  2  0.23  0.25  0.47  1.0
  O  O4  4  0.17  0.52  0.08  1.0
  O  O5  2  0.03  0.25  0.65  1.0
  O  O6  2  0.05  0.75  0.73  1.0
  O  O7  2  0.05  0.25  0.87  1.0
  O  O8  2  0.26  0.25  0.63  1.0
  O  O9  2  0.48  0.75  0.56  1.0

Na Na Na Na Dy Dy P P C C O O O O O O O O O O O O O O