data_NaPrPCO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.36
_cell_length_b   7.21
_cell_length_c   9.8
_cell_angle_alpha   90.0
_cell_angle_beta   90.76
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaPrPCO7
_chemical_formula_sum   'Na2 Pr2 P2 C2 O14'
_cell_volume   378.74
_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  0.14  0.36  0.56  1.0
  Na  Na1  1  0.1  0.97  0.24  1.0
  Pr  Pr2  1  0.1  0.61  0.15  1.0
  Pr  Pr3  1  0.13  0.0  0.64  1.0
  P  P4  1  0.77  0.95  0.72  1.0
  P  P5  1  0.46  0.55  0.08  1.0
  C  C6  1  0.76  0.22  0.12  1.0
  C  C7  1  0.48  0.61  0.68  1.0
  O  O8  1  0.53  0.86  0.25  1.0
  O  O9  1  0.96  0.16  0.64  1.0
  O  O10  1  0.78  0.07  0.28  1.0
  O  O11  1  0.14  0.67  0.5  1.0
  O  O12  1  0.44  0.2  0.33  1.0
  O  O13  1  0.03  0.4  0.58  1.0
  O  O14  1  0.22  0.15  0.68  1.0
  O  O15  1  0.01  0.75  0.11  1.0
  O  O16  1  0.21  0.8  0.21  1.0
  O  O17  1  0.8  0.8  0.47  1.0
  O  O18  1  0.1  0.28  0.3  1.0
  O  O19  1  0.45  0.46  0.51  1.0
  O  O20  1  0.28  0.55  0.15  1.0
  O  O21  1  0.7  0.46  0.55  1.0

data_NaPrPCO7
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.36
_cell_length_b   7.21
_cell_length_c   9.8
_cell_angle_alpha   90.0
_cell_angle_beta   90.76
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaPrPCO7
_chemical_formula_sum   'Na2 Pr2 P2 C2 O14'
_cell_volume   378.74
_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  0.1  0.97  0.24  1.0
  Na  Na1  1  0.14  0.36  0.56  1.0
  Pr  Pr2  1  0.1  0.61  0.15  1.0
  Pr  Pr3  1  0.13  0.0  0.64  1.0
  P  P4  1  0.46  0.55  0.08  1.0
  P  P5  1  0.77  0.95  0.72  1.0
  C  C6  1  0.48  0.61  0.68  1.0
  C  C7  1  0.76  0.22  0.12  1.0
  O  O8  1  0.01  0.75  0.11  1.0
  O  O9  1  0.03  0.4  0.58  1.0
  O  O10  1  0.1  0.28  0.3  1.0
  O  O11  1  0.14  0.67  0.5  1.0
  O  O12  1  0.21  0.8  0.21  1.0
  O  O13  1  0.22  0.15  0.68  1.0
  O  O14  1  0.28  0.55  0.15  1.0
  O  O15  1  0.44  0.2  0.33  1.0
  O  O16  1  0.45  0.46  0.51  1.0
  O  O17  1  0.53  0.86  0.25  1.0
  O  O18  1  0.7  0.46  0.55  1.0
  O  O19  1  0.78  0.07  0.28  1.0
  O  O20  1  0.8  0.8  0.47  1.0
  O  O21  1  0.96  0.16  0.64  1.0

Na Na Pr Pr P P C C O O O O O O O O O O O O O O
Na Na Pr Pr P P C C O O O O O O O O O O O O O O 0 13 o o o 0 11 o o o 1 16 o o o 1 10 - + o 1 18 o + o 2 20 o o o 2 15 o o o 2 16 o o o 3 9 - o o 3 14 o o o 3 4 - - o 3 17 - - o 4 9 o + o 4 17 o o o 5 20 o o o 6 10 o o o 7 19 o o o 7 21 o o o 7 11 o o o 8 16 o o o 8 10 o + o 8 17 o o o 9 14 + o o 10 12 o o o 10 18 + o o 10 17 o - o 11 13 o o o 11 17 - o o 11 19 o o o 12 18 o o o 15 16 o o o 17 21 o o o 19 21 o o o 