data_[Cs8Zn12P16O56]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Zn  1.6500  1.3500  0.8800
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [13.2734]
_cell_length_b [7.3296]
_cell_length_c [14.5192]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.0710]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Cs2Zn3(P2O7)2]
_chemical_formula_sum '[Cs8 Zn12 P16 O56]'
_cell_volume [1412.3086]
_cell_formula_units_Z [4]
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
[
  Cs  Cs0  4  0.0907  0.2440  0.0264  1
  Cs  Cs1  4  0.3979  0.0152  0.3230  1
  Zn  Zn2  4  0.1156  0.0525  0.7633  1
  Zn  Zn3  4  0.2456  0.6346  0.6297  1
  Zn  Zn4  4  0.3956  0.5093  0.3836  1
  P  P5  4  0.1104  0.0078  0.3096  1
  P  P6  4  0.1791  0.7102  0.4302  1
  P  P7  4  0.3280  0.5109  0.1769  1
  P  P8  4  0.3921  0.2033  0.0692  1
  O  O9  4  0.0027  0.0171  0.6788  1
  O  O10  4  0.1049  0.5942  0.3733  1
  O  O11  4  0.1448  0.2061  0.3165  1
  O  O12  4  0.1511  0.6962  0.5314  1
  O  O13  4  0.1518  0.5984  0.7294  1
  O  O14  4  0.1597  0.5760  0.9048  1
  O  O15  4  0.2144  0.0149  0.6680  1
  O  O16  4  0.2903  0.6817  0.4112  1
  O  O17  4  0.2953  0.1098  0.0987  1
  O  O18  4  0.3586  0.7128  0.1706  1
  O  O19  4  0.3754  0.0788  0.5848  1
  O  O20  4  0.3779  0.0873  0.7586  1
  O  O21  4  0.4110  0.1950  0.9658  1
  O  O22  4  0.4828  0.1521  0.1295  1
]