data_[Cu8P6O24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [7.3997]
_cell_length_b [7.8727]
_cell_length_c [9.5520]
_cell_angle_alpha [109.5810]
_cell_angle_beta [111.7814]
_cell_angle_gamma [92.2782]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Cu4(PO4)3]
_chemical_formula_sum '[Cu8 P6 O24]'
_cell_volume [478.2050]
_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
[
  Cu  Cu0  2  0.0147  0.7941  0.4579  1
  Cu  Cu1  2  0.2626  0.8977  0.9017  1
  Cu  Cu2  2  0.2643  0.5243  0.9182  1
  Cu  Cu3  2  0.3027  0.6148  0.2945  1
  P  P4  2  0.0195  0.2496  0.9387  1
  P  P5  2  0.3024  0.5448  0.6077  1
  P  P6  2  0.3923  0.1386  0.7447  1
  O  O7  2  0.0726  0.7293  0.2295  1
  O  O8  2  0.0953  0.0726  0.9241  1
  O  O9  2  0.1371  0.7387  0.9844  1
  O  O10  2  0.1711  0.0569  0.6202  1
  O  O11  2  0.1721  0.3533  0.5147  1
  O  O12  2  0.1906  0.4241  0.0513  1
  O  O13  2  0.2380  0.6666  0.5031  1
  O  O14  2  0.2707  0.6422  0.7701  1
  O  O15  2  0.4150  0.3402  0.8633  1
  O  O16  2  0.4482  0.0126  0.8454  1
  O  O17  2  0.4700  0.8519  0.3394  1
  O  O18  2  0.4765  0.4554  0.3482  1
]