# generated using pymatgen
data_Cu4P2O9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.26249263
_cell_length_b   7.53373228
_cell_length_c   8.01003258
_cell_angle_alpha   99.32326044
_cell_angle_beta   112.25526268
_cell_angle_gamma   97.98631152
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu4P2O9
_chemical_formula_sum   'Cu8 P4 O18'
_cell_volume   336.73770614
_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  1  0.88426600  0.10475681  0.75761339  1.0
  Cu  Cu1  1  0.40777082  0.12510680  0.76312617  1.0
  Cu  Cu2  1  0.11573400  0.89524319  0.24238661  1.0
  Cu  Cu3  1  0.65588746  0.38458180  0.58909623  1.0
  Cu  Cu4  1  0.34411254  0.61541820  0.41090377  1.0
  Cu  Cu5  1  0.59222918  0.87489320  0.23687383  1.0
  Cu  Cu6  1  0.15407518  0.67047192  0.93683783  1.0
  Cu  Cu7  1  0.84592482  0.32952808  0.06316217  1.0
  P  P8  1  0.99957424  0.78407518  0.57902669  1.0
  P  P9  1  0.37124081  0.26398103  0.15086847  1.0
  P  P10  1  0.62875919  0.73601897  0.84913153  1.0
  P  P11  1  0.00042576  0.21592482  0.42097331  1.0
  O  O12  1  0.51290872  0.58404470  0.66609536  1.0
  O  O13  1  0.34538333  0.07254531  0.19124221  1.0
  O  O14  1  0.13180264  0.30040611  0.02771252  1.0
  O  O15  1  0.48709128  0.41595530  0.33390464  1.0
  O  O16  1  0.65461667  0.92745469  0.80875779  1.0
  O  O17  1  0.14945144  0.77982315  0.46449617  1.0
  O  O18  1  0.30030069  0.72725474  0.20394775  1.0
  O  O19  1  0.69969931  0.27274526  0.79605225  1.0
  O  O20  1  0.00355524  0.62176720  0.67150388  1.0
  O  O21  1  0.74883975  0.79638773  0.46488683  1.0
  O  O22  1  0.86819736  0.69959389  0.97228748  1.0
  O  O23  1  0.85054856  0.22017685  0.53550383  1.0
  O  O24  1  0.11783576  0.96621237  0.73916816  1.0
  O  O25  1  0.99644476  0.37823280  0.32849612  1.0
  O  O26  1  0.47731769  0.72636803  0.96141848  1.0
  O  O27  1  0.88216424  0.03378763  0.26083184  1.0
  O  O28  1  0.25116025  0.20361227  0.53511317  1.0
  O  O29  1  0.52268231  0.27363197  0.03858152  1.0