# generated using pymatgen
data_Cu2PO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.99624048
_cell_length_b   6.19315973
_cell_length_c   9.23363020
_cell_angle_alpha   73.98347303
_cell_angle_beta   84.14997349
_cell_angle_gamma   79.67638284
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu2PO4
_chemical_formula_sum   'Cu8 P4 O16'
_cell_volume   323.75125605
_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
  Cu  Cu0  1  0.80794688  0.67189544  0.02990494  1.0
  Cu  Cu1  1  0.19205312  0.32810456  0.97009506  1.0
  Cu  Cu2  1  0.97483975  0.88330838  0.27163325  1.0
  Cu  Cu3  1  0.02516025  0.11669162  0.72836675  1.0
  Cu  Cu4  1  0.45138204  0.61575929  0.36553632  1.0
  Cu  Cu5  1  0.54861796  0.38424071  0.63446368  1.0
  Cu  Cu6  1  0.56453423  0.81192818  0.65449223  1.0
  Cu  Cu7  1  0.43546577  0.18807182  0.34550777  1.0
  P  P8  1  0.12071231  0.69868853  0.61748592  1.0
  P  P9  1  0.87928769  0.30131147  0.38251408  1.0
  P  P10  1  0.29072747  0.80506363  0.00096153  1.0
  P  P11  1  0.70927253  0.19493637  0.99903847  1.0
  O  O12  1  0.80493641  0.95045219  0.09106111  1.0
  O  O13  1  0.19506359  0.04954781  0.90893889  1.0
  O  O14  1  0.75927819  0.53944190  0.29898675  1.0
  O  O15  1  0.24072181  0.46055810  0.70101325  1.0
  O  O16  1  0.13445893  0.64575205  0.97765600  1.0
  O  O17  1  0.86554107  0.35424795  0.02234400  1.0
  O  O18  1  0.15113276  0.71253215  0.44599777  1.0
  O  O19  1  0.84886724  0.28746785  0.55400223  1.0
  O  O20  1  0.87592021  0.74351876  0.67083819  1.0
  O  O21  1  0.12407979  0.25648124  0.32916181  1.0
  O  O22  1  0.52738620  0.73942643  0.93717395  1.0
  O  O23  1  0.47261380  0.26057357  0.06282605  1.0
  O  O24  1  0.27926266  0.80135616  0.16813178  1.0
  O  O25  1  0.72073734  0.19864384  0.83186822  1.0
  O  O26  1  0.24500327  0.88464503  0.64553060  1.0
  O  O27  1  0.75499673  0.11535497  0.35446940  1.0