# generated using pymatgen
data_CuP2(HO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.92568500
_cell_length_b   7.44205500
_cell_length_c   7.63276902
_cell_angle_alpha   79.37133114
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuP2(HO3)2
_chemical_formula_sum   'Cu4 P8 H8 O24'
_cell_volume   554.14027212
_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  0.59070300  0.79628600  0.56249300  1.0
  Cu  Cu1  1  0.09070300  0.20371400  0.93750700  1.0
  Cu  Cu2  1  0.40929700  0.20371400  0.43750700  1.0
  Cu  Cu3  1  0.90929700  0.79628600  0.06249300  1.0
  P  P4  1  0.92020900  0.54227200  0.77978600  1.0
  P  P5  1  0.42020900  0.45772800  0.72021400  1.0
  P  P6  1  0.07979100  0.45772800  0.22021400  1.0
  P  P7  1  0.57979100  0.54227200  0.27978600  1.0
  P  P8  1  0.79452500  0.04354000  0.71381100  1.0
  P  P9  1  0.29452500  0.95646000  0.78618900  1.0
  P  P10  1  0.20547500  0.95646000  0.28618900  1.0
  P  P11  1  0.70547500  0.04354000  0.21381100  1.0
  H  H12  1  0.80679400  0.46202100  0.87403800  1.0
  H  H13  1  0.30679400  0.53797900  0.62596200  1.0
  H  H14  1  0.19320600  0.53797900  0.12596200  1.0
  H  H15  1  0.69320600  0.46202100  0.37403800  1.0
  H  H16  1  0.88370700  0.01287800  0.57816200  1.0
  H  H17  1  0.38370700  0.98712200  0.92183800  1.0
  H  H18  1  0.11629300  0.98712200  0.42183800  1.0
  H  H19  1  0.61629300  0.01287800  0.07816200  1.0
  O  O20  1  0.53200200  0.59934900  0.73779800  1.0
  O  O21  1  0.03200200  0.40065100  0.76220200  1.0
  O  O22  1  0.46799800  0.40065100  0.26220200  1.0
  O  O23  1  0.96799800  0.59934900  0.23779800  1.0
  O  O24  1  0.98132800  0.68883300  0.88364700  1.0
  O  O25  1  0.48132800  0.31116700  0.61635300  1.0
  O  O26  1  0.01867200  0.31116700  0.11635300  1.0
  O  O27  1  0.51867200  0.68883300  0.38364700  1.0
  O  O28  1  0.88306600  0.64948400  0.59606900  1.0
  O  O29  1  0.38306600  0.35051600  0.90393100  1.0
  O  O30  1  0.11693400  0.35051600  0.40393100  1.0
  O  O31  1  0.61693400  0.64948400  0.09606900  1.0
  O  O32  1  0.68107600  0.89535200  0.73858500  1.0
  O  O33  1  0.18107600  0.10464800  0.76141500  1.0
  O  O34  1  0.31892400  0.10464800  0.26141500  1.0
  O  O35  1  0.81892400  0.89535200  0.23858500  1.0
  O  O36  1  0.87408100  0.01010600  0.89702300  1.0
  O  O37  1  0.37408100  0.98989400  0.60297700  1.0
  O  O38  1  0.12591900  0.98989400  0.10297700  1.0
  O  O39  1  0.62591900  0.01010600  0.39702300  1.0
  O  O40  1  0.75048900  0.24054500  0.68343500  1.0
  O  O41  1  0.25048900  0.75945500  0.81656500  1.0
  O  O42  1  0.24951100  0.75945500  0.31656500  1.0
  O  O43  1  0.74951100  0.24054500  0.18343500  1.0