# generated using pymatgen
data_Cu3(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.84664900
_cell_length_b   7.03693600
_cell_length_c   8.48234655
_cell_angle_alpha   67.96965905
_cell_angle_beta   75.66439245
_cell_angle_gamma   72.09462526
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu3(P2O7)2
_chemical_formula_sum   'Cu3 P4 O14'
_cell_volume   252.29795604
_cell_formula_units_Z   1
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  0.03587500  0.16909600  0.55921500  1.0
  Cu  Cu1  1  0.96412500  0.83090400  0.44078500  1.0
  Cu  Cu2  1  0.00000000  0.00000000  0.00000000  1.0
  P  P3  1  0.37676100  0.48689000  0.29718600  1.0
  P  P4  1  0.62323900  0.51311000  0.70281400  1.0
  P  P5  1  0.35049800  0.15756100  0.18392600  1.0
  P  P6  1  0.64950200  0.84243900  0.81607400  1.0
  O  O7  1  0.30760900  0.33114500  0.48087300  1.0
  O  O8  1  0.69239100  0.66885500  0.51912700  1.0
  O  O9  1  0.18344900  0.05238200  0.37100900  1.0
  O  O10  1  0.81655100  0.94761800  0.62899100  1.0
  O  O11  1  0.69710600  0.47877900  0.26679600  1.0
  O  O12  1  0.30289400  0.52122100  0.73320400  1.0
  O  O13  1  0.29637900  0.40161200  0.16452000  1.0
  O  O14  1  0.70362100  0.59838800  0.83548000  1.0
  O  O15  1  0.21733000  0.15731700  0.04122800  1.0
  O  O16  1  0.78267000  0.84268300  0.95877200  1.0
  O  O17  1  0.82613900  0.28669300  0.73382600  1.0
  O  O18  1  0.17386100  0.71330700  0.26617400  1.0
  O  O19  1  0.67945800  0.05538000  0.18504300  1.0
  O  O20  1  0.32054200  0.94462000  0.81495700  1.0