# generated using pymatgen
data_CrP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.05196991
_cell_length_b   8.19678000
_cell_length_c   8.83232041
_cell_angle_alpha   90.00000000
_cell_angle_beta   111.77335557
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrP2O7
_chemical_formula_sum   'Cr4 P8 O28'
_cell_volume   474.11593040
_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
  Cr  Cr0  1  0.37739700  0.08553200  0.61264400  1.0
  Cr  Cr1  1  0.62260300  0.91446800  0.38735600  1.0
  Cr  Cr2  1  0.12260300  0.58553200  0.88735600  1.0
  Cr  Cr3  1  0.87739700  0.41446800  0.11264300  1.0
  P  P4  1  0.17837900  0.72977900  0.24723100  1.0
  P  P5  1  0.42441400  0.23997400  0.96112000  1.0
  P  P6  1  0.67837900  0.77022100  0.74723100  1.0
  P  P7  1  0.92441400  0.26002600  0.46112000  1.0
  P  P8  1  0.32162100  0.22977900  0.25276900  1.0
  P  P9  1  0.07558600  0.73997400  0.53888000  1.0
  P  P10  1  0.57558600  0.76002600  0.03888000  1.0
  P  P11  1  0.82162100  0.27022100  0.75276900  1.0
  O  O12  1  0.37062200  0.15572200  0.10451000  1.0
  O  O13  1  0.56431000  0.61522000  0.68001000  1.0
  O  O14  1  0.06431000  0.88478000  0.18001000  1.0
  O  O15  1  0.30739400  0.40035400  0.91663000  1.0
  O  O16  1  0.62937800  0.84427800  0.89549000  1.0
  O  O17  1  0.39227500  0.08308700  0.37715500  1.0
  O  O18  1  0.69260600  0.59964600  0.08337000  1.0
  O  O19  1  0.36293800  0.10851800  0.83048700  1.0
  O  O20  1  0.15600700  0.23430000  0.52761400  1.0
  O  O21  1  0.60772500  0.91691300  0.62284500  1.0
  O  O22  1  0.89227500  0.41691300  0.87715500  1.0
  O  O23  1  0.91042100  0.74763800  0.81118700  1.0
  O  O24  1  0.58957900  0.24763800  0.68881300  1.0
  O  O25  1  0.87062200  0.34427800  0.60451000  1.0
  O  O26  1  0.10772500  0.58308700  0.12284500  1.0
  O  O27  1  0.93569000  0.11522000  0.81999000  1.0
  O  O28  1  0.08957900  0.25236200  0.18881300  1.0
  O  O29  1  0.63706200  0.89148200  0.16951300  1.0
  O  O30  1  0.65600700  0.26570000  0.02761400  1.0
  O  O31  1  0.34399300  0.73430000  0.97238600  1.0
  O  O32  1  0.19260600  0.90035400  0.58337000  1.0
  O  O33  1  0.86293800  0.39148200  0.33048700  1.0
  O  O34  1  0.13706200  0.60851800  0.66951300  1.0
  O  O35  1  0.43569000  0.38478000  0.31999000  1.0
  O  O36  1  0.41042100  0.75236200  0.31118700  1.0
  O  O37  1  0.80739400  0.09964600  0.41663000  1.0
  O  O38  1  0.84399300  0.76570000  0.47238600  1.0
  O  O39  1  0.12937800  0.65572200  0.39549000  1.0