# generated using pymatgen
data_CrP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.09879548
_cell_length_b   8.32528800
_cell_length_c   6.79353733
_cell_angle_alpha   90.00000000
_cell_angle_beta   104.14758526
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrP2O7
_chemical_formula_sum   'Cr4 P8 O28'
_cell_volume   499.00259713
_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  0.75000400  0.06389000  0.25040900  1.0
  Cr  Cr1  1  0.24999600  0.93611000  0.74959100  1.0
  Cr  Cr2  1  0.24999600  0.56389000  0.74959100  1.0
  Cr  Cr3  1  0.75000400  0.43611000  0.25040900  1.0
  P  P4  1  0.52567700  0.75000000  0.08488500  1.0
  P  P5  1  0.94453500  0.25000000  0.99972200  1.0
  P  P6  1  0.97330700  0.75000000  0.41521600  1.0
  P  P7  1  0.47432300  0.25000000  0.91511500  1.0
  P  P8  1  0.44327700  0.75000000  0.49776500  1.0
  P  P9  1  0.55672300  0.25000000  0.50223500  1.0
  P  P10  1  0.05546500  0.75000000  0.00027800  1.0
  P  P11  1  0.02669300  0.25000000  0.58478400  1.0
  O  O12  1  0.89411200  0.75000000  0.87069400  1.0
  O  O13  1  0.05996400  0.75000000  0.23636100  1.0
  O  O14  1  0.61136500  0.25000000  0.10853300  1.0
  O  O15  1  0.35958400  0.90507200  0.53217900  1.0
  O  O16  1  0.86021000  0.09500000  0.03312600  1.0
  O  O17  1  0.35958400  0.59492800  0.53217900  1.0
  O  O18  1  0.64041600  0.09492800  0.46782100  1.0
  O  O19  1  0.88235200  0.90246600  0.40941800  1.0
  O  O20  1  0.60550800  0.75000000  0.62484600  1.0
  O  O21  1  0.13979000  0.59500000  0.96687400  1.0
  O  O22  1  0.39449200  0.25000000  0.37515400  1.0
  O  O23  1  0.88848300  0.25000000  0.39284700  1.0
  O  O24  1  0.56366900  0.25000000  0.73905600  1.0
  O  O25  1  0.11151700  0.75000000  0.60715300  1.0
  O  O26  1  0.38307000  0.40242100  0.90763200  1.0
  O  O27  1  0.38863500  0.75000000  0.89146700  1.0
  O  O28  1  0.94003600  0.25000000  0.76363900  1.0
  O  O29  1  0.10588800  0.25000000  0.12930600  1.0
  O  O30  1  0.43633100  0.75000000  0.26094400  1.0
  O  O31  1  0.61693000  0.59757900  0.09236800  1.0
  O  O32  1  0.38307000  0.09757900  0.90763200  1.0
  O  O33  1  0.61693000  0.90242100  0.09236800  1.0
  O  O34  1  0.64041600  0.40507200  0.46782100  1.0
  O  O35  1  0.11764800  0.09753400  0.59058200  1.0
  O  O36  1  0.86021000  0.40500000  0.03312600  1.0
  O  O37  1  0.13979000  0.90500000  0.96687400  1.0
  O  O38  1  0.11764800  0.40246600  0.59058200  1.0
  O  O39  1  0.88235200  0.59753400  0.40941800  1.0