# generated using pymatgen
data_NbP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.45771800
_cell_length_b   8.45771800
_cell_length_c   8.45771800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbP2O7
_chemical_formula_sum   'Nb4 P8 O28'
_cell_volume   605.00588898
_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
  Nb  Nb0  1  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb1  1  0.00000000  0.50000000  0.50000000  1.0
  Nb  Nb2  1  0.50000000  0.00000000  0.50000000  1.0
  Nb  Nb3  1  0.50000000  0.50000000  0.00000000  1.0
  P  P4  1  0.10809700  0.60809700  0.89190300  1.0
  P  P5  1  0.10809700  0.89190300  0.39190300  1.0
  P  P6  1  0.39190300  0.39190300  0.39190300  1.0
  P  P7  1  0.39190300  0.10809700  0.89190300  1.0
  P  P8  1  0.60809700  0.60809700  0.60809700  1.0
  P  P9  1  0.60809700  0.89190300  0.10809700  1.0
  P  P10  1  0.89190300  0.10809700  0.60809700  1.0
  P  P11  1  0.89190300  0.39190300  0.10809700  1.0
  O  O12  1  0.05915900  0.72196900  0.42345600  1.0
  O  O13  1  0.07654400  0.94084100  0.22196900  1.0
  O  O14  1  0.27803100  0.92345600  0.44084100  1.0
  O  O15  1  0.50000000  0.00000000  0.00000000  1.0
  O  O16  1  0.55915900  0.77803100  0.57654400  1.0
  O  O17  1  0.55915900  0.72196900  0.07654400  1.0
  O  O18  1  0.57654400  0.55915900  0.77803100  1.0
  O  O19  1  0.57654400  0.94084100  0.27803100  1.0
  O  O20  1  0.72196900  0.42345600  0.05915900  1.0
  O  O21  1  0.77803100  0.57654400  0.55915900  1.0
  O  O22  1  0.77803100  0.92345600  0.05915900  1.0
  O  O23  1  0.92345600  0.44084100  0.27803100  1.0
  O  O24  1  0.94084100  0.22196900  0.07654400  1.0
  O  O25  1  0.00000000  0.50000000  0.00000000  1.0
  O  O26  1  0.05915900  0.77803100  0.92345600  1.0
  O  O27  1  0.07654400  0.55915900  0.72196900  1.0
  O  O28  1  0.22196900  0.07654400  0.94084100  1.0
  O  O29  1  0.22196900  0.42345600  0.44084100  1.0
  O  O30  1  0.27803100  0.57654400  0.94084100  1.0
  O  O31  1  0.42345600  0.05915900  0.72196900  1.0
  O  O32  1  0.42345600  0.44084100  0.22196900  1.0
  O  O33  1  0.44084100  0.27803100  0.92345600  1.0
  O  O34  1  0.44084100  0.22196900  0.42345600  1.0
  O  O35  1  0.50000000  0.50000000  0.50000000  1.0
  O  O36  1  0.72196900  0.07654400  0.55915900  1.0
  O  O37  1  0.92345600  0.05915900  0.77803100  1.0
  O  O38  1  0.94084100  0.27803100  0.57654400  1.0
  O  O39  1  0.00000000  0.00000000  0.50000000  1.0