# generated using pymatgen
data_TaP2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.38900800
_cell_length_b   8.38900800
_cell_length_c   8.38900800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaP2O7
_chemical_formula_sum   'Ta4 P8 O28'
_cell_volume   590.38025688
_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
  Ta  Ta0  1  0.50000000  0.50000000  0.50000000  1.0
  Ta  Ta1  1  0.00000000  0.50000000  0.00000000  1.0
  Ta  Ta2  1  0.50000000  0.00000000  0.00000000  1.0
  Ta  Ta3  1  0.00000000  0.00000000  0.50000000  1.0
  P  P4  1  0.10993900  0.10993900  0.10993900  1.0
  P  P5  1  0.89006100  0.89006100  0.89006100  1.0
  P  P6  1  0.39006100  0.89006100  0.60993900  1.0
  P  P7  1  0.89006100  0.60993900  0.39006100  1.0
  P  P8  1  0.60993900  0.10993900  0.39006100  1.0
  P  P9  1  0.10993900  0.39006100  0.60993900  1.0
  P  P10  1  0.60993900  0.39006100  0.89006100  1.0
  P  P11  1  0.39006100  0.60993900  0.10993900  1.0
  O  O12  1  0.00000000  0.00000000  0.00000000  1.0
  O  O13  1  0.50000000  0.00000000  0.50000000  1.0
  O  O14  1  0.00000000  0.50000000  0.50000000  1.0
  O  O15  1  0.50000000  0.50000000  0.00000000  1.0
  O  O16  1  0.05671400  0.28118200  0.08618900  1.0
  O  O17  1  0.94328600  0.71881800  0.91381100  1.0
  O  O18  1  0.44328600  0.71881800  0.58618900  1.0
  O  O19  1  0.94328600  0.78118200  0.41381100  1.0
  O  O20  1  0.08618900  0.05671400  0.28118200  1.0
  O  O21  1  0.55671400  0.28118200  0.41381100  1.0
  O  O22  1  0.05671400  0.21881800  0.58618900  1.0
  O  O23  1  0.91381100  0.94328600  0.71881800  1.0
  O  O24  1  0.55671400  0.21881800  0.91381100  1.0
  O  O25  1  0.58618900  0.44328600  0.71881800  1.0
  O  O26  1  0.44328600  0.78118200  0.08618900  1.0
  O  O27  1  0.41381100  0.55671400  0.28118200  1.0
  O  O28  1  0.41381100  0.94328600  0.78118200  1.0
  O  O29  1  0.58618900  0.05671400  0.21881800  1.0
  O  O30  1  0.91381100  0.55671400  0.21881800  1.0
  O  O31  1  0.08618900  0.44328600  0.78118200  1.0
  O  O32  1  0.28118200  0.08618900  0.05671400  1.0
  O  O33  1  0.71881800  0.91381100  0.94328600  1.0
  O  O34  1  0.78118200  0.41381100  0.94328600  1.0
  O  O35  1  0.21881800  0.58618900  0.05671400  1.0
  O  O36  1  0.21881800  0.91381100  0.55671400  1.0
  O  O37  1  0.78118200  0.08618900  0.44328600  1.0
  O  O38  1  0.71881800  0.58618900  0.44328600  1.0
  O  O39  1  0.28118200  0.41381100  0.55671400  1.0