# generated using pymatgen
data_Nb3O7F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.71949130
_cell_length_b   10.71949130
_cell_length_c   3.98926100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   159.03191013
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb3O7F
_chemical_formula_sum   'Nb3 O7 F1'
_cell_volume   164.03606239
_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
  Nb  Nb0  1  0.18454100  0.81545900  0.00000000  1.0
  Nb  Nb1  1  0.81545900  0.18454100  0.00000000  1.0
  Nb  Nb2  1  0.00000000  0.00000000  0.00000000  1.0
  O  O3  1  0.09305000  0.90695000  0.00000000  1.0
  O  O4  1  0.18548200  0.81451800  0.50000000  1.0
  O  O5  1  0.70932200  0.29067800  0.00000000  1.0
  O  O6  1  0.29067800  0.70932200  0.00000000  1.0
  O  O7  1  0.81451800  0.18548200  0.50000000  1.0
  O  O8  1  0.90695000  0.09305000  0.00000000  1.0
  O  O9  1  0.50000000  0.50000000  0.00000000  1.0
  F  F10  1  0.00000000  0.00000000  0.50000000  1.0