# generated using pymatgen
data_NbVO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.68350071
_cell_length_b   5.68350951
_cell_length_c   5.68346707
_cell_angle_alpha   139.33550421
_cell_angle_beta   139.33698661
_cell_angle_gamma   58.86340069
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbVO4
_chemical_formula_sum   'Nb1 V1 O4'
_cell_volume   77.21439326
_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  0.99999800  0.00000000  0.00000000  1.0
  V  V1  1  0.75000500  0.24999900  0.50000000  1.0
  O  O2  1  0.53617600  0.03617500  0.50000100  1.0
  O  O3  1  0.20513900  0.20514300  0.00000100  1.0
  O  O4  1  0.96382400  0.46382300  0.49999900  1.0
  O  O5  1  0.79485800  0.79486100  0.99999900  1.0