data_[Na1V5O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  V  1.6300  1.3500  0.7775
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.6130]
_cell_length_b [5.7115]
_cell_length_c [7.1328]
_cell_angle_alpha [83.3382]
_cell_angle_beta [68.9623]
_cell_angle_gamma [64.4897]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [NaV5O10]
_chemical_formula_sum '[Na1 V5 O10]'
_cell_volume [192.4181]
_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
[
  Na  Na0  1  0.5573  0.0181  0.7312  1.0
  V  V1  1  0.1989  0.5136  0.5991  1.0
  V  V2  1  0.4169  0.9972  0.2282  1.0
  V  V3  1  0.6443  0.4864  0.8387  1.0
  V  V4  1  0.7744  0.4975  0.3704  1.0
  V  V5  1  0.9809  0.9953  0.9941  1.0
  O  O6  1  0.0147  0.3138  0.8332  1.0
  O  O7  1  0.0768  0.8039  0.7859  1.0
  O  O8  1  0.3188  0.2075  0.4231  1.0
  O  O9  1  0.4021  0.6810  0.3743  1.0
  O  O10  1  0.4130  0.7874  0.9887  1.0
  O  O11  1  0.5795  0.3697  0.6280  1.0
  O  O12  1  0.5908  0.2050  0.0128  1.0
  O  O13  1  0.8105  0.7869  0.1933  1.0
  O  O14  1  0.8246  0.6389  0.5790  1.0
  O  O15  1  0.9965  0.1977  0.2200  1.0
]