data_[Li2V2Mo2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  V  1.6300  1.3500  0.7775
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.4649]
_cell_length_b [3.7180]
_cell_length_c [6.7821]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.3153]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LiVMoO6]
_chemical_formula_sum '[Li2 V2 Mo2 O12]'
_cell_volume [220.7944]
_cell_formula_units_Z [2]
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
[
  Li  Li0  2  0.4914  0.5000  0.9821  1.0
  V  V1  2  0.1893  0.0000  0.6558  1.0
  Mo  Mo2  2  0.3170  0.5000  0.3590  1.0
  O  O3  2  0.0238  0.0000  0.7022  1.0
  O  O4  2  0.1623  0.5000  0.1163  1.0
  O  O5  2  0.1964  0.5000  0.5712  1.0
  O  O6  2  0.3103  0.0000  0.4407  1.0
  O  O7  2  0.3334  0.0000  0.8899  1.0
  O  O8  2  0.4761  0.5000  0.2828  1.0
]