data_[Li4V1Cr3O8]
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
  Cr  1.6600  1.4000  0.9400
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [5.1413]
_cell_length_b [5.9303]
_cell_length_c [5.1619]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.5145]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Li4VCr3O8]
_chemical_formula_sum '[Li4 V1 Cr3 O8]'
_cell_volume [148.3447]
_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
[
  Li  Li0  2  0.5000  0.2523  0.0000  1.0
  Li  Li1  1  0.0000  0.0000  0.0000  1.0
  Li  Li2  1  0.0000  0.5000  0.0000  1.0
  V  V3  1  0.5000  0.0000  0.5000  1.0
  Cr  Cr4  2  0.0000  0.2490  0.5000  1.0
  Cr  Cr5  1  0.5000  0.5000  0.5000  1.0
  O  O6  4  0.2565  0.2518  0.2724  1.0
  O  O7  2  0.2385  0.0000  0.7306  1.0
  O  O8  2  0.2424  0.5000  0.7231  1.0
]