data_[Li2Sc1V1O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Sc  1.3600  1.6000  0.8850
  V  1.6300  1.3500  0.7775
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [5.2401]
_cell_length_b [3.0563]
_cell_length_c [5.2765]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.7970]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Li2ScVO4]
_chemical_formula_sum '[Li2 Sc1 V1 O4]'
_cell_volume [79.5101]
_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  1  0.0000  0.0000  0.0000  1
  Li  Li1  1  0.0000  0.5000  0.5000  1
  Sc  Sc2  1  0.5000  0.5000  0.0000  1
  V  V3  1  0.5000  0.0000  0.5000  1
  O  O4  2  0.2688  0.0000  0.7523  1
  O  O5  2  0.2708  0.5000  0.2645  1
]