data_Li2VCrO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.32
_cell_length_b   5.32
_cell_length_c   5.32
_cell_angle_alpha   135.16
_cell_angle_beta   135.16
_cell_angle_gamma   65.29
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2VCrO4
_chemical_formula_sum   'Li2 V1 Cr1 O4'
_cell_volume   73.85
_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  0.0  0.03  0.24  1.0
  Li  Li1  1  0.0  0.0  0.0  1.0
  V  V2  1  0.0  0.0  0.48  1.0
  Cr  Cr3  1  0.03  0.0  0.24  1.0
  O  O4  1  0.03  0.0  0.29  1.0
  O  O5  1  0.0  0.0  0.39  1.0
  O  O6  1  0.03  0.0  0.2  1.0
  O  O7  1  0.0  0.0  0.57  1.0

data_Li2VCrO4
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.06
_cell_length_b   4.06
_cell_length_c   5.32
_cell_angle_alpha   112.42
_cell_angle_beta   112.42
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2VCrO4
_chemical_formula_sum   'Li2 V1 Cr1 O4'
_cell_volume   73.85
_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  0.0  0.0  0.0  1.0
  Li  Li1  1  0.21  0.24  0.21  1.0
  V  V2  1  0.48  0.48  0.48  1.0
  Cr  Cr3  1  0.24  0.21  0.21  1.0
  O  O4  1  0.2  0.17  0.17  1.0
  O  O5  1  0.29  0.26  0.26  1.0
  O  O6  1  0.39  0.39  0.39  1.0
  O  O7  1  0.57  0.57  0.57  1.0

Li Li V Cr O O O O