# generated using pymatgen
data_LiVCuO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.08910440
_cell_length_b   5.08910440
_cell_length_c   6.39651800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   110.41617582
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiVCuO4
_chemical_formula_sum   'Li2 V2 Cu2 O8'
_cell_volume   155.25693210
_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  1  0.66914800  0.33085200  0.75000000  1
  Li  Li1  1  0.33085200  0.66914800  0.25000000  1
  V  V2  1  0.65167500  0.34832500  0.25000000  1
  V  V3  1  0.34832500  0.65167500  0.75000000  1
  Cu  Cu4  1  0.00000000  0.00000000  0.00000000  1
  Cu  Cu5  1  0.00000000  0.00000000  0.50000000  1
  O  O6  1  0.76936300  0.23063700  0.02628400  1
  O  O7  1  0.76936300  0.23063700  0.47371600  1
  O  O8  1  0.28162600  0.24212600  0.25000000  1
  O  O9  1  0.24212600  0.28162600  0.75000000  1
  O  O10  1  0.75787400  0.71837400  0.25000000  1
  O  O11  1  0.71837400  0.75787400  0.75000000  1
  O  O12  1  0.23063700  0.76936300  0.97371600  1
  O  O13  1  0.23063700  0.76936300  0.52628400  1
