# generated using pymatgen
data_LiVCuO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.98643100
_cell_length_b   5.96095100
_cell_length_c   7.04548496
_cell_angle_alpha   115.02624330
_cell_angle_beta   115.14063671
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiVCuO4
_chemical_formula_sum   'Li2 V2 Cu2 O8'
_cell_volume   201.22028718
_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  0.50000000  0.50000000  0.50000000  1
  Li  Li1  1  0.00000000  0.50000000  0.50000000  1
  V  V2  1  0.42917200  0.67917200  0.85834400  1
  V  V3  1  0.57082800  0.32082800  0.14165600  1
  Cu  Cu4  1  0.00000000  0.50000000  0.00000000  1
  Cu  Cu5  1  0.00000000  0.00000000  0.00000000  1
  O  O6  1  0.66891400  0.63240500  0.33782800  1
  O  O7  1  0.33108600  0.36759500  0.66217200  1
  O  O8  1  0.33108600  0.79457700  0.66217200  1
  O  O9  1  0.66891400  0.20542300  0.33782800  1
  O  O10  1  0.22610700  0.26735800  0.03471600  1
  O  O11  1  0.19139100  0.73264200  0.96528400  1
  O  O12  1  0.77389300  0.73264200  0.96528400  1
  O  O13  1  0.80860900  0.26735800  0.03471600  1
