# generated using pymatgen
data_LiAl2(CuO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.03719400
_cell_length_b   3.03719336
_cell_length_c   13.31302700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998517
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiAl2(CuO3)2
_chemical_formula_sum   'Li1 Al2 Cu2 O6'
_cell_volume   106.35367089
_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  0.66666700  0.33333300  0.13944600  1.0
  Al  Al1  1  0.00000000  0.00000000  0.52554200  1.0
  Al  Al2  1  0.00000000  0.00000000  0.96200100  1.0
  Cu  Cu3  1  0.66666500  0.33333200  0.74405100  1.0
  Cu  Cu4  1  0.33333400  0.66666800  0.30501100  1.0
  O  O5  1  0.33333400  0.66666800  0.45499700  1.0
  O  O6  1  0.66666500  0.33333200  0.89656600  1.0
  O  O7  1  0.66666500  0.33333200  0.59336500  1.0
  O  O8  1  0.33333400  0.66666800  0.03773400  1.0
  O  O9  1  0.00000000  0.00000000  0.23685600  1.0
  O  O10  1  0.00000000  0.00000000  0.74728900  1.0