# generated using pymatgen
data_Li3Ti(CuO2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.17992750
_cell_length_b   6.17992750
_cell_length_c   5.66437222
_cell_angle_alpha   64.18872388
_cell_angle_beta   64.18872388
_cell_angle_gamma   55.57261233
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Ti(CuO2)4
_chemical_formula_sum   'Li3 Ti1 Cu4 O8'
_cell_volume   155.33230574
_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  0.00000000  0.50000000  0.00000000  1
  Li  Li1  1  0.00000000  0.00000000  0.50000000  1
  Li  Li2  1  0.50000000  0.00000000  0.00000000  1
  Ti  Ti3  1  0.50000000  0.50000000  0.00000000  1
  Cu  Cu4  1  0.50000000  0.50000000  0.50000000  1
  Cu  Cu5  1  0.00000000  0.00000000  0.00000000  1
  Cu  Cu6  1  0.00000000  0.50000000  0.50000000  1
  Cu  Cu7  1  0.50000000  0.00000000  0.50000000  1
  O  O8  1  0.28395200  0.28395200  0.24383200  1
  O  O9  1  0.24286700  0.70656000  0.76968800  1
  O  O10  1  0.70656000  0.24286700  0.76968800  1
  O  O11  1  0.79368400  0.79368400  0.23992100  1
  O  O12  1  0.20631600  0.20631600  0.76007900  1
  O  O13  1  0.29344000  0.75713300  0.23031200  1
  O  O14  1  0.75713300  0.29344000  0.23031200  1
  O  O15  1  0.71604800  0.71604800  0.75616800  1
