# generated using pymatgen
data_Li4Ti3Fe2Cu3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88547258
_cell_length_b   5.88759600
_cell_length_c   9.62488173
_cell_angle_alpha   89.98304251
_cell_angle_beta   91.00934755
_cell_angle_gamma   119.99158699
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti3Fe2Cu3O16
_chemical_formula_sum   'Li4 Ti3 Fe2 Cu3 O16'
_cell_volume   288.79776258
_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  0.33253200  0.66658100  0.89693800  1
  Li  Li1  1  0.97844600  0.98913900  0.99057100  1
  Li  Li2  1  0.99827900  0.99919500  0.49630700  1
  Li  Li3  1  0.67716200  0.33854500  0.39852100  1
  Ti  Ti4  1  0.17750700  0.83585500  0.21711500  1
  Ti  Ti5  1  0.17782200  0.34166900  0.21705300  1
  Ti  Ti6  1  0.35047500  0.17542200  0.72143200  1
  Fe  Fe7  1  0.33688700  0.66839300  0.49467500  1
  Fe  Fe8  1  0.67106000  0.33566000  0.99179300  1
  Cu  Cu9  1  0.65960400  0.82981500  0.21024500  1
  Cu  Cu10  1  0.83409100  0.66141300  0.70986400  1
  Cu  Cu11  1  0.83418500  0.17273800  0.70996100  1
  O  O12  1  0.17697000  0.84424500  0.59753600  1
  O  O13  1  0.03568800  0.51788200  0.33281700  1
  O  O14  1  0.31713200  0.65860100  0.10250500  1
  O  O15  1  0.99877000  0.99946100  0.30794500  1
  O  O16  1  0.99434700  0.99669700  0.80137000  1
  O  O17  1  0.17632500  0.33230800  0.59776000  1
  O  O18  1  0.47509500  0.96490200  0.34333000  1
  O  O19  1  0.47502600  0.50994100  0.34324400  1
  O  O20  1  0.32732500  0.16356300  0.10423200  1
  O  O21  1  0.67844900  0.83891600  0.59916500  1
  O  O22  1  0.50398300  0.47254100  0.84450300  1
  O  O23  1  0.50553100  0.03219100  0.84426900  1
  O  O24  1  0.66741100  0.33388600  0.60508000  1
  O  O25  1  0.84024900  0.67214500  0.09733000  1
  O  O26  1  0.95937800  0.48038400  0.83504700  1
  O  O27  1  0.84027300  0.16821100  0.09723200  1
