# generated using pymatgen
data_Li4Ti2Fe3Cu3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91861440
_cell_length_b   5.93202314
_cell_length_c   9.56284144
_cell_angle_alpha   90.00644075
_cell_angle_beta   89.54121014
_cell_angle_gamma   120.01127749
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti2Fe3Cu3O16
_chemical_formula_sum   'Li4 Ti2 Fe3 Cu3 O16'
_cell_volume   290.71858320
_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  0.32636900  0.66291800  0.89764300  1
  Li  Li1  1  0.00066700  0.00003400  0.99583600  1
  Li  Li2  1  0.00766200  0.00410200  0.49107000  1
  Li  Li3  1  0.66665300  0.33348000  0.39524300  1
  Ti  Ti4  1  0.34088600  0.67047500  0.49783400  1
  Ti  Ti5  1  0.67414300  0.33698100  0.99607400  1
  Fe  Fe6  1  0.65935500  0.82966800  0.21668400  1
  Fe  Fe7  1  0.83102200  0.65944700  0.71637100  1
  Fe  Fe8  1  0.83106900  0.17166900  0.71633800  1
  Cu  Cu9  1  0.17585200  0.83316900  0.21438200  1
  Cu  Cu10  1  0.17574300  0.34266200  0.21453100  1
  Cu  Cu11  1  0.34066100  0.17031400  0.71278200  1
  O  O12  1  0.16239500  0.82909500  0.59209800  1
  O  O13  1  0.04557400  0.52260800  0.34238700  1
  O  O14  1  0.32389100  0.66193200  0.11005200  1
  O  O15  1  0.01265800  0.00635600  0.30092700  1
  O  O16  1  0.01529000  0.00746300  0.80511100  1
  O  O17  1  0.16255400  0.33368400  0.59218500  1
  O  O18  1  0.48398200  0.96363600  0.34557200  1
  O  O19  1  0.48426000  0.52080400  0.34560400  1
  O  O20  1  0.32779800  0.16411600  0.09344800  1
  O  O21  1  0.66294700  0.83161800  0.59318500  1
  O  O22  1  0.51691100  0.48014700  0.84331500  1
  O  O23  1  0.51694400  0.03653900  0.84336100  1
  O  O24  1  0.65522200  0.32777800  0.60694200  1
  O  O25  1  0.81915700  0.65990400  0.09232700  1
  O  O26  1  0.96132300  0.48060500  0.84438100  1
  O  O27  1  0.81900900  0.15909700  0.09215300  1
