# generated using pymatgen
data_Li4Ti3Cr3(CuO8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.80697499
_cell_length_b   5.84004026
_cell_length_c   9.74456707
_cell_angle_alpha   90.03387299
_cell_angle_beta   89.80788268
_cell_angle_gamma   120.26969723
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti3Cr3(CuO8)2
_chemical_formula_sum   'Li4 Ti3 Cr3 Cu2 O16'
_cell_volume   285.41020498
_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  0.33862500  0.66748100  0.89583300  1
  Li  Li1  1  0.98863600  0.99564500  0.99678200  1
  Li  Li2  1  0.99685500  0.99807900  0.49835500  1
  Li  Li3  1  0.66745700  0.33485000  0.39584800  1
  Ti  Ti4  1  0.16906500  0.83184700  0.21472700  1
  Ti  Ti5  1  0.17097400  0.33830600  0.21613300  1
  Ti  Ti6  1  0.34227600  0.15976100  0.72424500  1
  Cr  Cr7  1  0.66056300  0.83184900  0.21412000  1
  Cr  Cr8  1  0.83156900  0.65807000  0.71140500  1
  Cr  Cr9  1  0.84412100  0.18080700  0.70694300  1
  Cu  Cu10  1  0.32920300  0.66665100  0.49518700  1
  Cu  Cu11  1  0.66800400  0.33380700  0.99280400  1
  O  O12  1  0.15532000  0.83679600  0.60523800  1
  O  O13  1  0.03123000  0.51672800  0.33015400  1
  O  O14  1  0.33094100  0.66571000  0.10231900  1
  O  O15  1  0.99602000  0.99841200  0.31619300  1
  O  O16  1  0.99484300  0.99852600  0.81336300  1
  O  O17  1  0.15524600  0.32137800  0.60501900  1
  O  O18  1  0.49018500  0.96788300  0.32849100  1
  O  O19  1  0.48896600  0.52332800  0.32944500  1
  O  O20  1  0.31453500  0.15764100  0.10516100  1
  O  O21  1  0.68564100  0.84465100  0.61263600  1
  O  O22  1  0.52439500  0.48765800  0.82872900  1
  O  O23  1  0.52318200  0.03465000  0.83003900  1
  O  O24  1  0.66799400  0.33327200  0.60354300  1
  O  O25  1  0.83246400  0.68068500  0.10649000  1
  O  O26  1  0.96884500  0.48307500  0.82198200  1
  O  O27  1  0.83284900  0.15275400  0.10665500  1
