# generated using pymatgen
data_Li4Ti3Mn3(CuO8)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88646962
_cell_length_b   5.88646962
_cell_length_c   9.70629880
_cell_angle_alpha   89.97972395
_cell_angle_beta   89.97972395
_cell_angle_gamma   59.32963263
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti3Mn3(CuO8)2
_chemical_formula_sum   'Li4 Ti3 Mn3 Cu2 O16'
_cell_volume   289.28143571
_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  0.32402000  0.32402000  0.89062800  1
  Li  Li1  1  0.01243300  0.01243300  0.99604300  1
  Li  Li2  1  0.99925400  0.99925400  0.49828500  1
  Li  Li3  1  0.66971000  0.66971000  0.39384500  1
  Ti  Ti4  1  0.18126100  0.67166400  0.21321600  1
  Ti  Ti5  1  0.67166400  0.18126100  0.21321600  1
  Ti  Ti6  1  0.82103300  0.82103300  0.71312800  1
  Mn  Mn7  1  0.17774500  0.17774500  0.21656600  1
  Mn  Mn8  1  0.32829000  0.82095700  0.71473500  1
  Mn  Mn9  1  0.82095700  0.32829000  0.71473500  1
  Cu  Cu10  1  0.33131800  0.33131800  0.49124900  1
  Cu  Cu11  1  0.66814000  0.66814000  0.99010000  1
  O  O12  1  0.15138900  0.67280700  0.60375400  1
  O  O13  1  0.49563100  0.49563100  0.32031600  1
  O  O14  1  0.33660900  0.33660900  0.10557600  1
  O  O15  1  0.01378200  0.01378200  0.31483500  1
  O  O16  1  0.99199700  0.99199700  0.81230700  1
  O  O17  1  0.67280700  0.15138900  0.60375400  1
  O  O18  1  0.04712000  0.48598300  0.33637400  1
  O  O19  1  0.48598300  0.04712000  0.33637400  1
  O  O20  1  0.85276300  0.85276300  0.10892400  1
  O  O21  1  0.14939500  0.14939500  0.61370500  1
  O  O22  1  0.50974300  0.95019400  0.83476800  1
  O  O23  1  0.95019400  0.50974300  0.83476800  1
  O  O24  1  0.65674600  0.65674600  0.60694700  1
  O  O25  1  0.32786800  0.85212100  0.10479800  1
  O  O26  1  0.50325600  0.50325600  0.82291500  1
  O  O27  1  0.85212100  0.32786800  0.10479800  1
