# generated using pymatgen
data_Li4Ti3Mn5O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91596945
_cell_length_b   5.91596945
_cell_length_c   9.72643304
_cell_angle_alpha   87.82038687
_cell_angle_beta   87.82038687
_cell_angle_gamma   60.40236138
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti3Mn5O16
_chemical_formula_sum   'Li4 Ti3 Mn5 O16'
_cell_volume   295.70710592
_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  0.67511200  0.67511200  0.10680500  1
  Li  Li1  1  0.98998700  0.98998700  0.00433900  1
  Li  Li2  1  0.98684700  0.98684700  0.50392500  1
  Li  Li3  1  0.33723500  0.33723500  0.60687200  1
  Ti  Ti4  1  0.33822600  0.83744200  0.78349900  1
  Ti  Ti5  1  0.83744200  0.33822600  0.78349900  1
  Ti  Ti6  1  0.17030800  0.17030800  0.28902400  1
  Mn  Mn7  1  0.66676100  0.66676100  0.51073400  1
  Mn  Mn8  1  0.83050900  0.83050900  0.79035300  1
  Mn  Mn9  1  0.33980200  0.33980200  0.01304900  1
  Mn  Mn10  1  0.17426800  0.66359500  0.28393600  1
  Mn  Mn11  1  0.66359500  0.17426800  0.28393600  1
  O  O12  1  0.31185000  0.83996400  0.39343500  1
  O  O13  1  0.51905000  0.51905000  0.66716900  1
  O  O14  1  0.66456600  0.66456600  0.89336000  1
  O  O15  1  0.99643000  0.99643000  0.69013200  1
  O  O16  1  0.00224400  0.00224400  0.18946900  1
  O  O17  1  0.83996400  0.31185000  0.39343500  1
  O  O18  1  0.50583900  0.96861400  0.66341600  1
  O  O19  1  0.96861400  0.50583900  0.66341600  1
  O  O20  1  0.15353100  0.15353100  0.89312600  1
  O  O21  1  0.83297200  0.83297200  0.39163500  1
  O  O22  1  0.04909600  0.48448000  0.16300100  1
  O  O23  1  0.48448000  0.04909600  0.16300100  1
  O  O24  1  0.33033000  0.33033000  0.39296700  1
  O  O25  1  0.17235100  0.66667300  0.90223600  1
  O  O26  1  0.49168400  0.49168400  0.17014900  1
  O  O27  1  0.66667300  0.17235100  0.90223600  1
