# generated using pymatgen
data_Li4Ti2Mn3Nb3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.22389726
_cell_length_b   6.22389726
_cell_length_c   9.89601935
_cell_angle_alpha   88.18860219
_cell_angle_beta   88.18860219
_cell_angle_gamma   58.38619807
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Ti2Mn3Nb3O16
_chemical_formula_sum   'Li4 Ti2 Mn3 Nb3 O16'
_cell_volume   326.23945654
_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  0.66947100  0.66947100  0.90404200  1
  Li  Li1  1  0.00217200  0.00217200  0.99789700  1
  Li  Li2  1  0.00718300  0.00718300  0.48562200  1
  Li  Li3  1  0.33644100  0.33644100  0.39783400  1
  Ti  Ti4  1  0.64146300  0.64146300  0.48005500  1
  Ti  Ti5  1  0.32919900  0.32919900  0.00481600  1
  Mn  Mn6  1  0.82720100  0.33597600  0.20350800  1
  Mn  Mn7  1  0.33597600  0.82720100  0.20350800  1
  Mn  Mn8  1  0.16918400  0.16918400  0.70645500  1
  Nb  Nb9  1  0.82264700  0.82264700  0.22800100  1
  Nb  Nb10  1  0.65909100  0.16356400  0.71877100  1
  Nb  Nb11  1  0.16356400  0.65909100  0.71877100  1
  O  O12  1  0.81478800  0.33772200  0.59176800  1
  O  O13  1  0.52364300  0.52364300  0.35605600  1
  O  O14  1  0.68447400  0.68447400  0.10252100  1
  O  O15  1  0.98906400  0.98906400  0.30178900  1
  O  O16  1  0.00050200  0.00050200  0.81493900  1
  O  O17  1  0.33772200  0.81478800  0.59176800  1
  O  O18  1  0.96319300  0.53119300  0.35153900  1
  O  O19  1  0.53119300  0.96319300  0.35153900  1
  O  O20  1  0.17306600  0.17306600  0.08096300  1
  O  O21  1  0.84153500  0.84153500  0.60063300  1
  O  O22  1  0.49806700  0.04482300  0.84369600  1
  O  O23  1  0.04482300  0.49806700  0.84369600  1
  O  O24  1  0.34259700  0.34259700  0.59837200  1
  O  O25  1  0.64843900  0.15873400  0.09368700  1
  O  O26  1  0.48483200  0.48483200  0.84187900  1
  O  O27  1  0.15873400  0.64844000  0.09368700  1
