# generated using pymatgen
data_Li3TiMn3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.90700000
_cell_length_b   6.11218904
_cell_length_c   14.66390074
_cell_angle_alpha   94.81862959
_cell_angle_beta   90.76505785
_cell_angle_gamma   118.20706710
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3TiMn3O8
_chemical_formula_sum   'Li9 Ti3 Mn9 O24'
_cell_volume   464.06429148
_cell_formula_units_Z   3
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  0.34186600  0.17429000  0.33556100  1
  Li  Li1  1  0.16754200  0.83422600  0.16850900  1
  Li  Li2  1  0.00000000  0.50000000  0.00000000  1
  Li  Li3  1  0.83245800  0.16577400  0.83149100  1
  Li  Li4  1  0.17130500  0.34371300  0.66876000  1
  Li  Li5  1  0.65813400  0.82571000  0.66443900  1
  Li  Li6  1  0.00000000  0.00000000  0.50000000  1
  Li  Li7  1  0.82869500  0.65628700  0.33124000  1
  Li  Li8  1  0.50000000  0.00000000  0.00000000  1
  Ti  Ti9  1  0.66263300  0.34265700  0.66327100  1
  Ti  Ti10  1  0.33736700  0.65734300  0.33672900  1
  Ti  Ti11  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn12  1  0.83321900  0.66620900  0.83319000  1
  Mn  Mn13  1  0.50000000  0.00000000  0.50000000  1
  Mn  Mn14  1  0.82976600  0.16874600  0.32992400  1
  Mn  Mn15  1  0.66543900  0.83442200  0.16615500  1
  Mn  Mn16  1  0.16678100  0.33379100  0.16681000  1
  Mn  Mn17  1  0.50000000  0.50000000  0.00000000  1
  Mn  Mn18  1  0.33456100  0.16557800  0.83384500  1
  Mn  Mn19  1  0.17023400  0.83125400  0.67007600  1
  Mn  Mn20  1  0.00000000  0.50000000  0.50000000  1
  O  O21  1  0.13610300  0.82588500  0.92009400  1
  O  O22  1  0.69911400  0.33625300  0.41288200  1
  O  O23  1  0.95956200  0.48336200  0.75058000  1
  O  O24  1  0.50146800  0.96097600  0.25740700  1
  O  O25  1  0.80855700  0.15801500  0.58338400  1
  O  O26  1  0.35975200  0.66966300  0.08186200  1
  O  O27  1  0.15134200  0.35718900  0.40810300  1
  O  O28  1  0.65075700  0.84388100  0.41609700  1
  O  O29  1  0.69982700  0.84330700  0.91475500  1
  O  O30  1  0.17500400  0.30006500  0.92494200  1
  O  O31  1  0.97178200  0.99570200  0.24920500  1
  O  O32  1  0.46989800  0.49267100  0.25599800  1
  O  O33  1  0.53010200  0.50732900  0.74400200  1
  O  O34  1  0.02821800  0.00429800  0.75079500  1
  O  O35  1  0.82499600  0.69993500  0.07505800  1
  O  O36  1  0.30017300  0.15669300  0.08524500  1
  O  O37  1  0.34924300  0.15611900  0.58390300  1
  O  O38  1  0.84865800  0.64281100  0.59189700  1
  O  O39  1  0.64024800  0.33033700  0.91813800  1
  O  O40  1  0.19144300  0.84198500  0.41661600  1
  O  O41  1  0.49853200  0.03902400  0.74259300  1
  O  O42  1  0.04043800  0.51663800  0.24942000  1
  O  O43  1  0.30088600  0.66374700  0.58711800  1
  O  O44  1  0.86389700  0.17411500  0.07990600  1
