# generated using pymatgen
data_Li2TiCr3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.89131454
_cell_length_b   5.94556252
_cell_length_c   10.45815070
_cell_angle_alpha   74.86380489
_cell_angle_beta   73.63963568
_cell_angle_gamma   60.30120002
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiCr3O8
_chemical_formula_sum   'Li4 Ti2 Cr6 O16'
_cell_volume   302.05150217
_cell_formula_units_Z   2
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  0.25000100  0.75000000  0.25000400  1
  Li  Li1  1  0.75000900  0.25000200  0.74999800  1
  Li  Li2  1  0.75000100  0.75000700  0.25000200  1
  Li  Li3  1  0.24999600  0.25001100  0.74999500  1
  Ti  Ti4  1  0.99994600  0.00000500  0.00000500  1
  Ti  Ti5  1  0.49997600  0.49998100  0.50000400  1
  Cr  Cr6  1  0.00004900  0.50001000  0.49999500  1
  Cr  Cr7  1  0.00000900  0.00007600  0.49994600  1
  Cr  Cr8  1  0.50000800  0.99992600  0.50005800  1
  Cr  Cr9  1  0.50006200  0.99994200  0.00000200  1
  Cr  Cr10  1  0.49996400  0.50002100  0.00001000  1
  Cr  Cr11  1  0.99999500  0.49996500  0.99997200  1
  O  O12  1  0.62414000  0.64564000  0.10607600  1
  O  O13  1  0.12412900  0.14564100  0.60608800  1
  O  O14  1  0.87584800  0.85438600  0.39391500  1
  O  O15  1  0.37587200  0.35435400  0.89390400  1
  O  O16  1  0.12225400  0.64930700  0.10613200  1
  O  O17  1  0.62228900  0.14931800  0.60612300  1
  O  O18  1  0.37774800  0.85069200  0.39387300  1
  O  O19  1  0.87771300  0.35068600  0.89387300  1
  O  O20  1  0.14143000  0.12585400  0.10181800  1
  O  O21  1  0.64143600  0.62584700  0.60182600  1
  O  O22  1  0.63090400  0.12584300  0.10180500  1
  O  O23  1  0.13091200  0.62586800  0.60179800  1
  O  O24  1  0.86908400  0.37419000  0.39818900  1
  O  O25  1  0.36908100  0.87416600  0.89819200  1
  O  O26  1  0.35857000  0.37413300  0.39820200  1
  O  O27  1  0.85857200  0.87413600  0.89819400  1
