# generated using pymatgen
data_Li2TiCr3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91510677
_cell_length_b   5.91510681
_cell_length_c   5.91510744
_cell_angle_alpha   60.58745583
_cell_angle_beta   60.58746460
_cell_angle_gamma   60.58746633
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiCr3O8
_chemical_formula_sum   'Li2 Ti1 Cr3 O8'
_cell_volume   148.28511747
_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  0.12544600  0.12544600  0.12544600  1
  Li  Li1  1  0.87455400  0.87455400  0.87455400  1
  Ti  Ti2  1  0.50000000  0.50000000  0.50000000  1
  Cr  Cr3  1  0.00000000  0.50000000  0.50000000  1
  Cr  Cr4  1  0.50000000  0.00000000  0.50000000  1
  Cr  Cr5  1  0.50000000  0.50000000  0.00000000  1
  O  O6  1  0.26285800  0.26285800  0.26285800  1
  O  O7  1  0.26409800  0.26409800  0.71204800  1
  O  O8  1  0.26409800  0.71204800  0.26409800  1
  O  O9  1  0.71204800  0.26409800  0.26409800  1
  O  O10  1  0.28795200  0.73590200  0.73590200  1
  O  O11  1  0.73590200  0.28795200  0.73590200  1
  O  O12  1  0.73590200  0.73590200  0.28795200  1
  O  O13  1  0.73714200  0.73714200  0.73714300  1
