# generated using pymatgen
data_Li2TiCrO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17909211
_cell_length_b   6.00119331
_cell_length_c   5.93617308
_cell_angle_alpha   60.14855902
_cell_angle_beta   106.21355808
_cell_angle_gamma   105.58621872
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiCrO4
_chemical_formula_sum   'Li4 Ti2 Cr2 O8'
_cell_volume   151.78148534
_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  0.00016000  0.50015900  0.49934500  1
  Li  Li1  1  0.99887800  0.00024500  0.00139600  1
  Li  Li2  1  0.00666200  0.00054000  0.49663600  1
  Li  Li3  1  0.99480500  0.49868600  0.00321000  1
  Ti  Ti4  1  0.50214600  0.75764700  0.74211700  1
  Ti  Ti5  1  0.50108500  0.24152400  0.25738200  1
  Cr  Cr6  1  0.49976900  0.25195800  0.75156600  1
  Cr  Cr7  1  0.49755600  0.74783900  0.24707900  1
  O  O8  1  0.72650300  0.61807600  0.63482400  1
  O  O9  1  0.73494000  0.14956900  0.11634500  1
  O  O10  1  0.27405000  0.88641700  0.86058600  1
  O  O11  1  0.26644900  0.34643800  0.38855300  1
  O  O12  1  0.73275900  0.12252300  0.62891100  1
  O  O13  1  0.72669800  0.61677500  0.11852800  1
  O  O14  1  0.27544400  0.38431300  0.87807600  1
  O  O15  1  0.26209600  0.87729000  0.37544400  1
