# generated using pymatgen
data_LiTiCoO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.91515630
_cell_length_b   5.96410139
_cell_length_c   5.98266097
_cell_angle_alpha   121.63484908
_cell_angle_beta   60.38346514
_cell_angle_gamma   119.73772260
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiCoO4
_chemical_formula_sum   'Li2 Ti2 Co2 O8'
_cell_volume   148.00867111
_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  0.12102100  0.87485000  0.63286000  1
  Li  Li1  1  0.87897900  0.12515000  0.36714000  1
  Ti  Ti2  1  0.50000000  0.50000000  0.00000000  1
  Ti  Ti3  1  0.00000000  0.50000000  0.00000000  1
  Co  Co4  1  0.50000000  0.50000000  0.50000000  1
  Co  Co5  1  0.50000000  0.00000000  0.00000000  1
  O  O6  1  0.75410200  0.28394900  0.77561300  1
  O  O7  1  0.74085600  0.71670500  0.23504000  1
  O  O8  1  0.25914400  0.28329500  0.76496000  1
  O  O9  1  0.24589800  0.71605100  0.22438700  1
  O  O10  1  0.74061200  0.25850600  0.22375700  1
  O  O11  1  0.29422900  0.25874800  0.22408700  1
  O  O12  1  0.70577100  0.74125200  0.77591300  1
  O  O13  1  0.25938800  0.74149400  0.77624300  1
