# generated using pymatgen
data_Li2TiCoO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.24924995
_cell_length_b   5.24931644
_cell_length_c   5.75465200
_cell_angle_alpha   90.00002829
_cell_angle_beta   89.99996939
_cell_angle_gamma   113.52187978
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2TiCoO4
_chemical_formula_sum   'Li4 Ti2 Co2 O8'
_cell_volume   145.39340548
_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  0.00000000  0.50000100  0.74999700  1
  Li  Li1  1  0.50000100  0.00000000  0.25000200  1
  Li  Li2  1  0.49999900  0.49999900  0.00000000  1
  Li  Li3  1  0.00000000  0.00000000  0.50000000  1
  Ti  Ti4  1  0.00000100  0.49999600  0.24999900  1
  Ti  Ti5  1  0.49999600  0.00000100  0.75000200  1
  Co  Co6  1  0.50000000  0.50000000  0.50000500  1
  Co  Co7  1  0.99999600  0.99999600  0.00000500  1
  O  O8  1  0.22301800  0.27700800  0.25000800  1
  O  O9  1  0.72300100  0.77698500  0.74998400  1
  O  O10  1  0.77698500  0.72300100  0.25001000  1
  O  O11  1  0.27700800  0.22301800  0.74998600  1
  O  O12  1  0.25098900  0.74900700  0.00000000  1
  O  O13  1  0.75098200  0.24902000  0.50000000  1
  O  O14  1  0.74900600  0.25098800  0.00000000  1
  O  O15  1  0.24901900  0.75098100  0.50000100  1
