# generated using pymatgen
data_LiTiCoO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.93174675
_cell_length_b   8.52692779
_cell_length_c   5.93163754
_cell_angle_alpha   90.03411250
_cell_angle_beta   91.89153061
_cell_angle_gamma   90.03400079
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTiCoO4
_chemical_formula_sum   'Li4 Ti4 Co4 O16'
_cell_volume   299.85612468
_cell_formula_units_Z   4
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  0.49717100  0.37499600  0.25284100  1
  Li  Li1  1  0.99661700  0.87500400  0.75336700  1
  Li  Li2  1  0.50310200  0.62441300  0.74783900  1
  Li  Li3  1  0.00216300  0.12558500  0.24690300  1
  Ti  Ti4  1  0.50128900  0.00097200  0.00151100  1
  Ti  Ti5  1  0.00222600  0.50075400  0.50003600  1
  Ti  Ti6  1  0.24996500  0.24925800  0.74775700  1
  Ti  Ti7  1  0.74849000  0.74903000  0.24869000  1
  Co  Co8  1  0.24883900  0.75107300  0.25078300  1
  Co  Co9  1  0.49921300  0.99892000  0.50115100  1
  Co  Co10  1  0.74996300  0.25093700  0.75075300  1
  Co  Co11  1  0.99927000  0.49906400  0.00005000  1
  O  O12  1  0.50651400  0.76747800  0.01533800  1
  O  O13  1  0.00594900  0.26735800  0.51566400  1
  O  O14  1  0.23434500  0.48263600  0.74404900  1
  O  O15  1  0.73465500  0.98252000  0.24348500  1
  O  O16  1  0.76581300  0.51720100  0.25526800  1
  O  O17  1  0.26547900  0.01728500  0.75585800  1
  O  O18  1  0.49473200  0.23279800  0.98419400  1
  O  O19  1  0.99414100  0.73271500  0.48451500  1
  O  O20  1  0.00098900  0.25678600  0.96580400  1
  O  O21  1  0.50085100  0.75670100  0.46579400  1
  O  O22  1  0.78420300  0.49321700  0.74900800  1
  O  O23  1  0.28420500  0.99329700  0.24915000  1
  O  O24  1  0.21511100  0.50759300  0.25043400  1
  O  O25  1  0.71480700  0.00802700  0.74968100  1
  O  O26  1  0.00032100  0.74197500  0.03518400  1
  O  O27  1  0.49957500  0.24240600  0.53489500  1
