# generated using pymatgen
data_TiCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.73368741
_cell_length_b   4.73368886
_cell_length_c   15.39209669
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00011509
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TiCo2
_chemical_formula_sum   'Ti8 Co16'
_cell_volume   298.69447912
_cell_formula_units_Z   8
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
  Ti  Ti0  1  0.00000000  0.00000000  0.40569103  1.0
  Ti  Ti1  1  0.00000000  0.00000000  0.59428439  1.0
  Ti  Ti2  1  0.00000000  0.00000000  0.90571561  1.0
  Ti  Ti3  1  0.00000000  0.00000000  0.09430897  1.0
  Ti  Ti4  1  0.33333300  0.66666700  0.65527376  1.0
  Ti  Ti5  1  0.66666700  0.33333300  0.34470603  1.0
  Ti  Ti6  1  0.66666700  0.33333300  0.15529397  1.0
  Ti  Ti7  1  0.33333300  0.66666700  0.84472624  1.0
  Co  Co8  1  0.33333300  0.66666800  0.37454755  1.0
  Co  Co9  1  0.66666700  0.33333300  0.62542595  1.0
  Co  Co10  1  0.66666700  0.33333300  0.87457405  1.0
  Co  Co11  1  0.33333300  0.66666800  0.12545245  1.0
  Co  Co12  1  0.50000951  0.49999049  0.49997752  1.0
  Co  Co13  1  0.50000951  0.00001901  0.49997752  1.0
  Co  Co14  1  -0.00001901  0.49999049  0.49997752  1.0
  Co  Co15  1  0.50000951  0.49999049  0.00002248  1.0
  Co  Co16  1  0.50000951  0.00001901  0.00002248  1.0
  Co  Co17  1  -0.00001901  0.49999049  0.00002248  1.0
  Co  Co18  1  0.16399636  0.83600364  0.25000000  1.0
  Co  Co19  1  0.16399636  0.32799171  0.25000000  1.0
  Co  Co20  1  0.67200829  0.83600364  0.25000000  1.0
  Co  Co21  1  0.83596147  0.16403853  0.75000000  1.0
  Co  Co22  1  0.83596147  0.67192393  0.75000000  1.0
  Co  Co23  1  0.32807607  0.16403853  0.75000000  1.0