# generated using pymatgen
data_Pa3TiCo6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26063398
_cell_length_b   7.12532617
_cell_length_c   8.22672767
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pa3TiCo6
_chemical_formula_sum   'Pa6 Ti2 Co12'
_cell_volume   308.36846294
_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
  Pa  Pa0  1  0.75000000  0.89266353  0.85227635  1.0
  Pa  Pa1  1  0.75000000  0.39266353  0.64772365  1.0
  Pa  Pa2  1  0.25000000  0.10242155  0.14309443  1.0
  Pa  Pa3  1  0.25000000  0.60242155  0.35690557  1.0
  Pa  Pa4  1  0.75000000  0.94982222  0.41965563  1.0
  Pa  Pa5  1  0.75000000  0.44982222  0.08034437  1.0
  Ti  Ti6  1  0.25000000  0.06533450  0.61390810  1.0
  Ti  Ti7  1  0.25000000  0.56533450  0.88609190  1.0
  Co  Co8  1  0.75000000  0.59057177  0.36809078  1.0
  Co  Co9  1  0.75000000  0.09057177  0.13190922  1.0
  Co  Co10  1  0.25000000  0.40307942  0.63092188  1.0
  Co  Co11  1  0.25000000  0.90307942  0.86907812  1.0
  Co  Co12  1  0.99661761  0.26032568  0.38116301  1.0
  Co  Co13  1  0.50338239  0.76032568  0.11883699  1.0
  Co  Co14  1  0.48682589  0.73772833  0.62221272  1.0
  Co  Co15  1  0.01317411  0.23772833  0.87778728  1.0
  Co  Co16  1  0.01317411  0.73772833  0.62221272  1.0
  Co  Co17  1  0.48682589  0.23772833  0.87778728  1.0
  Co  Co18  1  0.50338239  0.26032568  0.38116301  1.0
  Co  Co19  1  0.99661761  0.76032568  0.11883699  1.0