# generated using pymatgen
data_PaTi2(Nb2Sn3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.76345247
_cell_length_b   5.75978248
_cell_length_c   9.55993141
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.02106272
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PaTi2(Nb2Sn3)2
_chemical_formula_sum   'Pa1 Ti2 Nb4 Sn6'
_cell_volume   274.77802113
_cell_formula_units_Z   1
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  0.00000000  0.00000000  0.00000000  1.0
  Ti  Ti1  1  0.50000000  0.00000000  0.75151229  1.0
  Ti  Ti2  1  0.50000000  0.00000000  0.24848771  1.0
  Nb  Nb3  1  0.00000000  0.50000000  0.75248485  1.0
  Nb  Nb4  1  0.50000000  0.50000000  0.75248485  1.0
  Nb  Nb5  1  0.00000000  0.50000000  0.24751515  1.0
  Nb  Nb6  1  0.50000000  0.50000000  0.24751515  1.0
  Sn  Sn7  1  0.66336351  0.32672801  0.50000000  1.0
  Sn  Sn8  1  0.33663649  0.67327199  0.50000000  1.0
  Sn  Sn9  1  0.66354651  0.32709102  0.00000000  1.0
  Sn  Sn10  1  0.33645349  0.67290898  0.00000000  1.0
  Sn  Sn11  1  0.00000000  0.00000000  0.66703850  1.0
  Sn  Sn12  1  0.00000000  0.00000000  0.33296150  1.0