[CIF]
data_Nb2PdBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.06231578
_cell_length_b   3.06231578
_cell_length_c   7.26346790
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2PdBr
_chemical_formula_sum   'Nb2 Pd1 Br1'
_cell_volume   68.11518901
_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
  Br  Br0  1  0.00000000  0.00000000  0.00000000  1
  Nb  Nb1  1  1.53115789  1.53115789  1.80170467  1
  Nb  Nb2  1  1.53115789  1.53115789  5.46176323  1
  Pd  Pd3  1  0.00000000  0.00000000  3.63173395  1
[/CIF]
