[CIF]
data_Pt2SeBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.74262007
_cell_length_b   6.74262007
_cell_length_c   6.74262007
_cell_angle_alpha   149.49481623
_cell_angle_beta   148.63161608
_cell_angle_gamma   44.32225486
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pt2SeBr
_chemical_formula_sum   'Pt2 Se1 Br1'
_cell_volume   80.76028016
_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  1.82276503  3.31375964  1
  Pt  Pt1  1  -0.00000000  0.00000000  0.43788427  1
  Pt  Pt2  1  1.77381382  -0.00000000  2.66986090  1
  Se  Se3  1  0.00000000  0.00000000  6.06753641  1
[/CIF]
