[CIF]
data_KTiBr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.09328006
_cell_length_b   4.09328006
_cell_length_c   7.26070761
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KTiBr2
_chemical_formula_sum   'K1 Ti1 Br2'
_cell_volume   121.65273234
_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  6.51933309  1
  Br  Br1  1  2.04664003  2.04664003  1.92516842  1
  K  K2  1  0.00000000  0.00000000  3.27381480  1
  Ti  Ti3  1  2.04664003  2.04664003  6.43345264  1
[/CIF]
