# generated using pymatgen
data_Ti(AlBr4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.47470128
_cell_length_b   10.47470128
_cell_length_c   12.57801786
_cell_angle_alpha   55.51393666
_cell_angle_beta   55.51393666
_cell_angle_gamma   49.00505135
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ti(AlBr4)2
_chemical_formula_sum   'Ti2 Al4 Br16'
_cell_volume   815.40394566
_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
  Ti  Ti0  1  0.99734800  0.00265200  0.25000000  1.0
  Ti  Ti1  1  0.00265200  0.99734800  0.75000000  1.0
  Al  Al2  1  0.32567600  0.84143300  0.47152200  1.0
  Al  Al3  1  0.15856700  0.67432400  0.02847800  1.0
  Al  Al4  1  0.67432400  0.15856700  0.52847800  1.0
  Al  Al5  1  0.84143300  0.32567600  0.97152200  1.0
  Br  Br6  1  0.61827700  0.69397100  0.44935400  1.0
  Br  Br7  1  0.30602900  0.38172300  0.05064600  1.0
  Br  Br8  1  0.38172300  0.30602900  0.55064600  1.0
  Br  Br9  1  0.69397100  0.61827700  0.94935400  1.0
  Br  Br10  1  0.16487300  0.13007900  0.48502500  1.0
  Br  Br11  1  0.86992100  0.83512700  0.01497500  1.0
  Br  Br12  1  0.83512700  0.86992100  0.51497500  1.0
  Br  Br13  1  0.13007900  0.16487300  0.98502500  1.0
  Br  Br14  1  0.30826700  0.85686600  0.28397500  1.0
  Br  Br15  1  0.14313400  0.69173300  0.21602500  1.0
  Br  Br16  1  0.69173300  0.14313400  0.71602500  1.0
  Br  Br17  1  0.85686600  0.30826700  0.78397500  1.0
  Br  Br18  1  0.16475900  0.70937500  0.67937500  1.0
  Br  Br19  1  0.29062500  0.83524100  0.82062500  1.0
  Br  Br20  1  0.83524100  0.29062500  0.32062500  1.0
  Br  Br21  1  0.70937500  0.16475900  0.17937500  1.0