# generated using pymatgen
data_InSn2Br5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.41748996
_cell_length_b   9.41748996
_cell_length_c   9.41748996
_cell_angle_alpha   127.04346755
_cell_angle_beta   127.04346755
_cell_angle_gamma   78.17978084
_symmetry_Int_Tables_number   1
_chemical_formula_structural   InSn2Br5
_chemical_formula_sum   'In2 Sn4 Br10'
_cell_volume   515.47686025
_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
  In  In0  1  0.25000000  0.25000000  -0.00000000  1.0
  In  In1  1  0.75000000  0.75000000  -0.00000000  1.0
  Sn  Sn2  1  0.17832647  0.32167353  0.50000000  1.0
  Sn  Sn3  1  0.67832647  0.17832647  0.85665294  1.0
  Sn  Sn4  1  0.82167353  0.67832647  0.50000000  1.0
  Sn  Sn5  1  0.32167353  0.82167353  0.14334706  1.0
  Br  Br6  1  0.69970005  0.19970005  0.17336758  1.0
  Br  Br7  1  0.97366752  0.47366752  0.17336758  1.0
  Br  Br8  1  0.30029995  0.80029995  0.82663242  1.0
  Br  Br9  1  0.80029995  0.97366752  0.50000000  1.0
  Br  Br10  1  0.47366752  0.30029995  0.50000000  1.0
  Br  Br11  1  0.19970005  0.02633248  0.50000000  1.0
  Br  Br12  1  0.00000000  0.00000000  -0.00000000  1.0
  Br  Br13  1  0.50000000  0.50000000  -0.00000000  1.0
  Br  Br14  1  0.02633248  0.52633248  0.82663242  1.0
  Br  Br15  1  0.52633248  0.69970005  0.50000000  1.0