# generated using pymatgen
data_In23Se28
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.45237271
_cell_length_b   10.45237271
_cell_length_c   18.69537386
_cell_angle_alpha   72.75137071
_cell_angle_beta   72.75137071
_cell_angle_gamma   46.47205727
_symmetry_Int_Tables_number   1
_chemical_formula_structural   In23Se28
_chemical_formula_sum   'In23 Se28'
_cell_volume   1401.67498798
_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
  In  In0  1  0.19308500  0.19308500  0.53276200  1.0
  In  In1  1  0.69309400  0.69309400  0.53471600  1.0
  In  In2  1  0.30263500  0.80437900  0.46862500  1.0
  In  In3  1  0.80437900  0.30263500  0.46862500  1.0
  In  In4  1  0.41656500  0.41656500  0.39748700  1.0
  In  In5  1  0.91615000  0.91615000  0.39752200  1.0
  In  In6  1  0.08218300  0.58278200  0.60489200  1.0
  In  In7  1  0.58278200  0.08218300  0.60489200  1.0
  In  In8  1  0.80861400  0.80861400  0.81027200  1.0
  In  In9  1  0.30991200  0.30991200  0.81112600  1.0
  In  In10  1  0.69098700  0.19053400  0.18769300  1.0
  In  In11  1  0.19053400  0.69098700  0.18769300  1.0
  In  In12  1  0.28033000  0.28033000  0.04484300  1.0
  In  In13  1  0.77967500  0.77967500  0.04591400  1.0
  In  In14  1  0.22129000  0.72212900  0.95304500  1.0
  In  In15  1  0.72212900  0.22129000  0.95304500  1.0
  In  In16  1  0.15260100  0.15260100  0.87649400  1.0
  In  In17  1  0.65216000  0.65216000  0.87603300  1.0
  In  In18  1  0.34658800  0.84711700  0.12178500  1.0
  In  In19  1  0.84711700  0.34658800  0.12178500  1.0
  In  In20  1  0.02808900  0.02808900  0.72579100  1.0
  In  In21  1  0.97114700  0.47037300  0.27556700  1.0
  In  In22  1  0.47037300  0.97114700  0.27556700  1.0
  Se  Se23  1  0.53976900  0.53976900  0.00796000  1.0
  Se  Se24  1  0.03991900  0.03991900  0.00935100  1.0
  Se  Se25  1  0.95901300  0.46171700  0.99337100  1.0
  Se  Se26  1  0.46171700  0.95901300  0.99337100  1.0
  Se  Se27  1  0.16139400  0.16139400  0.17759700  1.0
  Se  Se28  1  0.66039500  0.66039500  0.17882000  1.0
  Se  Se29  1  0.33866100  0.84231800  0.82259500  1.0
  Se  Se30  1  0.84231800  0.33866100  0.82259500  1.0
  Se  Se31  1  0.36675500  0.36675500  0.27206300  1.0
  Se  Se32  1  0.86651000  0.86651000  0.27216200  1.0
  Se  Se33  1  0.13221000  0.63467400  0.72743800  1.0
  Se  Se34  1  0.63467400  0.13221000  0.72743800  1.0
  Se  Se35  1  0.89306500  0.89306500  0.90788400  1.0
  Se  Se36  1  0.39232300  0.39232300  0.90951100  1.0
  Se  Se37  1  0.60733200  0.10634900  0.09268400  1.0
  Se  Se38  1  0.10634900  0.60733200  0.09268400  1.0
  Se  Se39  1  0.94464800  0.94464800  0.53235500  1.0
  Se  Se40  1  0.44436900  0.44436900  0.53257900  1.0
  Se  Se41  1  0.55709700  0.05705100  0.46717400  1.0
  Se  Se42  1  0.05705100  0.55709700  0.46717400  1.0
  Se  Se43  1  0.23770400  0.23770400  0.65695700  1.0
  Se  Se44  1  0.73808600  0.73808600  0.65694600  1.0
  Se  Se45  1  0.26219700  0.76260900  0.34279200  1.0
  Se  Se46  1  0.76260900  0.26219700  0.34279200  1.0
  Se  Se47  1  0.15683200  0.15683200  0.40349100  1.0
  Se  Se48  1  0.65629800  0.65629800  0.40605900  1.0
  Se  Se49  1  0.34355900  0.84772600  0.59149300  1.0
  Se  Se50  1  0.84772600  0.34355900  0.59149300  1.0