# generated using pymatgen
data_Cr5InSe8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.62145274
_cell_length_b   9.62145274
_cell_length_c   9.04564685
_cell_angle_alpha   75.71052704
_cell_angle_beta   75.71052704
_cell_angle_gamma   22.03670649
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr5InSe8
_chemical_formula_sum   'Cr5 In1 Se8'
_cell_volume   304.08904888
_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
  Cr  Cr0  1  0.00000000  0.00000000  0.50000000  1.0
  Cr  Cr1  1  0.29551600  0.29551600  0.83499200  1.0
  Cr  Cr2  1  0.70448400  0.70448400  0.16500800  1.0
  Cr  Cr3  1  0.34187600  0.34187600  0.47995300  1.0
  Cr  Cr4  1  0.65812400  0.65812400  0.52004700  1.0
  In  In5  1  0.50000000  0.50000000  0.00000000  1.0
  Se  Se6  1  0.16954100  0.16954100  0.00875500  1.0
  Se  Se7  1  0.83045900  0.83045900  0.99124500  1.0
  Se  Se8  1  0.23925500  0.23925500  0.34194400  1.0
  Se  Se9  1  0.76074500  0.76074500  0.65805600  1.0
  Se  Se10  1  0.08620200  0.08620200  0.67375300  1.0
  Se  Se11  1  0.91379800  0.91379800  0.32624700  1.0
  Se  Se12  1  0.42588000  0.42588000  0.65906200  1.0
  Se  Se13  1  0.57412000  0.57412000  0.34093800  1.0