# generated using pymatgen
data_Hf18FeRe8Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.53111839
_cell_length_b   8.53111696
_cell_length_c   8.57433842
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999410
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf18FeRe8Se
_chemical_formula_sum   'Hf18 Fe1 Re8 Se1'
_cell_volume   540.43459657
_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
  Hf  Hf0  1  0.19115579  0.80884421  0.45229394  1.0
  Hf  Hf1  1  0.19115579  0.38231258  0.45229394  1.0
  Hf  Hf2  1  0.61768742  0.80884421  0.45229394  1.0
  Hf  Hf3  1  0.79947102  0.20052898  0.55886134  1.0
  Hf  Hf4  1  0.79947102  0.59894204  0.55886134  1.0
  Hf  Hf5  1  0.40105796  0.20052898  0.55886134  1.0
  Hf  Hf6  1  0.79947102  0.20052898  0.94113866  1.0
  Hf  Hf7  1  0.79947102  0.59894204  0.94113866  1.0
  Hf  Hf8  1  0.40105796  0.20052898  0.94113866  1.0
  Hf  Hf9  1  0.19115579  0.80884421  0.04770606  1.0
  Hf  Hf10  1  0.19115579  0.38231258  0.04770606  1.0
  Hf  Hf11  1  0.61768742  0.80884421  0.04770606  1.0
  Hf  Hf12  1  0.54457574  0.45542426  0.25000000  1.0
  Hf  Hf13  1  0.54457574  0.08915048  0.25000000  1.0
  Hf  Hf14  1  0.91084952  0.45542426  0.25000000  1.0
  Hf  Hf15  1  0.45948924  0.54051076  0.75000000  1.0
  Hf  Hf16  1  0.45948924  0.91897748  0.75000000  1.0
  Hf  Hf17  1  0.08102252  0.54051076  0.75000000  1.0
  Fe  Fe18  1  0.66666700  0.33333300  0.75000000  1.0
  Re  Re19  1  0.88965079  0.11034921  0.25000000  1.0
  Re  Re20  1  0.88965079  0.77930158  0.25000000  1.0
  Re  Re21  1  0.22069842  0.11034921  0.25000000  1.0
  Re  Re22  1  0.11029678  0.88970322  0.75000000  1.0
  Re  Re23  1  0.11029678  0.22059356  0.75000000  1.0
  Re  Re24  1  0.77940644  0.88970322  0.75000000  1.0
  Re  Re25  1  0.00000000  0.00000000  0.50135463  1.0
  Re  Re26  1  0.00000000  0.00000000  0.99864537  1.0
  Se  Se27  1  0.33333300  0.66666700  0.25000000  1.0