# generated using pymatgen
data_Fe23B6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.53846936
_cell_length_b   7.53846878
_cell_length_c   7.53842043
_cell_angle_alpha   60.00021688
_cell_angle_beta   60.00021940
_cell_angle_gamma   60.00070632
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Fe23B6
_chemical_formula_sum   'Fe23 B6'
_cell_volume   302.92521321
_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
  Fe  Fe0  1  -0.00000000  -0.00000000  0.00000000  1.0
  Fe  Fe1  1  0.24999547  0.24999447  0.25000553  1.0
  Fe  Fe2  1  0.75000453  0.75000553  0.74999447  1.0
  Fe  Fe3  1  0.34371769  0.00000175  0.00000145  1.0
  Fe  Fe4  1  0.00000000  0.00000000  0.34371742  1.0
  Fe  Fe5  1  0.34372160  0.65627840  0.00000000  1.0
  Fe  Fe6  1  0.00000175  0.34371769  0.65627911  1.0
  Fe  Fe7  1  -0.00000175  0.65628231  0.34372089  1.0
  Fe  Fe8  1  0.00000175  0.34371769  0.00000145  1.0
  Fe  Fe9  1  0.34371769  0.00000175  0.65627811  1.0
  Fe  Fe10  1  0.65627840  0.34372160  -0.00000000  1.0
  Fe  Fe11  1  -0.00000175  0.65628231  -0.00000145  1.0
  Fe  Fe12  1  0.65628231  -0.00000175  0.34372189  1.0
  Fe  Fe13  1  -0.00000000  -0.00000000  0.65628258  1.0
  Fe  Fe14  1  0.65628231  -0.00000175  -0.00000145  1.0
  Fe  Fe15  1  0.38289669  0.38289569  0.38289752  1.0
  Fe  Fe16  1  0.61710331  0.61710431  0.14868990  1.0
  Fe  Fe17  1  0.14868760  0.61710485  0.61710427  1.0
  Fe  Fe18  1  0.61710485  0.14868660  0.61710427  1.0
  Fe  Fe19  1  0.85131240  0.38289515  0.38289573  1.0
  Fe  Fe20  1  0.38289515  0.85131340  0.38289573  1.0
  Fe  Fe21  1  0.38289669  0.38289569  0.85131010  1.0
  Fe  Fe22  1  0.61710331  0.61710431  0.61710248  1.0
  B  B23  1  0.72520397  0.27479603  0.27479392  1.0
  B  B24  1  0.72520504  0.72520504  0.27479496  1.0
  B  B25  1  0.27479496  0.27479496  0.72520504  1.0
  B  B26  1  0.72520397  0.27479603  0.72520608  1.0
  B  B27  1  0.27479603  0.72520397  0.27479392  1.0
  B  B28  1  0.27479603  0.72520397  0.72520608  1.0