# generated using pymatgen
data_Ho7FeI12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.63303313
_cell_length_b   9.63303336
_cell_length_c   9.63303323
_cell_angle_alpha   107.05682541
_cell_angle_beta   107.05682423
_cell_angle_gamma   107.05683085
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ho7FeI12
_chemical_formula_sum   'Ho7 Fe1 I12'
_cell_volume   743.29184282
_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
  Ho  Ho0  1  0.78761855  0.52042128  0.59023077  1.0
  Ho  Ho1  1  0.40976923  0.21238145  0.47957872  1.0
  Ho  Ho2  1  0.47957872  0.40976923  0.21238145  1.0
  Ho  Ho3  1  0.59023077  0.78761855  0.52042128  1.0
  Ho  Ho4  1  0.00000000  0.00000000  0.00000000  1.0
  Ho  Ho5  1  0.52042128  0.59023077  0.78761855  1.0
  Ho  Ho6  1  0.21238145  0.47957872  0.40976923  1.0
  Fe  Fe7  1  0.50000000  0.50000000  0.50000000  1.0
  I  I8  1  0.65911643  0.96409113  0.88624847  1.0
  I  I9  1  0.72789480  0.17803406  0.57255863  1.0
  I  I10  1  0.88624847  0.65911643  0.96409113  1.0
  I  I11  1  0.27210520  0.82196594  0.42744137  1.0
  I  I12  1  0.17803406  0.57255863  0.72789480  1.0
  I  I13  1  0.03590887  0.11375153  0.34088357  1.0
  I  I14  1  0.57255863  0.72789480  0.17803406  1.0
  I  I15  1  0.11375153  0.34088357  0.03590887  1.0
  I  I16  1  0.82196594  0.42744137  0.27210520  1.0
  I  I17  1  0.42744137  0.27210520  0.82196594  1.0
  I  I18  1  0.96409113  0.88624847  0.65911643  1.0
  I  I19  1  0.34088357  0.03590887  0.11375153  1.0