# generated using pymatgen
data_Ho4BCl6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.81468337
_cell_length_b   12.51276527
_cell_length_c   12.95558870
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ho4BCl6
_chemical_formula_sum   'Ho8 B2 Cl12'
_cell_volume   618.39923869
_cell_formula_units_Z   2
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  0.00000000  0.10657403  0.08453310  1.0
  Ho  Ho1  1  0.00000000  0.89342597  0.91546690  1.0
  Ho  Ho2  1  0.00000000  0.60657403  0.41546690  1.0
  Ho  Ho3  1  0.00000000  0.39342597  0.58453310  1.0
  Ho  Ho4  1  0.50000000  0.12640208  0.85124472  1.0
  Ho  Ho5  1  0.50000000  0.87359792  0.14875528  1.0
  Ho  Ho6  1  0.50000000  0.62640208  0.64875528  1.0
  Ho  Ho7  1  0.50000000  0.37359792  0.35124472  1.0
  B  B8  1  0.50000000  0.00000000  0.00000000  1.0
  B  B9  1  0.50000000  0.50000000  0.50000000  1.0
  Cl  Cl10  1  0.50000000  0.26749006  0.68361870  1.0
  Cl  Cl11  1  0.50000000  0.73250994  0.31638130  1.0
  Cl  Cl12  1  0.50000000  0.76749006  0.81638130  1.0
  Cl  Cl13  1  0.50000000  0.23250994  0.18361870  1.0
  Cl  Cl14  1  0.00000000  0.25766521  0.92936449  1.0
  Cl  Cl15  1  0.00000000  0.74233479  0.07063551  1.0
  Cl  Cl16  1  0.00000000  0.47866747  0.24222964  1.0
  Cl  Cl17  1  0.00000000  0.52133253  0.75777036  1.0
  Cl  Cl18  1  0.00000000  0.97866747  0.25777036  1.0
  Cl  Cl19  1  0.00000000  0.02133253  0.74222964  1.0
  Cl  Cl20  1  0.00000000  0.24233479  0.42936449  1.0
  Cl  Cl21  1  0.00000000  0.75766521  0.57063551  1.0