data_[Ho9Tc24Mo3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Tc  1.9000  1.3500  0.7417
  Mo  2.1600  1.4500  0.7750
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.3137]
_cell_length_b [5.3137]
_cell_length_c [26.0462]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Ho3Tc8Mo]
_chemical_formula_sum '[Ho9 Tc24 Mo3]'
_cell_volume [636.8909]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.0012  1
  Ho  Ho1  3  0.0000  0.0000  0.4990  1
  Ho  Ho2  3  0.0000  0.0000  0.6256  1
  Tc  Tc3  9  0.0034  0.5017  0.0654  1
  Tc  Tc4  9  0.1688  0.8312  0.8930  1
  Tc  Tc5  3  0.0000  0.0000  0.3120  1
  Tc  Tc6  3  0.0000  0.0000  0.8125  1
  Mo  Mo7  3  0.0000  0.0000  0.1243  1
]