data_[Dy3Be51Mo3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Dy  1.2200  1.7500  1.1310
  Be  1.5700  1.0500  0.5900
  Mo  2.1600  1.4500  0.7750
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [7.4854]
_cell_length_b [7.4854]
_cell_length_c [10.9132]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [DyBe17Mo]
_chemical_formula_sum '[Dy3 Be51 Mo3]'
_cell_volume [529.5545]
_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
[
  Dy  Dy0  3  0.0000  0.0000  0.3390  1
  Be  Be1  18  0.0472  0.3757  0.6669  1
  Be  Be2  9  0.0020  0.5010  0.4987  1
  Be  Be3  9  0.1687  0.3374  0.4921  1
  Be  Be4  9  0.1709  0.3417  0.1779  1
  Be  Be5  3  0.0000  0.0000  0.0915  1
  Be  Be6  3  0.0000  0.0000  0.8984  1
  Mo  Mo7  3  0.0000  0.0000  0.6636  1
]