data_[Y6Hg2Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Hg  2.0000  1.5000  1.2450
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.5412]
_cell_length_b [6.2282]
_cell_length_c [8.7038]
_cell_angle_alpha [100.3432]
_cell_angle_beta [99.7410]
_cell_angle_gamma [114.4938]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Y3HgRh]
_chemical_formula_sum '[Y6 Hg2 Rh2]'
_cell_volume [258.7600]
_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
[
  Y  Y0  2  0.1998  0.6987  0.8940  1.0
  Y  Y1  2  0.2086  0.0503  0.2686  1.0
  Y  Y2  2  0.4517  0.3206  0.7100  1.0
  Hg  Hg3  2  0.1622  0.7564  0.5258  1.0
  Rh  Rh4  2  0.2571  0.2591  0.0030  1.0
]