data_[Y4Be1Rh3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Y  1.2200  1.8000  1.0400
  Be  1.5700  1.0500  0.5900
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.9461]
_cell_length_b [4.0534]
_cell_length_c [10.7828]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Y4BeRh3]
_chemical_formula_sum '[Y4 Be1 Rh3]'
_cell_volume [172.4689]
_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
[
  Y  Y0  1  0.0000  0.0000  0.1432  1
  Y  Y1  1  0.0000  0.5000  0.8545  1
  Y  Y2  1  0.5000  0.0000  0.6401  1
  Y  Y3  1  0.5000  0.5000  0.3629  1
  Be  Be4  1  0.5000  0.5000  0.0534  1
  Rh  Rh5  1  0.0000  0.0000  0.4094  1
  Rh  Rh6  1  0.0000  0.5000  0.5892  1
  Rh  Rh7  1  0.5000  0.0000  0.9473  1
]