data_YOsRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.91
_cell_length_b   4.91
_cell_length_c   5.07
_cell_angle_alpha   100.84
_cell_angle_beta   100.84
_cell_angle_gamma   34.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YOsRh2
_chemical_formula_sum   'Y1 Os1 Rh2'
_cell_volume   68.16
_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  Y3  1  0.16  0.0  0.57  1.0
  Os  Os0  1  0.76  0.0  0.93  1.0
  Rh  Rh1  1  1.0  0.0  0.17  1.0
  Rh  Rh2  1  0.64  0.0  0.79  1.0

data_YOsRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.93
_cell_length_b   4.91
_cell_length_c   5.07
_cell_angle_alpha   100.84
_cell_angle_beta   90.0
_cell_angle_gamma   107.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YOsRh2
_chemical_formula_sum   'Y1 Os1 Rh2'
_cell_volume   68.16
_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  0.0  0.84  0.43  1.0
  Os  Os1  1  0.0  0.24  0.07  1.0
  Rh  Rh2  1  0.0  0.0  0.83  1.0
  Rh  Rh3  1  0.0  0.36  0.21  1.0

Y Os Rh Rh
Y Os Rh Rh 0 2 - o o 0 3 o o o 1 3 o o o 1 2 o o + 