data_YCrRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.1
_cell_length_b   5.1
_cell_length_c   5.1
_cell_angle_alpha   134.62
_cell_angle_beta   134.62
_cell_angle_gamma   66.12
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YCrRh2
_chemical_formula_sum   'Y1 Cr1 Rh2'
_cell_volume   66.16
_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  0.0  0.97  0.14  1.0
  Cr  Cr0  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.97  0.0  0.14  1.0
  Rh  Rh2  1  0.0  0.0  0.27  1.0

data_YCrRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.93
_cell_length_b   3.93
_cell_length_c   5.1
_cell_angle_alpha   112.69
_cell_angle_beta   112.69
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YCrRh2
_chemical_formula_sum   'Y1 Cr1 Rh2'
_cell_volume   66.16
_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  0.83  0.97  0.83  1.0
  Cr  Cr1  1  0.0  0.0  0.0  1.0
  Rh  Rh2  1  0.73  0.0  0.73  1.0
  Rh  Rh3  1  0.86  0.0  0.83  1.0

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