data_As2RhPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.11
_cell_length_b   4.11
_cell_length_c   6.48
_cell_angle_alpha   105.89
_cell_angle_beta   105.89
_cell_angle_gamma   55.05
_symmetry_Int_Tables_number   1
_chemical_formula_structural   As2RhPb
_chemical_formula_sum   'As2 Rh1 Pb1'
_cell_volume   85.22
_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
  As  As0  1  0.32  0.0  0.1  1.0
  As  As1  1  0.96  0.0  0.06  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0
  Pb  Pb2  1  0.64  0.0  0.08  1.0

data_As2RhPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.8
_cell_length_b   4.11
_cell_length_c   6.48
_cell_angle_alpha   105.89
_cell_angle_beta   90.0
_cell_angle_gamma   117.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   As2RhPb
_chemical_formula_sum   'As2 Rh1 Pb1'
_cell_volume   85.22
_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
  As  As0  1  0.0  0.04  0.94  1.0
  As  As1  1  0.0  0.68  0.9  1.0
  Rh  Rh2  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.0  0.36  0.92  1.0

As As Rh Pb
As As Rh Pb 0 2 o o o 0 1 - o o 0 3 o o o 1 2 + o o 1 3 o o o 