data_GaAsRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.87
_cell_length_b   7.87
_cell_length_c   7.87
_cell_angle_alpha   22.15
_cell_angle_beta   22.15
_cell_angle_gamma   22.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaAsRh2
_chemical_formula_sum   'Ga1 As1 Rh2'
_cell_volume   60.7
_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
  Ga  Ga1  1  0.0  0.0  0.0  1.0
  As  As0  1  0.0  0.0  0.51  1.0
  Rh  Rh2  1  0.0  0.0  0.3  1.0
  Rh  Rh3  1  0.0  0.0  0.72  1.0

data_GaAsRh2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.24
_cell_length_b   3.02
_cell_length_c   7.87
_cell_angle_alpha   90.0
_cell_angle_beta   102.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   GaAsRh2
_chemical_formula_sum   'Ga2 As2 Rh4'
_cell_volume   121.41
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Ga  Ga0  2  0.0  0.0  0.0  1.0
  As  As1  2  0.0  0.0  0.49  1.0
  Rh  Rh2  2  0.0  0.0  0.28  1.0
  Rh  Rh3  2  0.0  0.0  0.7  1.0

Ga As Rh Rh
Ga As Rh Rh 0 3 o o - 0 2 o o o 1 2 o o o 1 3 o o o 