data_KAlRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.4
_cell_length_b   5.4
_cell_length_c   5.32
_cell_angle_alpha   99.01
_cell_angle_beta   99.01
_cell_angle_gamma   33.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAlRh2
_chemical_formula_sum   'K1 Al1 Rh2'
_cell_volume   83.93
_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
  K  K1  1  0.94  0.0  0.94  1.0
  Al  Al0  1  0.74  0.0  0.63  1.0
  Rh  Rh2  1  0.13  0.0  0.25  1.0
  Rh  Rh3  1  0.54  0.0  0.31  1.0

data_KAlRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.09
_cell_length_b   5.32
_cell_length_c   5.4
_cell_angle_alpha   99.01
_cell_angle_beta   106.61
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAlRh2
_chemical_formula_sum   'K1 Al1 Rh2'
_cell_volume   83.93
_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
  K  K0  1  0.0  0.94  0.94  1.0
  Al  Al1  1  0.0  0.63  0.74  1.0
  Rh  Rh2  1  0.0  0.25  0.13  1.0
  Rh  Rh3  1  0.0  0.31  0.54  1.0

K Al Rh Rh
K Al Rh Rh 0 1 o o o 0 2 + o + 1 3 o o o 2 3 o o o 