data_ScTc2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.03
_cell_length_b   5.03
_cell_length_c   2.8
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   117.71
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTc2Rh
_chemical_formula_sum   'Sc1 Tc2 Rh1'
_cell_volume   62.67
_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
  Sc  Sc1  1  0.0  0.0  0.0  1.0
  Tc  Tc2  1  0.3  0.15  0.4  1.0
  Tc  Tc3  1  0.3  0.85  0.4  1.0
  Rh  Rh0  1  0.6  0.0  0.0  1.0

data_ScTc2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.8
_cell_length_b   5.03
_cell_length_c   5.03
_cell_angle_alpha   117.71
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScTc2Rh
_chemical_formula_sum   'Sc1 Tc2 Rh1'
_cell_volume   62.67
_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
  Sc  Sc0  1  0.0  0.0  0.0  1.0
  Tc  Tc1  1  0.4  0.3  0.15  1.0
  Tc  Tc2  1  0.4  0.3  0.85  1.0
  Rh  Rh3  1  0.0  0.6  0.0  1.0

Sc Tc Tc Rh
Sc Tc Tc Rh 0 3 - o o 0 1 o o - 0 1 o o o 1 2 o - o 2 3 o + o 2 3 o + + 