data_TcNi2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.64
_cell_length_b   3.68
_cell_length_c   5.2
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcNi2Rh
_chemical_formula_sum   'Tc1 Ni2 Rh1'
_cell_volume   50.48
_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
  Tc  Tc3  1  0.0  0.0  0.0  1.0
  Ni  Ni0  1  0.32  0.84  0.26  1.0
  Ni  Ni1  1  0.32  0.84  0.95  1.0
  Rh  Rh2  1  0.0  0.0  0.6  1.0

data_TcNi2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.64
_cell_length_b   3.68
_cell_length_c   5.2
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcNi2Rh
_chemical_formula_sum   'Tc1 Ni2 Rh1'
_cell_volume   50.48
_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
  Tc  Tc0  1  0.0  0.0  0.0  1.0
  Ni  Ni1  1  0.32  0.84  0.26  1.0
  Ni  Ni2  1  0.32  0.84  0.95  1.0
  Rh  Rh3  1  0.0  0.0  0.6  1.0

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