data_Tc2TeRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   4.72
_cell_angle_alpha   97.0
_cell_angle_beta   97.0
_cell_angle_gamma   36.16
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2TeRh
_chemical_formula_sum   'Tc2 Te1 Rh1'
_cell_volume   65.08
_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  Tc1  1  0.6  0.0  0.62  1.0
  Tc  Tc2  1  0.97  0.0  0.67  1.0
  Te  Te3  1  0.33  0.0  0.31  1.0
  Rh  Rh0  1  0.65  0.0  0.11  1.0

data_Tc2TeRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.01
_cell_length_b   4.72
_cell_length_c   4.85
_cell_angle_alpha   97.0
_cell_angle_beta   108.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc2TeRh
_chemical_formula_sum   'Tc2 Te1 Rh1'
_cell_volume   65.08
_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  0.62  0.6  1.0
  Tc  Tc1  1  0.0  0.67  0.97  1.0
  Te  Te2  1  0.0  0.31  0.33  1.0
  Rh  Rh3  1  0.0  0.11  0.65  1.0

Tc Tc Te Rh
Tc Tc Te Rh 0 2 o o o 0 1 o o o 0 3 o o + 2 3 o o o 