data_TcGe2Sb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.81
_cell_length_b   4.81
_cell_length_c   3.31
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   107.24
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcGe2Sb
_chemical_formula_sum   'Tc1 Ge2 Sb1'
_cell_volume   72.94
_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
  Ge  Ge0  1  0.43  0.93  0.65  1.0
  Ge  Ge1  1  0.43  0.07  0.65  1.0
  Sb  Sb2  1  0.85  0.0  0.0  1.0

data_TcGe2Sb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.31
_cell_length_b   4.81
_cell_length_c   4.81
_cell_angle_alpha   107.24
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TcGe2Sb
_chemical_formula_sum   'Tc1 Ge2 Sb1'
_cell_volume   72.94
_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
  Ge  Ge1  1  0.65  0.43  0.93  1.0
  Ge  Ge2  1  0.65  0.43  0.07  1.0
  Sb  Sb3  1  0.0  0.85  0.0  1.0

Tc Ge Ge Sb