data_Tc3Ge
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.88
_cell_length_b   4.39
_cell_length_c   4.66
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc3Ge
_chemical_formula_sum   'Tc3 Ge1'
_cell_volume   58.98
_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  0.44  0.0  0.48  1.0
  Tc  Tc2  1  0.44  0.2  0.81  1.0
  Tc  Tc3  1  0.0  0.2  0.43  1.0
  Ge  Ge0  1  0.0  0.0  0.04  1.0

data_Tc3Ge
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.88
_cell_length_b   4.39
_cell_length_c   4.66
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc3Ge
_chemical_formula_sum   'Tc3 Ge1'
_cell_volume   58.98
_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  0.2  0.43  1.0
  Tc  Tc1  1  0.44  0.0  0.48  1.0
  Tc  Tc2  1  0.44  0.2  0.81  1.0
  Ge  Ge3  1  0.0  0.0  0.04  1.0

Tc Tc Tc Ge
Tc Tc Tc Ge 0 2 o o o 0 2 + o o 0 1 o o o 1 3 o o + 1 3 + o + 1 2 o o o 2 3 o o o 