data_Tc3Ge
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01
_cell_length_b   5.01
_cell_length_c   5.01
_cell_angle_alpha   116.57
_cell_angle_beta   116.57
_cell_angle_gamma   116.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc3Ge
_chemical_formula_sum   'Tc3 Ge1'
_cell_volume   59.17
_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  0.87  0.77  0.94  1.0
  Tc  Tc2  1  0.13  0.77  0.94  1.0
  Tc  Tc3  1  0.0  0.46  0.94  1.0
  Ge  Ge0  1  0.0  0.0  0.0  1.0

data_Tc3Ge
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   5.01
_cell_length_c   5.01
_cell_angle_alpha   116.57
_cell_angle_beta   100.8
_cell_angle_gamma   100.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tc3Ge
_chemical_formula_sum   'Tc3 Ge1'
_cell_volume   59.17
_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  0.94  0.07  0.17  1.0
  Tc  Tc1  1  0.94  0.81  0.17  1.0
  Tc  Tc2  1  0.94  0.94  0.48  1.0
  Ge  Ge3  1  0.0  0.0  0.0  1.0

Tc Tc Tc Ge