data_LiTc2Ge
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.49
_cell_length_b   4.49
_cell_length_c   4.66
_cell_angle_alpha   97.85
_cell_angle_beta   97.85
_cell_angle_gamma   37.26
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTc2Ge
_chemical_formula_sum   'Li1 Tc2 Ge1'
_cell_volume   56.28
_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
  Li  Li1  1  0.24  0.0  0.23  1.0
  Tc  Tc2  1  0.82  0.0  0.56  1.0
  Tc  Tc3  1  0.58  0.0  0.51  1.0
  Ge  Ge0  1  0.96  0.0  0.23  1.0

data_LiTc2Ge
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.87
_cell_length_b   4.49
_cell_length_c   4.66
_cell_angle_alpha   97.85
_cell_angle_beta   90.0
_cell_angle_gamma   108.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTc2Ge
_chemical_formula_sum   'Li1 Tc2 Ge1'
_cell_volume   56.28
_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
  Li  Li0  1  0.0  0.76  0.77  1.0
  Tc  Tc1  1  0.0  0.18  0.44  1.0
  Tc  Tc2  1  0.0  0.42  0.49  1.0
  Ge  Ge3  1  0.0  0.04  0.77  1.0

Li Tc Tc Ge