data_LiTcGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.8
_cell_length_b   6.62
_cell_length_c   2.76
_cell_angle_alpha   81.72
_cell_angle_beta   74.63
_cell_angle_gamma   23.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTcGe
_chemical_formula_sum   'Li1 Tc1 Ge1'
_cell_volume   46.38
_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  0.62  0.23  0.57  1.0
  Tc  Tc2  1  0.62  0.23  0.37  1.0
  Ge  Ge0  1  0.62  0.23  0.74  1.0

data_LiTcGe
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.24
_cell_length_b   12.84
_cell_length_c   2.76
_cell_angle_alpha   90.0
_cell_angle_beta   126.03
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   LiTcGe
_chemical_formula_sum   'Li2 Tc2 Ge2'
_cell_volume   92.75
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.23  0.0  0.81  1.0
  Tc  Tc1  2  0.23  0.0  0.01  1.0
  Ge  Ge2  2  0.23  0.0  0.64  1.0

Li Tc Ge