data_TmCuGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.21
_cell_length_b   4.21
_cell_length_c   7.23
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmCuGe
_chemical_formula_sum   'Tm2 Cu2 Ge2'
_cell_volume   110.94
_cell_formula_units_Z   2
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
  Tm  Tm4  1  0.0  0.0  0.0  1.0
  Tm  Tm5  1  0.0  0.0  0.61  1.0
  Cu  Cu0  1  0.0  0.43  0.81  1.0
  Cu  Cu1  1  0.11  0.22  0.42  1.0
  Ge  Ge2  1  0.11  0.22  0.81  1.0
  Ge  Ge3  1  0.0  0.43  0.42  1.0

data_TmCuGe
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.21
_cell_length_b   4.21
_cell_length_c   7.23
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmCuGe
_chemical_formula_sum   'Tm2 Cu2 Ge2'
_cell_volume   110.94
_cell_formula_units_Z   2
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
  Tm  Tm0  1  0.0  0.0  0.0  1.0
  Tm  Tm1  1  0.0  0.0  0.61  1.0
  Cu  Cu2  1  0.0  0.43  0.81  1.0
  Cu  Cu3  1  0.11  0.22  0.42  1.0
  Ge  Ge4  1  0.0  0.43  0.42  1.0
  Ge  Ge5  1  0.11  0.22  0.81  1.0

Tm Tm Cu Cu Ge Ge