data_TaGe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.55
_cell_length_b   6.59
_cell_length_c   2.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaGe2
_chemical_formula_sum   'Ta2 Ge4'
_cell_volume   119.67
_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
  Ta  Ta4  1  0.0  0.0  0.0  1.0
  Ta  Ta5  1  0.27  0.3  0.39  1.0
  Ge  Ge0  1  0.03  0.09  0.0  1.0
  Ge  Ge1  1  0.52  0.5  0.0  1.0
  Ge  Ge2  1  0.3  0.8  0.39  1.0
  Ge  Ge3  1  0.24  0.8  0.39  1.0

data_TaGe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.77
_cell_length_b   6.55
_cell_length_c   6.59
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaGe2
_chemical_formula_sum   'Ta2 Ge4'
_cell_volume   119.67
_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
  Ta  Ta0  1  0.0  0.0  0.0  1.0
  Ta  Ta1  1  0.39  0.27  0.3  1.0
  Ge  Ge2  1  -0.0  0.52  0.5  1.0
  Ge  Ge3  1  -0.0  0.03  0.09  1.0
  Ge  Ge4  1  0.39  0.24  0.8  1.0
  Ge  Ge5  1  0.39  0.3  0.8  1.0

Ta Ta Ge Ge Ge Ge