data_TaGeTe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.85
_cell_length_b   4.85
_cell_length_c   6.9
_cell_angle_alpha   99.26
_cell_angle_beta   99.26
_cell_angle_gamma   43.28
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaGeTe2
_chemical_formula_sum   'Ta1 Ge1 Te2'
_cell_volume   109.47
_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
  Ta  Ta1  1  0.3  0.0  0.32  1.0
  Ge  Ge0  1  0.72  0.0  0.79  1.0
  Te  Te2  1  0.27  0.0  0.61  1.0
  Te  Te3  1  0.43  0.0  0.47  1.0

data_TaGeTe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.57
_cell_length_b   4.85
_cell_length_c   6.9
_cell_angle_alpha   99.26
_cell_angle_beta   90.0
_cell_angle_gamma   111.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaGeTe2
_chemical_formula_sum   'Ta1 Ge1 Te2'
_cell_volume   109.47
_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
  Ta  Ta0  1  0.0  0.7  0.68  1.0
  Ge  Ge1  1  0.0  0.28  0.21  1.0
  Te  Te2  1  0.0  0.57  0.53  1.0
  Te  Te3  1  0.0  0.73  0.39  1.0

Ta Ge Te Te