data_GeTe3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.88
_cell_length_b   5.88
_cell_length_c   5.88
_cell_angle_alpha   138.95
_cell_angle_beta   89.93
_cell_angle_gamma   104.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GeTe3
_chemical_formula_sum   'Ge1 Te3'
_cell_volume   124.06
_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
  Ge  Ge0  1  0.0  0.0  0.15  1.0
  Te  Te1  1  0.0  0.16  0.23  1.0
  Te  Te2  1  0.0  0.18  0.33  1.0
  Te  Te3  1  0.06  0.98  0.72  1.0

data_GeTe3
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.13
_cell_length_b   5.88
_cell_length_c   5.88
_cell_angle_alpha   75.7
_cell_angle_beta   69.48
_cell_angle_gamma   69.48
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GeTe3
_chemical_formula_sum   'Ge1 Te3'
_cell_volume   124.06
_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
  Ge  Ge0  1  0.85  0.0  0.15  1.0
  Te  Te1  1  0.28  0.06  0.74  1.0
  Te  Te2  1  0.67  0.0  0.15  1.0
  Te  Te3  1  0.77  0.0  0.07  1.0

Ge Te Te Te
Ge Te Te Te 0 1 o o o 0 2 o o o 0 3 o - - 1 2 o o o 1 3 o - - 2 3 o - - 