data_GeTe2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.37
_cell_length_b   6.37
_cell_length_c   3.99
_cell_angle_alpha   105.4
_cell_angle_beta   105.4
_cell_angle_gamma   37.57
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GeTe2Pd
_chemical_formula_sum   'Ge1 Te2 Pd1'
_cell_volume   94.83
_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  0.78  0.0  0.81  1.0
  Te  Te2  1  0.67  0.0  0.74  1.0
  Te  Te3  1  0.82  0.0  0.12  1.0
  Pd  Pd1  1  0.08  0.0  0.91  1.0

data_GeTe2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.99
_cell_length_b   4.1
_cell_length_c   6.37
_cell_angle_alpha   108.78
_cell_angle_beta   105.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GeTe2Pd
_chemical_formula_sum   'Ge1 Te2 Pd1'
_cell_volume   94.83
_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  0.19  0.0  0.22  1.0
  Te  Te1  1  0.26  0.0  0.33  1.0
  Te  Te2  1  0.88  0.0  0.18  1.0
  Pd  Pd3  1  0.09  0.0  0.92  1.0

Ge Te Te Pd