data_GePBr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.86
_cell_length_b   6.37
_cell_length_c   3.67
_cell_angle_alpha   81.56
_cell_angle_beta   66.54
_cell_angle_gamma   31.9
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GePBr
_chemical_formula_sum   'Ge1 P1 Br1'
_cell_volume   71.36
_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  Ge1  1  0.85  0.16  0.37  1.0
  P  P2  1  0.85  0.16  0.73  1.0
  Br  Br0  1  0.85  0.16  0.08  1.0

data_GePBr
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.7
_cell_length_b   12.18
_cell_length_c   3.67
_cell_angle_alpha   90.0
_cell_angle_beta   120.32
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   GePBr
_chemical_formula_sum   'Ge2 P2 Br2'
_cell_volume   142.72
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.16  0.0  0.78  1.0
  P  P1  2  0.16  0.0  0.42  1.0
  Br  Br2  2  0.16  0.0  0.07  1.0

Ge P Br