data_AgGe2Bi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.14
_cell_length_b   6.14
_cell_length_c   6.14
_cell_angle_alpha   149.95
_cell_angle_beta   128.73
_cell_angle_gamma   60.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgGe2Bi
_chemical_formula_sum   'Ag1 Ge2 Bi1'
_cell_volume   89.64
_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
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Ge  Ge2  1  0.59  0.0  0.44  1.0
  Ge  Ge3  1  0.0  0.66  0.86  1.0
  Bi  Bi1  1  0.0  0.0  0.3  1.0

data_AgGe2Bi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.18
_cell_length_b   5.31
_cell_length_c   6.14
_cell_angle_alpha   115.63
_cell_angle_beta   105.03
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgGe2Bi
_chemical_formula_sum   'Ag1 Ge2 Bi1'
_cell_volume   89.64
_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
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Ge  Ge1  1  0.14  0.8  0.8  1.0
  Ge  Ge2  1  0.15  0.56  0.15  1.0
  Bi  Bi3  1  0.7  0.7  0.7  1.0

Ag Ge Ge Bi