data_ZnFeGe2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.26
_cell_length_b   4.26
_cell_length_c   4.95
_cell_angle_alpha   99.31
_cell_angle_beta   99.31
_cell_angle_gamma   41.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnFeGe2
_chemical_formula_sum   'Zn1 Fe1 Ge2'
_cell_volume   58.9
_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
  Zn  Zn3  1  0.56  0.0  0.44  1.0
  Fe  Fe0  1  0.0  0.0  0.0  1.0
  Ge  Ge1  1  0.44  0.0  0.83  1.0
  Ge  Ge2  1  0.67  0.0  0.05  1.0

data_ZnFeGe2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.03
_cell_length_b   4.26
_cell_length_c   4.95
_cell_angle_alpha   99.31
_cell_angle_beta   90.0
_cell_angle_gamma   110.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnFeGe2
_chemical_formula_sum   'Zn1 Fe1 Ge2'
_cell_volume   58.9
_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
  Zn  Zn0  1  0.0  0.44  0.56  1.0
  Fe  Fe1  1  0.0  0.0  0.0  1.0
  Ge  Ge2  1  0.0  0.33  0.95  1.0
  Ge  Ge3  1  0.0  0.56  0.17  1.0

Zn Fe Ge Ge