data_Sc2ZnGe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.25
_cell_length_b   3.25
_cell_length_c   7.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   94.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2ZnGe
_chemical_formula_sum   'Sc2 Zn1 Ge1'
_cell_volume   79.97
_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
  Sc  Sc1  1  0.0  0.0  0.22  1.0
  Sc  Sc2  1  0.21  0.0  0.44  1.0
  Zn  Zn3  1  0.0  0.0  0.62  1.0
  Ge  Ge0  1  0.21  0.0  0.12  1.0

data_Sc2ZnGe
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.25
_cell_length_b   3.25
_cell_length_c   7.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   94.22
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2ZnGe
_chemical_formula_sum   'Sc2 Zn1 Ge1'
_cell_volume   79.97
_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
  Sc  Sc0  1  0.0  0.0  0.22  1.0
  Sc  Sc1  1  0.21  0.0  0.44  1.0
  Zn  Zn2  1  0.0  0.0  0.62  1.0
  Ge  Ge3  1  0.21  0.0  0.12  1.0

Sc Sc Zn Ge
Sc Sc Zn Ge 0 3 o o o 1 2 o o o 
ScZnScGe crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one ScGe cluster and one ScZn cluster. In the ScGe cluster, Sc(1) is bonded in a single-bond geometry to one Ge(1) atom. The Sc(1)-Ge(1) bond length is 1.06 Å. Ge(1) is bonded in a single-bond geometry to one Sc(1) atom. In the ScZn cluster, Sc(2) is bonded in a distorted single-bond geometry to one Zn(1) atom. The Sc(2)-Zn(1) bond length is 1.48 Å. Zn(1) is bonded in a single-bond geometry to one Sc(2) atom.