data_ScMo2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.98
_cell_length_b   2.98
_cell_length_c   9.27
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   108.6
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScMo2Pb
_chemical_formula_sum   'Sc1 Mo2 Pb1'
_cell_volume   77.97
_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  Sc3  1  0.0  0.0  0.0  1.0
  Mo  Mo0  1  0.74  0.0  0.3  1.0
  Mo  Mo1  1  0.74  0.0  0.98  1.0
  Pb  Pb2  1  0.0  0.0  0.64  1.0

data_ScMo2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.98
_cell_length_b   2.98
_cell_length_c   9.27
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   108.6
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScMo2Pb
_chemical_formula_sum   'Sc1 Mo2 Pb1'
_cell_volume   77.97
_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  0.0  1.0
  Mo  Mo1  1  0.74  0.0  0.3  1.0
  Mo  Mo2  1  0.74  0.0  0.98  1.0
  Pb  Pb3  1  0.0  0.0  0.64  1.0

Sc Mo Mo Pb
ScMo2Pb crystallizes in the triclinic P1 space group. Sc(1) is bonded in a distorted single-bond geometry to one Mo(1), one Mo(2), and one Pb(1) atom. The Sc(1)-Mo(1) bond length is 2.85 Å. The Sc(1)-Mo(2) bond length is 0.81 Å. The Sc(1)-Pb(1) bond length is 3.38 Å. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 1-coordinate geometry to one Sc(1) and one Pb(1) atom. The Mo(1)-Pb(1) bond length is 3.25 Å. In the second Mo site, Mo(2) is bonded in a distorted single-bond geometry to one Sc(1) and one Pb(1) atom. The Mo(2)-Pb(1) bond length is 3.25 Å. Pb(1) is bonded in a 7-coordinate geometry to one Sc(1), one Mo(1), one Mo(2), and four equivalent Pb(1) atoms. All Pb(1)-Pb(1) bond lengths are 2.98 Å.