The compound described by Sc crystallizes in the monoclinic C2/m space group. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded in a 11-coordinate geometry to five equivalent Sc(1) and six equivalent Sc(2) atoms. In the second Sc site, Sc(2) is bonded in a 14-coordinate geometry to two equivalent Sc(2) and twelve equivalent Sc(1) atoms. is represented by the CIF file [CIF]
data_Sc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.201
_cell_length_b   5.001
_cell_length_c   5.064
_cell_angle_alpha   119.584
_cell_angle_beta   90.054
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   70.488
_cell_formula_units_Z   3
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  0.995  0.333  0.666  1.0
  Sc  Sc1  1  0.500  0.000  0.000  1.0
  Sc  Sc2  1  0.005  0.667  0.334  1.0
[/CIF]
.
The compound described by Sc crystallizes in the monoclinic C2/m space group. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded in a 11-coordinate geometry to five equivalent Sc(1) and six equivalent Sc(2) atoms. In the second Sc site, Sc(2) is bonded in a 14-coordinate geometry to two equivalent Sc(2) and twelve equivalent Sc(1) atoms. is represented by the CIF file [CIF]
data_Sc
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.201
_cell_length_b   5.001
_cell_length_c   5.064
_cell_angle_alpha   119.584
_cell_angle_beta   90.054
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   70.488
_cell_formula_units_Z   3
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  0.995  0.333  0.666  1.0
  Sc  Sc1  1  0.500  0.000  0.000  1.0
  Sc  Sc2  1  0.005  0.667  0.334  1.0
[/CIF]
.