The material structure described by Sc3CoC4 crystallizes in the orthorhombic Immm space group. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded to eight equivalent C(1) atoms to form distorted face-sharing ScC8 hexagonal bipyramids. In the second Sc site, Sc(2) is bonded in a 6-coordinate geometry to six equivalent C(1) atoms. Co(1) is bonded in a square co-planar geometry to four equivalent C(1) atoms. C(1) is bonded in a 7-coordinate geometry to two equivalent Sc(1), three equivalent Sc(2), one Co(1), and one C(1) atom. is represented by the CIF file [CIF]
data_Sc3CoC4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.437
_cell_length_b   4.322
_cell_length_c   6.579
_cell_angle_alpha   109.176
_cell_angle_beta   105.141
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   88.715
_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  0.000  0.500  0.000  1.0
  Sc  Sc1  1  0.188  0.188  0.376  1.0
  Sc  Sc2  1  0.812  0.812  0.624  1.0
  Co  Co3  1  0.500  0.000  0.000  1.0
  C  C4  1  0.377  0.209  0.753  1.0
  C  C5  1  0.623  0.791  0.247  1.0
  C  C6  1  0.623  0.456  0.247  1.0
  C  C7  1  0.377  0.544  0.753  1.0
[/CIF]
.
The material structure described by Sc3CoC4 crystallizes in the orthorhombic Immm space group. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded to eight equivalent C(1) atoms to form distorted face-sharing ScC8 hexagonal bipyramids. In the second Sc site, Sc(2) is bonded in a 6-coordinate geometry to six equivalent C(1) atoms. Co(1) is bonded in a square co-planar geometry to four equivalent C(1) atoms. C(1) is bonded in a 7-coordinate geometry to two equivalent Sc(1), three equivalent Sc(2), one Co(1), and one C(1) atom. is represented by the CIF file [CIF]
data_Sc3CoC4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.437
_cell_length_b   4.322
_cell_length_c   6.579
_cell_angle_alpha   109.176
_cell_angle_beta   105.141
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   88.715
_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  0.000  0.500  0.000  1.0
  Sc  Sc1  1  0.188  0.188  0.376  1.0
  Sc  Sc2  1  0.812  0.812  0.624  1.0
  Co  Co3  1  0.500  0.000  0.000  1.0
  C  C4  1  0.377  0.209  0.753  1.0
  C  C5  1  0.623  0.791  0.247  1.0
  C  C6  1  0.623  0.456  0.247  1.0
  C  C7  1  0.377  0.544  0.753  1.0
[/CIF]
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