The crystal structure described by Sc6Co2In crystallizes in the orthorhombic Immm space group. There are three inequivalent Sc sites. In the first Sc site, Sc(1) is bonded in a 4-coordinate geometry to one Co(1), one Co(2), one In(1), and one In(2) atom. In the second Sc site, Sc(2) is bonded in a 4-coordinate geometry to one Co(2), two equivalent Co(1), and one In(1) atom. In the third Sc site, Sc(3) is bonded in a 5-coordinate geometry to one Co(1), two equivalent Co(2), one In(1), and one In(2) atom. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 9-coordinate geometry to two equivalent Sc(1), two equivalent Sc(3), four equivalent Sc(2), and one Co(1) atom. In the second Co site, Co(2) is bonded in a 9-coordinate geometry to two equivalent Sc(1), two equivalent Sc(2), four equivalent Sc(3), and one Co(2) atom. There are two inequivalent In sites. In the first In site, In(1) is bonded in a cuboctahedral geometry to four equivalent Sc(1), four equivalent Sc(2), and four equivalent Sc(3) atoms. In the second In site, In(2) is bonded in a distorted body-centered cubic geometry to four equivalent Sc(1) and four equivalent Sc(3) atoms. is represented by the CIF card [CIF]
data_Sc6InCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.818
_cell_length_b   7.818
_cell_length_c   7.818
_cell_angle_alpha   110.724
_cell_angle_beta   110.733
_cell_angle_gamma   106.985
_symmetry_Int_Tables_number   1
_cell_volume   367.332
_cell_formula_units_Z   2
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  0.452  0.234  0.218  1.0
  Sc  Sc1  1  0.548  0.766  0.782  1.0
  Sc  Sc2  1  0.017  0.234  0.782  1.0
  Sc  Sc3  1  0.983  0.766  0.218  1.0
  Sc  Sc4  1  0.312  0.610  0.297  1.0
  Sc  Sc5  1  0.688  0.390  0.703  1.0
  Sc  Sc6  1  0.312  0.015  0.703  1.0
  Sc  Sc7  1  0.688  0.985  0.297  1.0
  Sc  Sc8  1  0.191  0.286  0.477  1.0
  Sc  Sc9  1  0.809  0.714  0.523  1.0
  Sc  Sc10  1  0.191  0.714  0.905  1.0
  Sc  Sc11  1  0.809  0.286  0.095  1.0
  In  In12  1  0.500  0.500  1.000  1.0
  In  In13  1  0.000  1.000  1.000  1.0
  Co  Co14  1  0.374  1.000  0.374  1.0
  Co  Co15  1  0.626  0.000  0.626  1.0
  Co  Co16  1  0.116  0.616  0.500  1.0
  Co  Co17  1  0.884  0.384  0.500  1.0
[/CIF]
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The crystal structure described by Sc6Co2In crystallizes in the orthorhombic Immm space group. There are three inequivalent Sc sites. In the first Sc site, Sc(1) is bonded in a 4-coordinate geometry to one Co(1), one Co(2), one In(1), and one In(2) atom. In the second Sc site, Sc(2) is bonded in a 4-coordinate geometry to one Co(2), two equivalent Co(1), and one In(1) atom. In the third Sc site, Sc(3) is bonded in a 5-coordinate geometry to one Co(1), two equivalent Co(2), one In(1), and one In(2) atom. There are two inequivalent Co sites. In the first Co site, Co(1) is bonded in a 9-coordinate geometry to two equivalent Sc(1), two equivalent Sc(3), four equivalent Sc(2), and one Co(1) atom. In the second Co site, Co(2) is bonded in a 9-coordinate geometry to two equivalent Sc(1), two equivalent Sc(2), four equivalent Sc(3), and one Co(2) atom. There are two inequivalent In sites. In the first In site, In(1) is bonded in a cuboctahedral geometry to four equivalent Sc(1), four equivalent Sc(2), and four equivalent Sc(3) atoms. In the second In site, In(2) is bonded in a distorted body-centered cubic geometry to four equivalent Sc(1) and four equivalent Sc(3) atoms. is represented by the CIF card [CIF]
data_Sc6InCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.818
_cell_length_b   7.818
_cell_length_c   7.818
_cell_angle_alpha   110.724
_cell_angle_beta   110.733
_cell_angle_gamma   106.985
_symmetry_Int_Tables_number   1
_cell_volume   367.332
_cell_formula_units_Z   2
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  0.452  0.234  0.218  1.0
  Sc  Sc1  1  0.548  0.766  0.782  1.0
  Sc  Sc2  1  0.017  0.234  0.782  1.0
  Sc  Sc3  1  0.983  0.766  0.218  1.0
  Sc  Sc4  1  0.312  0.610  0.297  1.0
  Sc  Sc5  1  0.688  0.390  0.703  1.0
  Sc  Sc6  1  0.312  0.015  0.703  1.0
  Sc  Sc7  1  0.688  0.985  0.297  1.0
  Sc  Sc8  1  0.191  0.286  0.477  1.0
  Sc  Sc9  1  0.809  0.714  0.523  1.0
  Sc  Sc10  1  0.191  0.714  0.905  1.0
  Sc  Sc11  1  0.809  0.286  0.095  1.0
  In  In12  1  0.500  0.500  1.000  1.0
  In  In13  1  0.000  1.000  1.000  1.0
  Co  Co14  1  0.374  1.000  0.374  1.0
  Co  Co15  1  0.626  0.000  0.626  1.0
  Co  Co16  1  0.116  0.616  0.500  1.0
  Co  Co17  1  0.884  0.384  0.500  1.0
[/CIF]
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