The material described by ScCoB4 crystallizes in the orthorhombic Pbam space group. Sc(1) is bonded in a 14-coordinate geometry to two equivalent B(3), four equivalent B(1), four equivalent B(2), and four equivalent B(4) atoms. Co(1) is bonded in a 10-coordinate geometry to two equivalent B(1), two equivalent B(2), two equivalent B(4), and four equivalent B(3) atoms. There are four inequivalent B sites. In the first B site, B(1) is bonded in a 9-coordinate geometry to four equivalent Sc(1), two equivalent Co(1), one B(2), and two equivalent B(4) atoms. In the second B site, B(2) is bonded in a 9-coordinate geometry to four equivalent Sc(1), two equivalent Co(1), one B(1), one B(2), and one B(3) atom. In the third B site, B(3) is bonded in a 9-coordinate geometry to two equivalent Sc(1), four equivalent Co(1), one B(2), one B(3), and one B(4) atom. In the fourth B site, B(4) is bonded in a 9-coordinate geometry to four equivalent Sc(1), two equivalent Co(1), one B(3), and two equivalent B(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_ScCoB4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.769
_cell_length_b   11.134
_cell_length_c   3.216
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   206.579
_cell_formula_units_Z   4
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  0.630  0.350  0.000  1.0
  Sc  Sc1  1  0.370  0.650  0.000  1.0
  Sc  Sc2  1  0.130  0.150  0.000  1.0
  Sc  Sc3  1  0.870  0.850  0.000  1.0
  Co  Co4  1  0.636  0.090  0.000  1.0
  Co  Co5  1  0.364  0.910  0.000  1.0
  Co  Co6  1  0.136  0.410  0.000  1.0
  Co  Co7  1  0.864  0.590  0.000  1.0
  B  B8  1  0.789  0.186  0.500  1.0
  B  B9  1  0.211  0.814  0.500  1.0
  B  B10  1  0.289  0.314  0.500  1.0
  B  B11  1  0.711  0.686  0.500  1.0
  B  B12  1  0.865  0.031  0.500  1.0
  B  B13  1  0.135  0.969  0.500  1.0
  B  B14  1  0.365  0.469  0.500  1.0
  B  B15  1  0.635  0.531  0.500  1.0
  B  B16  1  0.887  0.452  0.500  1.0
  B  B17  1  0.113  0.548  0.500  1.0
  B  B18  1  0.387  0.048  0.500  1.0
  B  B19  1  0.613  0.952  0.500  1.0
  B  B20  1  0.978  0.306  0.500  1.0
  B  B21  1  0.022  0.694  0.500  1.0
  B  B22  1  0.478  0.194  0.500  1.0
  B  B23  1  0.522  0.806  0.500  1.0
[/CIF]
.
The material described by ScCoB4 crystallizes in the orthorhombic Pbam space group. Sc(1) is bonded in a 14-coordinate geometry to two equivalent B(3), four equivalent B(1), four equivalent B(2), and four equivalent B(4) atoms. Co(1) is bonded in a 10-coordinate geometry to two equivalent B(1), two equivalent B(2), two equivalent B(4), and four equivalent B(3) atoms. There are four inequivalent B sites. In the first B site, B(1) is bonded in a 9-coordinate geometry to four equivalent Sc(1), two equivalent Co(1), one B(2), and two equivalent B(4) atoms. In the second B site, B(2) is bonded in a 9-coordinate geometry to four equivalent Sc(1), two equivalent Co(1), one B(1), one B(2), and one B(3) atom. In the third B site, B(3) is bonded in a 9-coordinate geometry to two equivalent Sc(1), four equivalent Co(1), one B(2), one B(3), and one B(4) atom. In the fourth B site, B(4) is bonded in a 9-coordinate geometry to four equivalent Sc(1), two equivalent Co(1), one B(3), and two equivalent B(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_ScCoB4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.769
_cell_length_b   11.134
_cell_length_c   3.216
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   206.579
_cell_formula_units_Z   4
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  0.630  0.350  0.000  1.0
  Sc  Sc1  1  0.370  0.650  0.000  1.0
  Sc  Sc2  1  0.130  0.150  0.000  1.0
  Sc  Sc3  1  0.870  0.850  0.000  1.0
  Co  Co4  1  0.636  0.090  0.000  1.0
  Co  Co5  1  0.364  0.910  0.000  1.0
  Co  Co6  1  0.136  0.410  0.000  1.0
  Co  Co7  1  0.864  0.590  0.000  1.0
  B  B8  1  0.789  0.186  0.500  1.0
  B  B9  1  0.211  0.814  0.500  1.0
  B  B10  1  0.289  0.314  0.500  1.0
  B  B11  1  0.711  0.686  0.500  1.0
  B  B12  1  0.865  0.031  0.500  1.0
  B  B13  1  0.135  0.969  0.500  1.0
  B  B14  1  0.365  0.469  0.500  1.0
  B  B15  1  0.635  0.531  0.500  1.0
  B  B16  1  0.887  0.452  0.500  1.0
  B  B17  1  0.113  0.548  0.500  1.0
  B  B18  1  0.387  0.048  0.500  1.0
  B  B19  1  0.613  0.952  0.500  1.0
  B  B20  1  0.978  0.306  0.500  1.0
  B  B21  1  0.022  0.694  0.500  1.0
  B  B22  1  0.478  0.194  0.500  1.0
  B  B23  1  0.522  0.806  0.500  1.0
[/CIF]
.