The material structure described by ThTc2 is Hexagonal Laves structured and crystallizes in the hexagonal P6_3/mmc space group. Th(1) is bonded in a 9-coordinate geometry to three equivalent Tc(1) and nine equivalent Tc(2) atoms. There are two inequivalent Tc sites. In the first Tc site, Tc(1) is bonded to six equivalent Th(1) and six equivalent Tc(2) atoms to form a mixture of face, corner, and edge-sharing TcTh6Tc6 cuboctahedra. In the second Tc site, Tc(2) is bonded to six equivalent Th(1), two equivalent Tc(1), and four equivalent Tc(2) atoms to form a mixture of face, corner, and edge-sharing TcTh6Tc6 cuboctahedra. is represented by the CIF card [CIF]
data_ThTc2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.229
_cell_length_b   5.229
_cell_length_c   9.806
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.026
_symmetry_Int_Tables_number   1
_cell_volume   232.125
_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
  Th  Th0  1  0.667  0.333  0.564  1.0
  Th  Th1  1  0.333  0.667  0.436  1.0
  Th  Th2  1  0.333  0.667  0.064  1.0
  Th  Th3  1  0.667  0.333  0.936  1.0
  Tc  Tc4  1  0.000  0.000  0.500  1.0
  Tc  Tc5  1  0.000  0.000  0.000  1.0
  Tc  Tc6  1  0.170  0.339  0.750  1.0
  Tc  Tc7  1  0.170  0.830  0.750  1.0
  Tc  Tc8  1  0.661  0.830  0.750  1.0
  Tc  Tc9  1  0.830  0.661  0.250  1.0
  Tc  Tc10  1  0.830  0.170  0.250  1.0
  Tc  Tc11  1  0.339  0.170  0.250  1.0
[/CIF]
.
The material structure described by ThTc2 is Hexagonal Laves structured and crystallizes in the hexagonal P6_3/mmc space group. Th(1) is bonded in a 9-coordinate geometry to three equivalent Tc(1) and nine equivalent Tc(2) atoms. There are two inequivalent Tc sites. In the first Tc site, Tc(1) is bonded to six equivalent Th(1) and six equivalent Tc(2) atoms to form a mixture of face, corner, and edge-sharing TcTh6Tc6 cuboctahedra. In the second Tc site, Tc(2) is bonded to six equivalent Th(1), two equivalent Tc(1), and four equivalent Tc(2) atoms to form a mixture of face, corner, and edge-sharing TcTh6Tc6 cuboctahedra. is represented by the CIF card [CIF]
data_ThTc2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.229
_cell_length_b   5.229
_cell_length_c   9.806
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.026
_symmetry_Int_Tables_number   1
_cell_volume   232.125
_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
  Th  Th0  1  0.667  0.333  0.564  1.0
  Th  Th1  1  0.333  0.667  0.436  1.0
  Th  Th2  1  0.333  0.667  0.064  1.0
  Th  Th3  1  0.667  0.333  0.936  1.0
  Tc  Tc4  1  0.000  0.000  0.500  1.0
  Tc  Tc5  1  0.000  0.000  0.000  1.0
  Tc  Tc6  1  0.170  0.339  0.750  1.0
  Tc  Tc7  1  0.170  0.830  0.750  1.0
  Tc  Tc8  1  0.661  0.830  0.750  1.0
  Tc  Tc9  1  0.830  0.661  0.250  1.0
  Tc  Tc10  1  0.830  0.170  0.250  1.0
  Tc  Tc11  1  0.339  0.170  0.250  1.0
[/CIF]
.