The structure described by UTh4Te5 is Heusler-like structured and crystallizes in the tetragonal P4/mmm space group. U(1) is bonded in a body-centered cubic geometry to eight equivalent Te(1) atoms. There are two inequivalent Th sites. In the first Th site, Th(1) is bonded in a body-centered cubic geometry to four equivalent Te(1) and four equivalent Te(2) atoms. In the second Th site, Th(2) is bonded in a body-centered cubic geometry to four equivalent Te(2) and four equivalent Te(3) atoms. There are three inequivalent Te sites. In the first Te site, Te(1) is bonded in a body-centered cubic geometry to four equivalent U(1) and four equivalent Th(1) atoms. In the second Te site, Te(2) is bonded in a body-centered cubic geometry to four equivalent Th(1) and four equivalent Th(2) atoms. In the third Te site, Te(3) is bonded in a body-centered cubic geometry to eight equivalent Th(2) atoms. is represented by the CIF card [CIF]
data_Th4UTe5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.826
_cell_length_b   3.826
_cell_length_c   19.230
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   281.495
_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
  Th  Th0  1  0.000  0.000  0.200  1.0
  Th  Th1  1  0.000  0.000  0.400  1.0
  Th  Th2  1  0.000  0.000  0.600  1.0
  Th  Th3  1  0.000  0.000  0.800  1.0
  U  U4  1  0.000  0.000  0.000  1.0
  Te  Te5  1  0.500  0.500  0.099  1.0
  Te  Te6  1  0.500  0.500  0.300  1.0
  Te  Te7  1  0.500  0.500  0.500  1.0
  Te  Te8  1  0.500  0.500  0.700  1.0
  Te  Te9  1  0.500  0.500  0.901  1.0
[/CIF]
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The structure described by UTh4Te5 is Heusler-like structured and crystallizes in the tetragonal P4/mmm space group. U(1) is bonded in a body-centered cubic geometry to eight equivalent Te(1) atoms. There are two inequivalent Th sites. In the first Th site, Th(1) is bonded in a body-centered cubic geometry to four equivalent Te(1) and four equivalent Te(2) atoms. In the second Th site, Th(2) is bonded in a body-centered cubic geometry to four equivalent Te(2) and four equivalent Te(3) atoms. There are three inequivalent Te sites. In the first Te site, Te(1) is bonded in a body-centered cubic geometry to four equivalent U(1) and four equivalent Th(1) atoms. In the second Te site, Te(2) is bonded in a body-centered cubic geometry to four equivalent Th(1) and four equivalent Th(2) atoms. In the third Te site, Te(3) is bonded in a body-centered cubic geometry to eight equivalent Th(2) atoms. is represented by the CIF card [CIF]
data_Th4UTe5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.826
_cell_length_b   3.826
_cell_length_c   19.230
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   281.495
_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
  Th  Th0  1  0.000  0.000  0.200  1.0
  Th  Th1  1  0.000  0.000  0.400  1.0
  Th  Th2  1  0.000  0.000  0.600  1.0
  Th  Th3  1  0.000  0.000  0.800  1.0
  U  U4  1  0.000  0.000  0.000  1.0
  Te  Te5  1  0.500  0.500  0.099  1.0
  Te  Te6  1  0.500  0.500  0.300  1.0
  Te  Te7  1  0.500  0.500  0.500  1.0
  Te  Te8  1  0.500  0.500  0.700  1.0
  Te  Te9  1  0.500  0.500  0.901  1.0
[/CIF]
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