The material structure described by BaUTe6 crystallizes in the monoclinic P2_1/c space group. Ba(1) is bonded in a 9-coordinate geometry to one Te(1), one Te(4), two equivalent Te(2), two equivalent Te(3), two equivalent Te(5), and two equivalent Te(6) atoms. U(1) is bonded in a 9-coordinate geometry to one Te(2), one Te(3), one Te(6), two equivalent Te(1), two equivalent Te(4), and two equivalent Te(5) atoms. There are six inequivalent Te sites. In the first Te site, Te(1) is bonded in a 5-coordinate geometry to one Ba(1), two equivalent U(1), and two equivalent Te(2) atoms. In the second Te site, Te(2) is bonded in a 5-coordinate geometry to two equivalent Ba(1), one U(1), and two equivalent Te(1) atoms. In the third Te site, Te(3) is bonded in a 5-coordinate geometry to two equivalent Ba(1), one U(1), one Te(4), and one Te(5) atom. In the fourth Te site, Te(4) is bonded in a 5-coordinate geometry to one Ba(1), two equivalent U(1), one Te(3), and one Te(6) atom. In the fifth Te site, Te(5) is bonded in a 6-coordinate geometry to two equivalent Ba(1), two equivalent U(1), one Te(3), and one Te(6) atom. In the sixth Te site, Te(6) is bonded in a 5-coordinate geometry to two equivalent Ba(1), one U(1), one Te(4), and one Te(5) atom. is represented by the CIF card [CIF]
data_BaUTe6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.332
_cell_length_b   8.232
_cell_length_c   9.055
_cell_angle_alpha   88.081
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1142.258
_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
  Ba  Ba0  1  0.090  0.232  0.239  1.0
  Ba  Ba1  1  0.590  0.268  0.761  1.0
  Ba  Ba2  1  0.910  0.768  0.761  1.0
  Ba  Ba3  1  0.410  0.732  0.239  1.0
  U  U4  1  0.751  0.388  0.273  1.0
  U  U5  1  0.251  0.112  0.727  1.0
  U  U6  1  0.249  0.612  0.727  1.0
  U  U7  1  0.749  0.888  0.273  1.0
  Te  Te8  1  0.763  0.150  0.004  1.0
  Te  Te9  1  0.263  0.350  0.996  1.0
  Te  Te10  1  0.237  0.850  0.996  1.0
  Te  Te11  1  0.737  0.650  0.004  1.0
  Te  Te12  1  0.897  0.389  0.027  1.0
  Te  Te13  1  0.397  0.111  0.973  1.0
  Te  Te14  1  0.103  0.611  0.973  1.0
  Te  Te15  1  0.603  0.889  0.027  1.0
  Te  Te16  1  0.553  0.388  0.178  1.0
  Te  Te17  1  0.053  0.112  0.822  1.0
  Te  Te18  1  0.447  0.612  0.822  1.0
  Te  Te19  1  0.947  0.888  0.178  1.0
  Te  Te20  1  0.604  0.138  0.388  1.0
  Te  Te21  1  0.104  0.362  0.612  1.0
  Te  Te22  1  0.396  0.862  0.612  1.0
  Te  Te23  1  0.896  0.638  0.388  1.0
  Te  Te24  1  0.885  0.131  0.421  1.0
  Te  Te25  1  0.385  0.369  0.579  1.0
  Te  Te26  1  0.115  0.869  0.579  1.0
  Te  Te27  1  0.615  0.631  0.421  1.0
  Te  Te28  1  0.806  0.374  0.605  1.0
  Te  Te29  1  0.306  0.126  0.395  1.0
  Te  Te30  1  0.194  0.626  0.395  1.0
  Te  Te31  1  0.694  0.874  0.605  1.0
[/CIF]
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The material structure described by BaUTe6 crystallizes in the monoclinic P2_1/c space group. Ba(1) is bonded in a 9-coordinate geometry to one Te(1), one Te(4), two equivalent Te(2), two equivalent Te(3), two equivalent Te(5), and two equivalent Te(6) atoms. U(1) is bonded in a 9-coordinate geometry to one Te(2), one Te(3), one Te(6), two equivalent Te(1), two equivalent Te(4), and two equivalent Te(5) atoms. There are six inequivalent Te sites. In the first Te site, Te(1) is bonded in a 5-coordinate geometry to one Ba(1), two equivalent U(1), and two equivalent Te(2) atoms. In the second Te site, Te(2) is bonded in a 5-coordinate geometry to two equivalent Ba(1), one U(1), and two equivalent Te(1) atoms. In the third Te site, Te(3) is bonded in a 5-coordinate geometry to two equivalent Ba(1), one U(1), one Te(4), and one Te(5) atom. In the fourth Te site, Te(4) is bonded in a 5-coordinate geometry to one Ba(1), two equivalent U(1), one Te(3), and one Te(6) atom. In the fifth Te site, Te(5) is bonded in a 6-coordinate geometry to two equivalent Ba(1), two equivalent U(1), one Te(3), and one Te(6) atom. In the sixth Te site, Te(6) is bonded in a 5-coordinate geometry to two equivalent Ba(1), one U(1), one Te(4), and one Te(5) atom. is represented by the CIF card [CIF]
data_BaUTe6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.332
_cell_length_b   8.232
_cell_length_c   9.055
_cell_angle_alpha   88.081
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1142.258
_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
  Ba  Ba0  1  0.090  0.232  0.239  1.0
  Ba  Ba1  1  0.590  0.268  0.761  1.0
  Ba  Ba2  1  0.910  0.768  0.761  1.0
  Ba  Ba3  1  0.410  0.732  0.239  1.0
  U  U4  1  0.751  0.388  0.273  1.0
  U  U5  1  0.251  0.112  0.727  1.0
  U  U6  1  0.249  0.612  0.727  1.0
  U  U7  1  0.749  0.888  0.273  1.0
  Te  Te8  1  0.763  0.150  0.004  1.0
  Te  Te9  1  0.263  0.350  0.996  1.0
  Te  Te10  1  0.237  0.850  0.996  1.0
  Te  Te11  1  0.737  0.650  0.004  1.0
  Te  Te12  1  0.897  0.389  0.027  1.0
  Te  Te13  1  0.397  0.111  0.973  1.0
  Te  Te14  1  0.103  0.611  0.973  1.0
  Te  Te15  1  0.603  0.889  0.027  1.0
  Te  Te16  1  0.553  0.388  0.178  1.0
  Te  Te17  1  0.053  0.112  0.822  1.0
  Te  Te18  1  0.447  0.612  0.822  1.0
  Te  Te19  1  0.947  0.888  0.178  1.0
  Te  Te20  1  0.604  0.138  0.388  1.0
  Te  Te21  1  0.104  0.362  0.612  1.0
  Te  Te22  1  0.396  0.862  0.612  1.0
  Te  Te23  1  0.896  0.638  0.388  1.0
  Te  Te24  1  0.885  0.131  0.421  1.0
  Te  Te25  1  0.385  0.369  0.579  1.0
  Te  Te26  1  0.115  0.869  0.579  1.0
  Te  Te27  1  0.615  0.631  0.421  1.0
  Te  Te28  1  0.806  0.374  0.605  1.0
  Te  Te29  1  0.306  0.126  0.395  1.0
  Te  Te30  1  0.194  0.626  0.395  1.0
  Te  Te31  1  0.694  0.874  0.605  1.0
[/CIF]
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