The material described by Bi3ReO8 crystallizes in the cubic I2_13 space group. Re(1) is bonded in a tetrahedral geometry to one O(1) and three equivalent O(2) atoms. Bi(1) is bonded in a 6-coordinate geometry to one O(2), one O(3), two equivalent O(4), and two equivalent O(5) atoms. There are five inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one Re(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to one Re(1) and one Bi(1) atom. In the third O site, O(3) is bonded in a trigonal non-coplanar geometry to three equivalent Bi(1) atoms. In the fourth O site, O(4) is bonded to four equivalent Bi(1) atoms to form a mixture of corner and edge-sharing OBi4 tetrahedra. In the fifth O site, O(5) is bonded to four equivalent Bi(1) atoms to form a mixture of distorted corner and edge-sharing OBi4 tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_ReBi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.959
_cell_length_b   9.959
_cell_length_c   9.959
_cell_angle_alpha   109.471
_cell_angle_beta   109.471
_cell_angle_gamma   109.471
_symmetry_Int_Tables_number   1
_cell_volume   760.291
_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
  Re  Re0  1  0.739  0.000  0.500  1.0
  Re  Re1  1  0.500  0.739  0.000  1.0
  Re  Re2  1  0.000  0.500  0.739  1.0
  Re  Re3  1  0.761  0.761  0.761  1.0
  Bi  Bi4  1  0.253  0.490  0.467  1.0
  Bi  Bi5  1  0.286  0.033  0.024  1.0
  Bi  Bi6  1  0.763  0.476  0.010  1.0
  Bi  Bi7  1  0.024  0.286  0.033  1.0
  Bi  Bi8  1  0.010  0.763  0.476  1.0
  Bi  Bi9  1  0.467  0.253  0.490  1.0
  Bi  Bi10  1  0.476  0.010  0.763  1.0
  Bi  Bi11  1  0.490  0.467  0.253  1.0
  Bi  Bi12  1  0.033  0.024  0.286  1.0
  Bi  Bi13  1  0.247  0.214  0.737  1.0
  Bi  Bi14  1  0.214  0.737  0.247  1.0
  Bi  Bi15  1  0.737  0.247  0.214  1.0
  O  O16  1  0.564  0.000  0.500  1.0
  O  O17  1  0.500  0.564  0.000  1.0
  O  O18  1  0.000  0.500  0.564  1.0
  O  O19  1  0.936  0.936  0.936  1.0
  O  O20  1  0.689  0.802  0.371  1.0
  O  O21  1  0.818  0.129  0.430  1.0
  O  O22  1  0.887  0.070  0.698  1.0
  O  O23  1  0.430  0.818  0.129  1.0
  O  O24  1  0.698  0.887  0.070  1.0
  O  O25  1  0.371  0.689  0.802  1.0
  O  O26  1  0.070  0.698  0.887  1.0
  O  O27  1  0.802  0.371  0.689  1.0
  O  O28  1  0.129  0.430  0.818  1.0
  O  O29  1  0.811  0.682  0.613  1.0
  O  O30  1  0.682  0.613  0.811  1.0
  O  O31  1  0.613  0.811  0.682  1.0
  O  O32  1  0.050  0.000  0.500  1.0
  O  O33  1  0.500  0.050  0.000  1.0
  O  O34  1  0.000  0.500  0.050  1.0
  O  O35  1  0.450  0.450  0.450  1.0
  O  O36  1  0.250  0.271  0.521  1.0
  O  O37  1  0.229  0.979  0.750  1.0
  O  O38  1  0.979  0.750  0.229  1.0
  O  O39  1  0.750  0.229  0.979  1.0
  O  O40  1  0.521  0.250  0.271  1.0
  O  O41  1  0.271  0.521  0.250  1.0
  O  O42  1  0.750  0.471  0.221  1.0
  O  O43  1  0.029  0.279  0.250  1.0
  O  O44  1  0.279  0.250  0.029  1.0
  O  O45  1  0.250  0.029  0.279  1.0
  O  O46  1  0.221  0.750  0.471  1.0
  O  O47  1  0.471  0.221  0.750  1.0
[/CIF]
.
The material described by Bi3ReO8 crystallizes in the cubic I2_13 space group. Re(1) is bonded in a tetrahedral geometry to one O(1) and three equivalent O(2) atoms. Bi(1) is bonded in a 6-coordinate geometry to one O(2), one O(3), two equivalent O(4), and two equivalent O(5) atoms. There are five inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one Re(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to one Re(1) and one Bi(1) atom. In the third O site, O(3) is bonded in a trigonal non-coplanar geometry to three equivalent Bi(1) atoms. In the fourth O site, O(4) is bonded to four equivalent Bi(1) atoms to form a mixture of corner and edge-sharing OBi4 tetrahedra. In the fifth O site, O(5) is bonded to four equivalent Bi(1) atoms to form a mixture of distorted corner and edge-sharing OBi4 tetrahedra. is represented by the Crystallographic Information File (CIF) [CIF]
data_ReBi3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.959
_cell_length_b   9.959
_cell_length_c   9.959
_cell_angle_alpha   109.471
_cell_angle_beta   109.471
_cell_angle_gamma   109.471
_symmetry_Int_Tables_number   1
_cell_volume   760.291
_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
  Re  Re0  1  0.739  0.000  0.500  1.0
  Re  Re1  1  0.500  0.739  0.000  1.0
  Re  Re2  1  0.000  0.500  0.739  1.0
  Re  Re3  1  0.761  0.761  0.761  1.0
  Bi  Bi4  1  0.253  0.490  0.467  1.0
  Bi  Bi5  1  0.286  0.033  0.024  1.0
  Bi  Bi6  1  0.763  0.476  0.010  1.0
  Bi  Bi7  1  0.024  0.286  0.033  1.0
  Bi  Bi8  1  0.010  0.763  0.476  1.0
  Bi  Bi9  1  0.467  0.253  0.490  1.0
  Bi  Bi10  1  0.476  0.010  0.763  1.0
  Bi  Bi11  1  0.490  0.467  0.253  1.0
  Bi  Bi12  1  0.033  0.024  0.286  1.0
  Bi  Bi13  1  0.247  0.214  0.737  1.0
  Bi  Bi14  1  0.214  0.737  0.247  1.0
  Bi  Bi15  1  0.737  0.247  0.214  1.0
  O  O16  1  0.564  0.000  0.500  1.0
  O  O17  1  0.500  0.564  0.000  1.0
  O  O18  1  0.000  0.500  0.564  1.0
  O  O19  1  0.936  0.936  0.936  1.0
  O  O20  1  0.689  0.802  0.371  1.0
  O  O21  1  0.818  0.129  0.430  1.0
  O  O22  1  0.887  0.070  0.698  1.0
  O  O23  1  0.430  0.818  0.129  1.0
  O  O24  1  0.698  0.887  0.070  1.0
  O  O25  1  0.371  0.689  0.802  1.0
  O  O26  1  0.070  0.698  0.887  1.0
  O  O27  1  0.802  0.371  0.689  1.0
  O  O28  1  0.129  0.430  0.818  1.0
  O  O29  1  0.811  0.682  0.613  1.0
  O  O30  1  0.682  0.613  0.811  1.0
  O  O31  1  0.613  0.811  0.682  1.0
  O  O32  1  0.050  0.000  0.500  1.0
  O  O33  1  0.500  0.050  0.000  1.0
  O  O34  1  0.000  0.500  0.050  1.0
  O  O35  1  0.450  0.450  0.450  1.0
  O  O36  1  0.250  0.271  0.521  1.0
  O  O37  1  0.229  0.979  0.750  1.0
  O  O38  1  0.979  0.750  0.229  1.0
  O  O39  1  0.750  0.229  0.979  1.0
  O  O40  1  0.521  0.250  0.271  1.0
  O  O41  1  0.271  0.521  0.250  1.0
  O  O42  1  0.750  0.471  0.221  1.0
  O  O43  1  0.029  0.279  0.250  1.0
  O  O44  1  0.279  0.250  0.029  1.0
  O  O45  1  0.250  0.029  0.279  1.0
  O  O46  1  0.221  0.750  0.471  1.0
  O  O47  1  0.471  0.221  0.750  1.0
[/CIF]
.