The material described by La5Re3MnO16 crystallizes in the triclinic P-1 space group. There are eleven inequivalent La sites. In the first La site, La(1) is bonded in a body-centered cubic geometry to one O(17), one O(18), one O(21), one O(22), one O(3), one O(4), one O(7), and one O(8) atom. In the second La site, La(2) is bonded in a body-centered cubic geometry to two equivalent O(19), two equivalent O(2), two equivalent O(23), and two equivalent O(6) atoms. In the third La site, La(3) is bonded in a body-centered cubic geometry to two equivalent O(1), two equivalent O(20), two equivalent O(24), and two equivalent O(5) atoms. In the fourth La site, La(4) is bonded in a 7-coordinate geometry to one O(10), one O(14), one O(20), one O(22), one O(25), one O(26), and one O(8) atom. In the fifth La site, La(5) is bonded in a 7-coordinate geometry to one O(13), one O(19), one O(21), one O(25), one O(26), one O(7), and one O(9) atom. In the sixth La site, La(6) is bonded in a 7-coordinate geometry to one O(11), one O(15), one O(18), one O(23), one O(6), and two equivalent O(27) atoms. In the seventh La site, La(7) is bonded in a 7-coordinate geometry to one O(12), one O(16), one O(17), one O(24), one O(5), and two equivalent O(28) atoms. In the eighth La site, La(8) is bonded in a 6-coordinate geometry to one O(10), one O(14), one O(18), one O(24), one O(32), and one O(8) atom. In the ninth La site, La(9) is bonded in a 6-coordinate geometry to one O(13), one O(17), one O(23), one O(31), one O(7), and one O(9) atom. In the tenth La site, La(10) is bonded in a 6-coordinate geometry to one O(11), one O(15), one O(19), one O(22), one O(29), and one O(6) atom. In the eleventh La site, La(11) is bonded in a 6-coordinate geometry to one O(12), one O(16), one O(20), one O(21), one O(30), and one O(5) atom. There are six inequivalent Re sites. In the first Re site, Re(1) is bonded to one O(13), one O(15), one O(26), one O(27), one O(29), and one O(32) atom to form ReO6 octahedra that share  a cornercorner with one Mn(2)O6 octahedra and corners with three equivalent Mn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 27-34°. In the second Re site, Re(2) is bonded to one O(14), one O(16), one O(25), one O(28), one O(30), and one O(31) atom to form ReO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra and corners with three equivalent Mn(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 28-34°. In the third Re site, Re(3) is bonded to one O(1), one O(17), one O(2), one O(21), one O(5), and one O(9) atom to form ReO6 octahedra that share  a cornercorner with one Mn(2)O6 octahedra and  an edgeedge with one Re(4)O6 octahedra. The corner-sharing octahedral tilt angles are 34°. In the fourth Re site, Re(4) is bonded to one O(1), one O(10), one O(18), one O(2), one O(22), and one O(6) atom to form ReO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra and  an edgeedge with one Re(3)O6 octahedra. The corner-sharing octahedral tilt angles are 34°. In the fifth Re site, Re(5) is bonded to one O(11), one O(19), one O(23), one O(7), and two equivalent O(3) atoms to form ReO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra and  an edgeedge with one Re(5)O6 octahedra. The corner-sharing octahedral tilt angles are 34°. In the sixth Re site, Re(6) is bonded to one O(12), one O(20), one O(24), one O(8), and two equivalent O(4) atoms to form ReO6 octahedra that share  a cornercorner with one Mn(2)O6 octahedra and  an edgeedge with one Re(6)O6 octahedra. The corner-sharing octahedral tilt angles are 34°. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(10), one O(11), one O(26), one O(27), one O(29), and one O(31) atom to form MnO6 octahedra that share  a cornercorner with one Re(2)O6 octahedra,  a cornercorner with one Re(4)O6 octahedra,  a cornercorner with one Re(5)O6 octahedra, and corners with three equivalent Re(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 27-34°. In the second Mn site, Mn(2) is bonded to one O(12), one O(25), one O(28), one O(30), one O(32), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Re(1)O6 octahedra,  a cornercorner with one Re(3)O6 octahedra,  a cornercorner with one Re(6)O6 octahedra, and corners with three equivalent Re(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 28-34°. There are thirty-two inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one La(3), one Re(3), and one Re(4) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one La(2), one Re(3), and one Re(4) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one La(1) and two equivalent Re(5) atoms. In the fourth O site, O(4) is bonded in a 3-coordinate geometry to one La(1) and two equivalent Re(6) atoms. In the fifth O site, O(5) is bonded to one La(11), one La(3), one La(7), and one Re(3) atom to form OLa3Re tetrahedra that share  a cornercorner with one O(9)La2MnRe tetrahedra,  a cornercorner with one O(5)La3Re tetrahedra, and corners with two equivalent O(12)La2MnRe tetrahedra. In the sixth O site, O(6) is bonded to one La(10), one La(2), one La(6), and one Re(4) atom to form OLa3Re tetrahedra that share  a cornercorner with one O(10)La2MnRe tetrahedra,  a cornercorner with one O(6)La3Re tetrahedra, and corners with two equivalent O(11)La2MnRe tetrahedra. In the seventh O site, O(7) is bonded to one La(1), one La(5), one La(9), and one Re(5) atom to form OLa3Re tetrahedra that share  a cornercorner with one O(11)La2MnRe tetrahedra,  a cornercorner with one O(8)La3Re tetrahedra, and corners with two equivalent O(9)La2MnRe tetrahedra. In the eighth O site, O(8) is bonded to one La(1), one La(4), one La(8), and one Re(6) atom to form OLa3Re tetrahedra that share  a cornercorner with one O(12)La2MnRe tetrahedra,  a cornercorner with one O(7)La3Re tetrahedra, and corners with two equivalent O(10)La2MnRe tetrahedra. In the ninth O site, O(9) is bonded to one La(5), one La(9), one Re(3), and one Mn(2) atom to form distorted OLa2MnRe tetrahedra that share  a cornercorner with one O(12)La2MnRe tetrahedra,  a cornercorner with one O(5)La3Re tetrahedra, and corners with two equivalent O(7)La3Re tetrahedra. In the tenth O site, O(10) is bonded to one La(4), one La(8), one Re(4), and one Mn(1) atom to form distorted OLa2MnRe tetrahedra that share  a cornercorner with one O(11)La2MnRe tetrahedra,  a cornercorner with one O(6)La3Re tetrahedra, and corners with two equivalent O(8)La3Re tetrahedra. In the eleventh O site, O(11) is bonded to one La(10), one La(6), one Re(5), and one Mn(1) atom to form distorted OLa2MnRe tetrahedra that share  a cornercorner with one O(10)La2MnRe tetrahedra,  a cornercorner with one O(7)La3Re tetrahedra, and corners with two equivalent O(6)La3Re tetrahedra. In the twelfth O site, O(12) is bonded to one La(11), one La(7), one Re(6), and one Mn(2) atom to form distorted OLa2MnRe tetrahedra that share  a cornercorner with one O(9)La2MnRe tetrahedra,  a cornercorner with one O(8)La3Re tetrahedra, and corners with two equivalent O(5)La3Re tetrahedra. In the thirteenth O site, O(13) is bonded in a distorted trigonal non-coplanar geometry to one La(5), one La(9), and one Re(1) atom. In the fourteenth O site, O(14) is bonded in a distorted trigonal non-coplanar geometry to one La(4), one La(8), and one Re(2) atom. In the fifteenth O site, O(15) is bonded in a distorted trigonal non-coplanar geometry to one La(10), one La(6), and one Re(1) atom. In the sixteenth O site, O(16) is bonded in a distorted trigonal non-coplanar geometry to one La(11), one La(7), and one Re(2) atom. In the seventeenth O site, O(17) is bonded in a 4-coordinate geometry to one La(1), one La(7), one La(9), and one Re(3) atom. In the eighteenth O site, O(18) is bonded in a 4-coordinate geometry to one La(1), one La(6), one La(8), and one Re(4) atom. In the nineteenth O site, O(19) is bonded in a 4-coordinate geometry to one La(10), one La(2), one La(5), and one Re(5) atom. In the twentieth O site, O(20) is bonded in a 4-coordinate geometry to one La(11), one La(3), one La(4), and one Re(6) atom. In the twenty-first O site, O(21) is bonded in a 4-coordinate geometry to one La(1), one La(11), one La(5), and one Re(3) atom. In the twenty-second O site, O(22) is bonded in a 4-coordinate geometry to one La(1), one La(10), one La(4), and one Re(4) atom. In the twenty-third O site, O(23) is bonded in a 4-coordinate geometry to one La(2), one La(6), one La(9), and one Re(5) atom. In the twenty-fourth O site, O(24) is bonded in a 4-coordinate geometry to one La(3), one La(7), one La(8), and one Re(6) atom. In the twenty-fifth O site, O(25) is bonded in a 4-coordinate geometry to one La(4), one La(5), one Re(2), and one Mn(2) atom. In the twenty-sixth O site, O(26) is bonded in a 4-coordinate geometry to one La(4), one La(5), one Re(1), and one Mn(1) atom. In the twenty-seventh O site, O(27) is bonded in a 4-coordinate geometry to two equivalent La(6), one Re(1), and one Mn(1) atom. In the twenty-eighth O site, O(28) is bonded in a 4-coordinate geometry to two equivalent La(7), one Re(2), and one Mn(2) atom. In the twenty-ninth O site, O(29) is bonded in a 3-coordinate geometry to one La(10), one Re(1), and one Mn(1) atom. In the thirtieth O site, O(30) is bonded in a 3-coordinate geometry to one La(11), one Re(2), and one Mn(2) atom. In the thirty-first O site, O(31) is bonded in a 3-coordinate geometry to one La(9), one Re(2), and one Mn(1) atom. In the thirty-second O site, O(32) is bonded in a 3-coordinate geometry to one La(8), one Re(1), and one Mn(2) atom. is represented by the CIF card [CIF]
data_La5MnRe3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.708
_cell_length_b   5.718
_cell_length_c   10.303
_cell_angle_alpha   93.701
_cell_angle_beta   93.685
_cell_angle_gamma   90.655
_symmetry_Int_Tables_number   1
_cell_volume   334.822
_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
  La  La0  1  1.000  0.000  0.500  1.0
  La  La1  1  0.512  0.028  0.201  1.0
  La  La2  1  0.488  0.972  0.799  1.0
  La  La3  1  0.032  0.505  0.210  1.0
  La  La4  1  0.968  0.495  0.790  1.0
  Mn  Mn5  1  0.500  0.500  1.000  1.0
  O  O6  1  0.310  0.306  0.434  1.0
  O  O7  1  0.690  0.694  0.566  1.0
  O  O8  1  0.226  0.220  0.675  1.0
  O  O9  1  0.774  0.780  0.325  1.0
  O  O10  1  0.548  0.549  0.799  1.0
  O  O11  1  0.452  0.451  0.201  1.0
  O  O12  1  0.925  0.922  0.817  1.0
  O  O13  1  0.075  0.078  0.183  1.0
  O  O14  1  0.703  0.229  0.635  1.0
  O  O15  1  0.297  0.771  0.365  1.0
  O  O16  1  0.222  0.696  0.635  1.0
  O  O17  1  0.778  0.304  0.365  1.0
  O  O18  1  0.303  0.820  0.996  1.0
  O  O19  1  0.697  0.180  0.004  1.0
  O  O20  1  0.828  0.712  0.038  1.0
  O  O21  1  0.172  0.288  0.962  1.0
  Re  Re22  1  1.000  1.000  1.000  1.0
  Re  Re23  1  0.446  0.446  0.605  1.0
  Re  Re24  1  0.554  0.554  0.395  1.0
[/CIF]
.
The material described by La5Re3MnO16 crystallizes in the triclinic P-1 space group. There are eleven inequivalent La sites. In the first La site, La(1) is bonded in a body-centered cubic geometry to one O(17), one O(18), one O(21), one O(22), one O(3), one O(4), one O(7), and one O(8) atom. In the second La site, La(2) is bonded in a body-centered cubic geometry to two equivalent O(19), two equivalent O(2), two equivalent O(23), and two equivalent O(6) atoms. In the third La site, La(3) is bonded in a body-centered cubic geometry to two equivalent O(1), two equivalent O(20), two equivalent O(24), and two equivalent O(5) atoms. In the fourth La site, La(4) is bonded in a 7-coordinate geometry to one O(10), one O(14), one O(20), one O(22), one O(25), one O(26), and one O(8) atom. In the fifth La site, La(5) is bonded in a 7-coordinate geometry to one O(13), one O(19), one O(21), one O(25), one O(26), one O(7), and one O(9) atom. In the sixth La site, La(6) is bonded in a 7-coordinate geometry to one O(11), one O(15), one O(18), one O(23), one O(6), and two equivalent O(27) atoms. In the seventh La site, La(7) is bonded in a 7-coordinate geometry to one O(12), one O(16), one O(17), one O(24), one O(5), and two equivalent O(28) atoms. In the eighth La site, La(8) is bonded in a 6-coordinate geometry to one O(10), one O(14), one O(18), one O(24), one O(32), and one O(8) atom. In the ninth La site, La(9) is bonded in a 6-coordinate geometry to one O(13), one O(17), one O(23), one O(31), one O(7), and one O(9) atom. In the tenth La site, La(10) is bonded in a 6-coordinate geometry to one O(11), one O(15), one O(19), one O(22), one O(29), and one O(6) atom. In the eleventh La site, La(11) is bonded in a 6-coordinate geometry to one O(12), one O(16), one O(20), one O(21), one O(30), and one O(5) atom. There are six inequivalent Re sites. In the first Re site, Re(1) is bonded to one O(13), one O(15), one O(26), one O(27), one O(29), and one O(32) atom to form ReO6 octahedra that share  a cornercorner with one Mn(2)O6 octahedra and corners with three equivalent Mn(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 27-34°. In the second Re site, Re(2) is bonded to one O(14), one O(16), one O(25), one O(28), one O(30), and one O(31) atom to form ReO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra and corners with three equivalent Mn(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 28-34°. In the third Re site, Re(3) is bonded to one O(1), one O(17), one O(2), one O(21), one O(5), and one O(9) atom to form ReO6 octahedra that share  a cornercorner with one Mn(2)O6 octahedra and  an edgeedge with one Re(4)O6 octahedra. The corner-sharing octahedral tilt angles are 34°. In the fourth Re site, Re(4) is bonded to one O(1), one O(10), one O(18), one O(2), one O(22), and one O(6) atom to form ReO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra and  an edgeedge with one Re(3)O6 octahedra. The corner-sharing octahedral tilt angles are 34°. In the fifth Re site, Re(5) is bonded to one O(11), one O(19), one O(23), one O(7), and two equivalent O(3) atoms to form ReO6 octahedra that share  a cornercorner with one Mn(1)O6 octahedra and  an edgeedge with one Re(5)O6 octahedra. The corner-sharing octahedral tilt angles are 34°. In the sixth Re site, Re(6) is bonded to one O(12), one O(20), one O(24), one O(8), and two equivalent O(4) atoms to form ReO6 octahedra that share  a cornercorner with one Mn(2)O6 octahedra and  an edgeedge with one Re(6)O6 octahedra. The corner-sharing octahedral tilt angles are 34°. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(10), one O(11), one O(26), one O(27), one O(29), and one O(31) atom to form MnO6 octahedra that share  a cornercorner with one Re(2)O6 octahedra,  a cornercorner with one Re(4)O6 octahedra,  a cornercorner with one Re(5)O6 octahedra, and corners with three equivalent Re(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 27-34°. In the second Mn site, Mn(2) is bonded to one O(12), one O(25), one O(28), one O(30), one O(32), and one O(9) atom to form MnO6 octahedra that share  a cornercorner with one Re(1)O6 octahedra,  a cornercorner with one Re(3)O6 octahedra,  a cornercorner with one Re(6)O6 octahedra, and corners with three equivalent Re(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 28-34°. There are thirty-two inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one La(3), one Re(3), and one Re(4) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one La(2), one Re(3), and one Re(4) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one La(1) and two equivalent Re(5) atoms. In the fourth O site, O(4) is bonded in a 3-coordinate geometry to one La(1) and two equivalent Re(6) atoms. In the fifth O site, O(5) is bonded to one La(11), one La(3), one La(7), and one Re(3) atom to form OLa3Re tetrahedra that share  a cornercorner with one O(9)La2MnRe tetrahedra,  a cornercorner with one O(5)La3Re tetrahedra, and corners with two equivalent O(12)La2MnRe tetrahedra. In the sixth O site, O(6) is bonded to one La(10), one La(2), one La(6), and one Re(4) atom to form OLa3Re tetrahedra that share  a cornercorner with one O(10)La2MnRe tetrahedra,  a cornercorner with one O(6)La3Re tetrahedra, and corners with two equivalent O(11)La2MnRe tetrahedra. In the seventh O site, O(7) is bonded to one La(1), one La(5), one La(9), and one Re(5) atom to form OLa3Re tetrahedra that share  a cornercorner with one O(11)La2MnRe tetrahedra,  a cornercorner with one O(8)La3Re tetrahedra, and corners with two equivalent O(9)La2MnRe tetrahedra. In the eighth O site, O(8) is bonded to one La(1), one La(4), one La(8), and one Re(6) atom to form OLa3Re tetrahedra that share  a cornercorner with one O(12)La2MnRe tetrahedra,  a cornercorner with one O(7)La3Re tetrahedra, and corners with two equivalent O(10)La2MnRe tetrahedra. In the ninth O site, O(9) is bonded to one La(5), one La(9), one Re(3), and one Mn(2) atom to form distorted OLa2MnRe tetrahedra that share  a cornercorner with one O(12)La2MnRe tetrahedra,  a cornercorner with one O(5)La3Re tetrahedra, and corners with two equivalent O(7)La3Re tetrahedra. In the tenth O site, O(10) is bonded to one La(4), one La(8), one Re(4), and one Mn(1) atom to form distorted OLa2MnRe tetrahedra that share  a cornercorner with one O(11)La2MnRe tetrahedra,  a cornercorner with one O(6)La3Re tetrahedra, and corners with two equivalent O(8)La3Re tetrahedra. In the eleventh O site, O(11) is bonded to one La(10), one La(6), one Re(5), and one Mn(1) atom to form distorted OLa2MnRe tetrahedra that share  a cornercorner with one O(10)La2MnRe tetrahedra,  a cornercorner with one O(7)La3Re tetrahedra, and corners with two equivalent O(6)La3Re tetrahedra. In the twelfth O site, O(12) is bonded to one La(11), one La(7), one Re(6), and one Mn(2) atom to form distorted OLa2MnRe tetrahedra that share  a cornercorner with one O(9)La2MnRe tetrahedra,  a cornercorner with one O(8)La3Re tetrahedra, and corners with two equivalent O(5)La3Re tetrahedra. In the thirteenth O site, O(13) is bonded in a distorted trigonal non-coplanar geometry to one La(5), one La(9), and one Re(1) atom. In the fourteenth O site, O(14) is bonded in a distorted trigonal non-coplanar geometry to one La(4), one La(8), and one Re(2) atom. In the fifteenth O site, O(15) is bonded in a distorted trigonal non-coplanar geometry to one La(10), one La(6), and one Re(1) atom. In the sixteenth O site, O(16) is bonded in a distorted trigonal non-coplanar geometry to one La(11), one La(7), and one Re(2) atom. In the seventeenth O site, O(17) is bonded in a 4-coordinate geometry to one La(1), one La(7), one La(9), and one Re(3) atom. In the eighteenth O site, O(18) is bonded in a 4-coordinate geometry to one La(1), one La(6), one La(8), and one Re(4) atom. In the nineteenth O site, O(19) is bonded in a 4-coordinate geometry to one La(10), one La(2), one La(5), and one Re(5) atom. In the twentieth O site, O(20) is bonded in a 4-coordinate geometry to one La(11), one La(3), one La(4), and one Re(6) atom. In the twenty-first O site, O(21) is bonded in a 4-coordinate geometry to one La(1), one La(11), one La(5), and one Re(3) atom. In the twenty-second O site, O(22) is bonded in a 4-coordinate geometry to one La(1), one La(10), one La(4), and one Re(4) atom. In the twenty-third O site, O(23) is bonded in a 4-coordinate geometry to one La(2), one La(6), one La(9), and one Re(5) atom. In the twenty-fourth O site, O(24) is bonded in a 4-coordinate geometry to one La(3), one La(7), one La(8), and one Re(6) atom. In the twenty-fifth O site, O(25) is bonded in a 4-coordinate geometry to one La(4), one La(5), one Re(2), and one Mn(2) atom. In the twenty-sixth O site, O(26) is bonded in a 4-coordinate geometry to one La(4), one La(5), one Re(1), and one Mn(1) atom. In the twenty-seventh O site, O(27) is bonded in a 4-coordinate geometry to two equivalent La(6), one Re(1), and one Mn(1) atom. In the twenty-eighth O site, O(28) is bonded in a 4-coordinate geometry to two equivalent La(7), one Re(2), and one Mn(2) atom. In the twenty-ninth O site, O(29) is bonded in a 3-coordinate geometry to one La(10), one Re(1), and one Mn(1) atom. In the thirtieth O site, O(30) is bonded in a 3-coordinate geometry to one La(11), one Re(2), and one Mn(2) atom. In the thirty-first O site, O(31) is bonded in a 3-coordinate geometry to one La(9), one Re(2), and one Mn(1) atom. In the thirty-second O site, O(32) is bonded in a 3-coordinate geometry to one La(8), one Re(1), and one Mn(2) atom. is represented by the CIF card [CIF]
data_La5MnRe3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.708
_cell_length_b   5.718
_cell_length_c   10.303
_cell_angle_alpha   93.701
_cell_angle_beta   93.685
_cell_angle_gamma   90.655
_symmetry_Int_Tables_number   1
_cell_volume   334.822
_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
  La  La0  1  1.000  0.000  0.500  1.0
  La  La1  1  0.512  0.028  0.201  1.0
  La  La2  1  0.488  0.972  0.799  1.0
  La  La3  1  0.032  0.505  0.210  1.0
  La  La4  1  0.968  0.495  0.790  1.0
  Mn  Mn5  1  0.500  0.500  1.000  1.0
  O  O6  1  0.310  0.306  0.434  1.0
  O  O7  1  0.690  0.694  0.566  1.0
  O  O8  1  0.226  0.220  0.675  1.0
  O  O9  1  0.774  0.780  0.325  1.0
  O  O10  1  0.548  0.549  0.799  1.0
  O  O11  1  0.452  0.451  0.201  1.0
  O  O12  1  0.925  0.922  0.817  1.0
  O  O13  1  0.075  0.078  0.183  1.0
  O  O14  1  0.703  0.229  0.635  1.0
  O  O15  1  0.297  0.771  0.365  1.0
  O  O16  1  0.222  0.696  0.635  1.0
  O  O17  1  0.778  0.304  0.365  1.0
  O  O18  1  0.303  0.820  0.996  1.0
  O  O19  1  0.697  0.180  0.004  1.0
  O  O20  1  0.828  0.712  0.038  1.0
  O  O21  1  0.172  0.288  0.962  1.0
  Re  Re22  1  1.000  1.000  1.000  1.0
  Re  Re23  1  0.446  0.446  0.605  1.0
  Re  Re24  1  0.554  0.554  0.395  1.0
[/CIF]
.