The material structure described by Rb2Mo(SO)2 crystallizes in the monoclinic P2_1/c space group. There are two inequivalent Rb sites. In the first Rb site, Rb(1) is bonded in a 8-coordinate geometry to three equivalent S(1), three equivalent S(2), one O(1), and one O(2) atom. In the second Rb site, Rb(2) is bonded in a 8-coordinate geometry to two equivalent S(1), two equivalent S(2), two equivalent O(1), and two equivalent O(2) atoms. Mo(1) is bonded in a distorted tetrahedral geometry to one S(1), one S(2), one O(1), and one O(2) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded to two equivalent Rb(2), three equivalent Rb(1), and one Mo(1) atom to form a mixture of distorted corner and edge-sharing SRb5Mo octahedra. The corner-sharing octahedral tilt angles range from 10-40°. In the second S site, S(2) is bonded in a 1-coordinate geometry to two equivalent Rb(2), three equivalent Rb(1), and one Mo(1) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to one Rb(1), two equivalent Rb(2), and one Mo(1) atom. In the second O site, O(2) is bonded in a 4-coordinate geometry to one Rb(1), two equivalent Rb(2), and one Mo(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Rb2Mo(SO)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.729
_cell_length_b   6.905
_cell_length_c   14.162
_cell_angle_alpha   64.735
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   771.945
_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
  Rb  Rb0  1  0.688  0.666  0.052  1.0
  Rb  Rb1  1  0.188  0.334  0.448  1.0
  Rb  Rb2  1  0.312  0.334  0.948  1.0
  Rb  Rb3  1  0.812  0.666  0.552  1.0
  Rb  Rb4  1  0.481  0.850  0.300  1.0
  Rb  Rb5  1  0.981  0.150  0.200  1.0
  Rb  Rb6  1  0.519  0.150  0.700  1.0
  Rb  Rb7  1  0.019  0.850  0.800  1.0
  Mo  Mo8  1  0.212  0.724  0.085  1.0
  Mo  Mo9  1  0.712  0.276  0.415  1.0
  Mo  Mo10  1  0.788  0.276  0.915  1.0
  Mo  Mo11  1  0.288  0.724  0.585  1.0
  S  S12  1  0.160  0.854  0.432  1.0
  S  S13  1  0.660  0.146  0.068  1.0
  S  S14  1  0.840  0.146  0.568  1.0
  S  S15  1  0.340  0.854  0.932  1.0
  S  S16  1  0.334  0.430  0.197  1.0
  S  S17  1  0.834  0.570  0.303  1.0
  S  S18  1  0.666  0.570  0.803  1.0
  S  S19  1  0.166  0.430  0.697  1.0
  O  O20  1  0.025  0.656  0.061  1.0
  O  O21  1  0.525  0.344  0.439  1.0
  O  O22  1  0.975  0.344  0.939  1.0
  O  O23  1  0.475  0.656  0.561  1.0
  O  O24  1  0.210  0.921  0.134  1.0
  O  O25  1  0.710  0.079  0.366  1.0
  O  O26  1  0.790  0.079  0.866  1.0
  O  O27  1  0.290  0.921  0.634  1.0
[/CIF]
.
The material structure described by Rb2Mo(SO)2 crystallizes in the monoclinic P2_1/c space group. There are two inequivalent Rb sites. In the first Rb site, Rb(1) is bonded in a 8-coordinate geometry to three equivalent S(1), three equivalent S(2), one O(1), and one O(2) atom. In the second Rb site, Rb(2) is bonded in a 8-coordinate geometry to two equivalent S(1), two equivalent S(2), two equivalent O(1), and two equivalent O(2) atoms. Mo(1) is bonded in a distorted tetrahedral geometry to one S(1), one S(2), one O(1), and one O(2) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded to two equivalent Rb(2), three equivalent Rb(1), and one Mo(1) atom to form a mixture of distorted corner and edge-sharing SRb5Mo octahedra. The corner-sharing octahedral tilt angles range from 10-40°. In the second S site, S(2) is bonded in a 1-coordinate geometry to two equivalent Rb(2), three equivalent Rb(1), and one Mo(1) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to one Rb(1), two equivalent Rb(2), and one Mo(1) atom. In the second O site, O(2) is bonded in a 4-coordinate geometry to one Rb(1), two equivalent Rb(2), and one Mo(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Rb2Mo(SO)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.729
_cell_length_b   6.905
_cell_length_c   14.162
_cell_angle_alpha   64.735
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   771.945
_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
  Rb  Rb0  1  0.688  0.666  0.052  1.0
  Rb  Rb1  1  0.188  0.334  0.448  1.0
  Rb  Rb2  1  0.312  0.334  0.948  1.0
  Rb  Rb3  1  0.812  0.666  0.552  1.0
  Rb  Rb4  1  0.481  0.850  0.300  1.0
  Rb  Rb5  1  0.981  0.150  0.200  1.0
  Rb  Rb6  1  0.519  0.150  0.700  1.0
  Rb  Rb7  1  0.019  0.850  0.800  1.0
  Mo  Mo8  1  0.212  0.724  0.085  1.0
  Mo  Mo9  1  0.712  0.276  0.415  1.0
  Mo  Mo10  1  0.788  0.276  0.915  1.0
  Mo  Mo11  1  0.288  0.724  0.585  1.0
  S  S12  1  0.160  0.854  0.432  1.0
  S  S13  1  0.660  0.146  0.068  1.0
  S  S14  1  0.840  0.146  0.568  1.0
  S  S15  1  0.340  0.854  0.932  1.0
  S  S16  1  0.334  0.430  0.197  1.0
  S  S17  1  0.834  0.570  0.303  1.0
  S  S18  1  0.666  0.570  0.803  1.0
  S  S19  1  0.166  0.430  0.697  1.0
  O  O20  1  0.025  0.656  0.061  1.0
  O  O21  1  0.525  0.344  0.439  1.0
  O  O22  1  0.975  0.344  0.939  1.0
  O  O23  1  0.475  0.656  0.561  1.0
  O  O24  1  0.210  0.921  0.134  1.0
  O  O25  1  0.710  0.079  0.366  1.0
  O  O26  1  0.790  0.079  0.866  1.0
  O  O27  1  0.290  0.921  0.634  1.0
[/CIF]
.