The crystal structure described by Mn5(SO5)3 crystallizes in the monoclinic P2_1/m space group. There are three inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(3), one O(4), one O(5), one O(6), and two equivalent O(7) atoms to form MnO6 octahedra that share corners with two equivalent Mn(2)O5 trigonal bipyramids and edges with two equivalent Mn(1)O6 octahedra. In the second Mn site, Mn(2) is bonded to one O(10), one O(2), one O(3), and two equivalent O(6) atoms to form corner-sharing MnO5 trigonal bipyramids. The corner-sharing octahedral tilt angles range from 51-59°. In the third Mn site, Mn(3) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(6), one O(8), and two equivalent O(9) atoms. There are three inequivalent S sites. In the first S site, S(1) is bonded in a trigonal non-coplanar geometry to one O(1) and two equivalent O(5) atoms. In the second S site, S(2) is bonded in a trigonal non-coplanar geometry to one O(2) and two equivalent O(7) atoms. In the third S site, S(3) is bonded in a trigonal non-coplanar geometry to one O(4) and two equivalent O(9) atoms. There are ten inequivalent O sites. In the first O site, O(7) is bonded in a distorted trigonal planar geometry to two equivalent Mn(1) and one S(2) atom. In the second O site, O(8) is bonded in a single-bond geometry to one Mn(3) atom. In the third O site, O(9) is bonded in a distorted trigonal planar geometry to two equivalent Mn(3) and one S(3) atom. In the fourth O site, O(10) is bonded in a trigonal non-coplanar geometry to one Mn(2) and two equivalent Mn(3) atoms. In the fifth O site, O(1) is bonded in a distorted trigonal planar geometry to two equivalent Mn(3) and one S(1) atom. In the sixth O site, O(2) is bonded in a bent 150 degrees geometry to one Mn(2) and one S(2) atom. In the seventh O site, O(3) is bonded in a trigonal planar geometry to one Mn(2) and two equivalent Mn(1) atoms. In the eighth O site, O(4) is bonded in a distorted trigonal planar geometry to two equivalent Mn(1) and one S(3) atom. In the ninth O site, O(5) is bonded in a bent 150 degrees geometry to one Mn(1) and one S(1) atom. In the tenth O site, O(6) is bonded in a trigonal planar geometry to one Mn(1), one Mn(2), and one Mn(3) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Mn5(SO5)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.370
_cell_length_b   8.098
_cell_length_c   10.365
_cell_angle_alpha   90.000
_cell_angle_beta   98.905
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   611.191
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.306  0.051  0.392  1.0
  Mn  Mn1  1  0.694  0.949  0.608  1.0
  Mn  Mn2  1  0.694  0.551  0.608  1.0
  Mn  Mn3  1  0.306  0.449  0.392  1.0
  Mn  Mn4  1  0.057  0.250  0.600  1.0
  Mn  Mn5  1  0.943  0.750  0.400  1.0
  Mn  Mn6  1  0.053  0.050  0.841  1.0
  Mn  Mn7  1  0.947  0.950  0.159  1.0
  Mn  Mn8  1  0.947  0.550  0.159  1.0
  Mn  Mn9  1  0.053  0.450  0.841  1.0
  S  S10  1  0.650  0.250  0.823  1.0
  S  S11  1  0.350  0.750  0.177  1.0
  S  S12  1  0.684  0.250  0.377  1.0
  S  S13  1  0.316  0.750  0.623  1.0
  S  S14  1  0.243  0.250  0.100  1.0
  S  S15  1  0.757  0.750  0.900  1.0
  O  O16  1  0.865  0.250  0.865  1.0
  O  O17  1  0.135  0.750  0.135  1.0
  O  O18  1  0.887  0.250  0.433  1.0
  O  O19  1  0.113  0.750  0.567  1.0
  O  O20  1  0.255  0.250  0.498  1.0
  O  O21  1  0.745  0.750  0.502  1.0
  O  O22  1  0.281  0.250  0.249  1.0
  O  O23  1  0.719  0.750  0.751  1.0
  O  O24  1  0.396  0.597  0.260  1.0
  O  O25  1  0.604  0.403  0.740  1.0
  O  O26  1  0.604  0.097  0.740  1.0
  O  O27  1  0.396  0.903  0.260  1.0
  O  O28  1  0.058  0.541  0.335  1.0
  O  O29  1  0.942  0.459  0.665  1.0
  O  O30  1  0.942  0.041  0.665  1.0
  O  O31  1  0.058  0.959  0.335  1.0
  O  O32  1  0.599  0.099  0.441  1.0
  O  O33  1  0.401  0.901  0.559  1.0
  O  O34  1  0.401  0.599  0.559  1.0
  O  O35  1  0.599  0.401  0.441  1.0
  O  O36  1  0.760  0.074  0.142  1.0
  O  O37  1  0.240  0.926  0.858  1.0
  O  O38  1  0.240  0.574  0.858  1.0
  O  O39  1  0.760  0.426  0.142  1.0
  O  O40  1  0.116  0.097  0.066  1.0
  O  O41  1  0.884  0.903  0.934  1.0
  O  O42  1  0.884  0.597  0.934  1.0
  O  O43  1  0.116  0.403  0.066  1.0
  O  O44  1  0.180  0.250  0.784  1.0
  O  O45  1  0.820  0.750  0.216  1.0
[/CIF]
.
The crystal structure described by Mn5(SO5)3 crystallizes in the monoclinic P2_1/m space group. There are three inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(3), one O(4), one O(5), one O(6), and two equivalent O(7) atoms to form MnO6 octahedra that share corners with two equivalent Mn(2)O5 trigonal bipyramids and edges with two equivalent Mn(1)O6 octahedra. In the second Mn site, Mn(2) is bonded to one O(10), one O(2), one O(3), and two equivalent O(6) atoms to form corner-sharing MnO5 trigonal bipyramids. The corner-sharing octahedral tilt angles range from 51-59°. In the third Mn site, Mn(3) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(6), one O(8), and two equivalent O(9) atoms. There are three inequivalent S sites. In the first S site, S(1) is bonded in a trigonal non-coplanar geometry to one O(1) and two equivalent O(5) atoms. In the second S site, S(2) is bonded in a trigonal non-coplanar geometry to one O(2) and two equivalent O(7) atoms. In the third S site, S(3) is bonded in a trigonal non-coplanar geometry to one O(4) and two equivalent O(9) atoms. There are ten inequivalent O sites. In the first O site, O(7) is bonded in a distorted trigonal planar geometry to two equivalent Mn(1) and one S(2) atom. In the second O site, O(8) is bonded in a single-bond geometry to one Mn(3) atom. In the third O site, O(9) is bonded in a distorted trigonal planar geometry to two equivalent Mn(3) and one S(3) atom. In the fourth O site, O(10) is bonded in a trigonal non-coplanar geometry to one Mn(2) and two equivalent Mn(3) atoms. In the fifth O site, O(1) is bonded in a distorted trigonal planar geometry to two equivalent Mn(3) and one S(1) atom. In the sixth O site, O(2) is bonded in a bent 150 degrees geometry to one Mn(2) and one S(2) atom. In the seventh O site, O(3) is bonded in a trigonal planar geometry to one Mn(2) and two equivalent Mn(1) atoms. In the eighth O site, O(4) is bonded in a distorted trigonal planar geometry to two equivalent Mn(1) and one S(3) atom. In the ninth O site, O(5) is bonded in a bent 150 degrees geometry to one Mn(1) and one S(1) atom. In the tenth O site, O(6) is bonded in a trigonal planar geometry to one Mn(1), one Mn(2), and one Mn(3) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Mn5(SO5)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.370
_cell_length_b   8.098
_cell_length_c   10.365
_cell_angle_alpha   90.000
_cell_angle_beta   98.905
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   611.191
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.306  0.051  0.392  1.0
  Mn  Mn1  1  0.694  0.949  0.608  1.0
  Mn  Mn2  1  0.694  0.551  0.608  1.0
  Mn  Mn3  1  0.306  0.449  0.392  1.0
  Mn  Mn4  1  0.057  0.250  0.600  1.0
  Mn  Mn5  1  0.943  0.750  0.400  1.0
  Mn  Mn6  1  0.053  0.050  0.841  1.0
  Mn  Mn7  1  0.947  0.950  0.159  1.0
  Mn  Mn8  1  0.947  0.550  0.159  1.0
  Mn  Mn9  1  0.053  0.450  0.841  1.0
  S  S10  1  0.650  0.250  0.823  1.0
  S  S11  1  0.350  0.750  0.177  1.0
  S  S12  1  0.684  0.250  0.377  1.0
  S  S13  1  0.316  0.750  0.623  1.0
  S  S14  1  0.243  0.250  0.100  1.0
  S  S15  1  0.757  0.750  0.900  1.0
  O  O16  1  0.865  0.250  0.865  1.0
  O  O17  1  0.135  0.750  0.135  1.0
  O  O18  1  0.887  0.250  0.433  1.0
  O  O19  1  0.113  0.750  0.567  1.0
  O  O20  1  0.255  0.250  0.498  1.0
  O  O21  1  0.745  0.750  0.502  1.0
  O  O22  1  0.281  0.250  0.249  1.0
  O  O23  1  0.719  0.750  0.751  1.0
  O  O24  1  0.396  0.597  0.260  1.0
  O  O25  1  0.604  0.403  0.740  1.0
  O  O26  1  0.604  0.097  0.740  1.0
  O  O27  1  0.396  0.903  0.260  1.0
  O  O28  1  0.058  0.541  0.335  1.0
  O  O29  1  0.942  0.459  0.665  1.0
  O  O30  1  0.942  0.041  0.665  1.0
  O  O31  1  0.058  0.959  0.335  1.0
  O  O32  1  0.599  0.099  0.441  1.0
  O  O33  1  0.401  0.901  0.559  1.0
  O  O34  1  0.401  0.599  0.559  1.0
  O  O35  1  0.599  0.401  0.441  1.0
  O  O36  1  0.760  0.074  0.142  1.0
  O  O37  1  0.240  0.926  0.858  1.0
  O  O38  1  0.240  0.574  0.858  1.0
  O  O39  1  0.760  0.426  0.142  1.0
  O  O40  1  0.116  0.097  0.066  1.0
  O  O41  1  0.884  0.903  0.934  1.0
  O  O42  1  0.884  0.597  0.934  1.0
  O  O43  1  0.116  0.403  0.066  1.0
  O  O44  1  0.180  0.250  0.784  1.0
  O  O45  1  0.820  0.750  0.216  1.0
[/CIF]
.