The crystal structure described by MoInHSeO7 crystallizes in the monoclinic C2/c space group. Mo(1) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(4), one O(5), one O(6), and one O(8) atom. In(1) is bonded to one O(1), one O(3), one O(7), one O(8), and two equivalent O(2) atoms to form edge-sharing InO6 octahedra. H(1) is bonded in a single-bond geometry to one O(5) atom. Se(1) is bonded in a trigonal non-coplanar geometry to one O(1), one O(3), and one O(7) atom. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one Mo(1), one In(1), and one Se(1) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Mo(1) and two equivalent In(1) atoms. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one In(1) and one Se(1) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to two equivalent Mo(1) atoms. In the fifth O site, O(5) is bonded in a water-like geometry to two equivalent Mo(1) and two equivalent H(1) atoms. In the sixth O site, O(6) is bonded in a single-bond geometry to one Mo(1) atom. In the seventh O site, O(7) is bonded in a bent 120 degrees geometry to one In(1) and one Se(1) atom. In the eighth O site, O(8) is bonded in a linear geometry to one Mo(1) and one In(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_InMoHSeO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.793
_cell_length_b   10.793
_cell_length_c   14.125
_cell_angle_alpha   49.570
_cell_angle_beta   49.570
_cell_angle_gamma   30.683
_symmetry_Int_Tables_number   1
_cell_volume   621.483
_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
  In  In0  1  0.883  0.580  0.406  1.0
  In  In1  1  0.420  0.117  0.094  1.0
  In  In2  1  0.117  0.420  0.594  1.0
  In  In3  1  0.580  0.883  0.906  1.0
  Mo  Mo4  1  0.463  0.745  0.701  1.0
  Mo  Mo5  1  0.255  0.537  0.799  1.0
  Mo  Mo6  1  0.537  0.255  0.299  1.0
  Mo  Mo7  1  0.745  0.463  0.201  1.0
  H  H8  1  0.750  0.202  0.824  1.0
  H  H9  1  0.798  0.250  0.676  1.0
  H  H10  1  0.250  0.798  0.176  1.0
  H  H11  1  0.202  0.750  0.324  1.0
  Se  Se12  1  0.272  0.969  0.430  1.0
  Se  Se13  1  0.031  0.728  0.070  1.0
  Se  Se14  1  0.728  0.031  0.570  1.0
  Se  Se15  1  0.969  0.272  0.930  1.0
  O  O16  1  0.503  0.771  0.503  1.0
  O  O17  1  0.229  0.497  0.997  1.0
  O  O18  1  0.497  0.229  0.497  1.0
  O  O19  1  0.771  0.503  0.003  1.0
  O  O20  1  0.788  0.586  0.599  1.0
  O  O21  1  0.414  0.212  0.901  1.0
  O  O22  1  0.212  0.414  0.401  1.0
  O  O23  1  0.586  0.788  0.099  1.0
  O  O24  1  0.017  0.229  0.492  1.0
  O  O25  1  0.771  0.983  0.008  1.0
  O  O26  1  0.983  0.771  0.508  1.0
  O  O27  1  0.229  0.017  0.992  1.0
  O  O28  1  0.220  0.780  0.750  1.0
  O  O29  1  0.780  0.220  0.250  1.0
  O  O30  1  0.672  0.328  0.750  1.0
  O  O31  1  0.328  0.672  0.250  1.0
  O  O32  1  0.501  0.635  0.849  1.0
  O  O33  1  0.365  0.499  0.651  1.0
  O  O34  1  0.499  0.365  0.151  1.0
  O  O35  1  0.635  0.501  0.349  1.0
  O  O36  1  0.387  0.058  0.281  1.0
  O  O37  1  0.942  0.613  0.219  1.0
  O  O38  1  0.613  0.942  0.719  1.0
  O  O39  1  0.058  0.387  0.781  1.0
  O  O40  1  0.268  0.063  0.661  1.0
  O  O41  1  0.937  0.732  0.839  1.0
  O  O42  1  0.732  0.937  0.339  1.0
  O  O43  1  0.063  0.268  0.161  1.0
[/CIF]
.
The crystal structure described by MoInHSeO7 crystallizes in the monoclinic C2/c space group. Mo(1) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(4), one O(5), one O(6), and one O(8) atom. In(1) is bonded to one O(1), one O(3), one O(7), one O(8), and two equivalent O(2) atoms to form edge-sharing InO6 octahedra. H(1) is bonded in a single-bond geometry to one O(5) atom. Se(1) is bonded in a trigonal non-coplanar geometry to one O(1), one O(3), and one O(7) atom. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one Mo(1), one In(1), and one Se(1) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Mo(1) and two equivalent In(1) atoms. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one In(1) and one Se(1) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to two equivalent Mo(1) atoms. In the fifth O site, O(5) is bonded in a water-like geometry to two equivalent Mo(1) and two equivalent H(1) atoms. In the sixth O site, O(6) is bonded in a single-bond geometry to one Mo(1) atom. In the seventh O site, O(7) is bonded in a bent 120 degrees geometry to one In(1) and one Se(1) atom. In the eighth O site, O(8) is bonded in a linear geometry to one Mo(1) and one In(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_InMoHSeO7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.793
_cell_length_b   10.793
_cell_length_c   14.125
_cell_angle_alpha   49.570
_cell_angle_beta   49.570
_cell_angle_gamma   30.683
_symmetry_Int_Tables_number   1
_cell_volume   621.483
_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
  In  In0  1  0.883  0.580  0.406  1.0
  In  In1  1  0.420  0.117  0.094  1.0
  In  In2  1  0.117  0.420  0.594  1.0
  In  In3  1  0.580  0.883  0.906  1.0
  Mo  Mo4  1  0.463  0.745  0.701  1.0
  Mo  Mo5  1  0.255  0.537  0.799  1.0
  Mo  Mo6  1  0.537  0.255  0.299  1.0
  Mo  Mo7  1  0.745  0.463  0.201  1.0
  H  H8  1  0.750  0.202  0.824  1.0
  H  H9  1  0.798  0.250  0.676  1.0
  H  H10  1  0.250  0.798  0.176  1.0
  H  H11  1  0.202  0.750  0.324  1.0
  Se  Se12  1  0.272  0.969  0.430  1.0
  Se  Se13  1  0.031  0.728  0.070  1.0
  Se  Se14  1  0.728  0.031  0.570  1.0
  Se  Se15  1  0.969  0.272  0.930  1.0
  O  O16  1  0.503  0.771  0.503  1.0
  O  O17  1  0.229  0.497  0.997  1.0
  O  O18  1  0.497  0.229  0.497  1.0
  O  O19  1  0.771  0.503  0.003  1.0
  O  O20  1  0.788  0.586  0.599  1.0
  O  O21  1  0.414  0.212  0.901  1.0
  O  O22  1  0.212  0.414  0.401  1.0
  O  O23  1  0.586  0.788  0.099  1.0
  O  O24  1  0.017  0.229  0.492  1.0
  O  O25  1  0.771  0.983  0.008  1.0
  O  O26  1  0.983  0.771  0.508  1.0
  O  O27  1  0.229  0.017  0.992  1.0
  O  O28  1  0.220  0.780  0.750  1.0
  O  O29  1  0.780  0.220  0.250  1.0
  O  O30  1  0.672  0.328  0.750  1.0
  O  O31  1  0.328  0.672  0.250  1.0
  O  O32  1  0.501  0.635  0.849  1.0
  O  O33  1  0.365  0.499  0.651  1.0
  O  O34  1  0.499  0.365  0.151  1.0
  O  O35  1  0.635  0.501  0.349  1.0
  O  O36  1  0.387  0.058  0.281  1.0
  O  O37  1  0.942  0.613  0.219  1.0
  O  O38  1  0.613  0.942  0.719  1.0
  O  O39  1  0.058  0.387  0.781  1.0
  O  O40  1  0.268  0.063  0.661  1.0
  O  O41  1  0.937  0.732  0.839  1.0
  O  O42  1  0.732  0.937  0.339  1.0
  O  O43  1  0.063  0.268  0.161  1.0
[/CIF]
.