The material described by MoS6 is Indium-derived structured and crystallizes in the orthorhombic Cmmm space group. The structure is zero-dimensional and consists of four hydrogen sulfide atoms and two MoS4 clusters. In each MoS4 cluster, Mo(1) is bonded in a distorted rectangular see-saw-like geometry to four equivalent S(2) atoms. S(2) is bonded in a distorted single-bond geometry to one Mo(1) and one S(2) atom. is represented by the CIF card [CIF]
data_MoS6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.431
_cell_length_b   9.431
_cell_length_c   49.259
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   123.331
_symmetry_Int_Tables_number   1
_cell_volume   3660.915
_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
  Mo  Mo0  1  0.000  0.000  0.000  1.0
  S  S1  1  0.000  0.000  0.250  1.0
  S  S2  1  0.000  0.000  0.750  1.0
  S  S3  1  0.242  0.991  0.000  1.0
  S  S4  1  0.758  0.009  0.000  1.0
  S  S5  1  0.991  0.242  0.000  1.0
  S  S6  1  0.009  0.758  0.000  1.0
[/CIF]
.
The material described by MoS6 is Indium-derived structured and crystallizes in the orthorhombic Cmmm space group. The structure is zero-dimensional and consists of four hydrogen sulfide atoms and two MoS4 clusters. In each MoS4 cluster, Mo(1) is bonded in a distorted rectangular see-saw-like geometry to four equivalent S(2) atoms. S(2) is bonded in a distorted single-bond geometry to one Mo(1) and one S(2) atom. is represented by the CIF card [CIF]
data_MoS6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.431
_cell_length_b   9.431
_cell_length_c   49.259
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   123.331
_symmetry_Int_Tables_number   1
_cell_volume   3660.915
_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
  Mo  Mo0  1  0.000  0.000  0.000  1.0
  S  S1  1  0.000  0.000  0.250  1.0
  S  S2  1  0.000  0.000  0.750  1.0
  S  S3  1  0.242  0.991  0.000  1.0
  S  S4  1  0.758  0.009  0.000  1.0
  S  S5  1  0.991  0.242  0.000  1.0
  S  S6  1  0.009  0.758  0.000  1.0
[/CIF]
.