The compound described by Ho2S3 is Corundum structured and crystallizes in the trigonal R-3c space group. Ho(1) is bonded to six equivalent S(1) atoms to form a mixture of edge, corner, and face-sharing HoS6 octahedra. The corner-sharing octahedral tilt angles range from 47-61°. S(1) is bonded to four equivalent Ho(1) atoms to form a mixture of distorted edge and corner-sharing SHo4 trigonal pyramids. is represented by the Crystallographic Information File (CIF) [CIF]
data_Ho2S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.841
_cell_length_b   6.841
_cell_length_c   7.293
_cell_angle_alpha   117.969
_cell_angle_beta   62.031
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   248.451
_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
  Ho  Ho0  1  0.650  0.350  0.051  1.0
  Ho  Ho1  1  0.850  0.150  0.449  1.0
  Ho  Ho2  1  0.150  0.850  0.551  1.0
  Ho  Ho3  1  0.350  0.650  0.949  1.0
  S  S4  1  0.552  0.750  0.250  1.0
  S  S5  1  0.948  0.448  0.250  1.0
  S  S6  1  0.250  0.052  0.250  1.0
  S  S7  1  0.750  0.948  0.750  1.0
  S  S8  1  0.052  0.552  0.750  1.0
  S  S9  1  0.448  0.250  0.750  1.0
[/CIF]
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The compound described by Ho2S3 is Corundum structured and crystallizes in the trigonal R-3c space group. Ho(1) is bonded to six equivalent S(1) atoms to form a mixture of edge, corner, and face-sharing HoS6 octahedra. The corner-sharing octahedral tilt angles range from 47-61°. S(1) is bonded to four equivalent Ho(1) atoms to form a mixture of distorted edge and corner-sharing SHo4 trigonal pyramids. is represented by the Crystallographic Information File (CIF) [CIF]
data_Ho2S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.841
_cell_length_b   6.841
_cell_length_c   7.293
_cell_angle_alpha   117.969
_cell_angle_beta   62.031
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   248.451
_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
  Ho  Ho0  1  0.650  0.350  0.051  1.0
  Ho  Ho1  1  0.850  0.150  0.449  1.0
  Ho  Ho2  1  0.150  0.850  0.551  1.0
  Ho  Ho3  1  0.350  0.650  0.949  1.0
  S  S4  1  0.552  0.750  0.250  1.0
  S  S5  1  0.948  0.448  0.250  1.0
  S  S6  1  0.250  0.052  0.250  1.0
  S  S7  1  0.750  0.948  0.750  1.0
  S  S8  1  0.052  0.552  0.750  1.0
  S  S9  1  0.448  0.250  0.750  1.0
[/CIF]
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