The material described by DySCl is Baddeleyite-derived structured and crystallizes in the monoclinic P2_1/c space group. Dy(1) is bonded to four equivalent S(1) and three equivalent Cl(1) atoms to form a mixture of distorted edge and corner-sharing DyS4Cl3 pentagonal bipyramids. S(1) is bonded to four equivalent Dy(1) atoms to form a mixture of edge and corner-sharing SDy4 tetrahedra. Cl(1) is bonded in a distorted trigonal non-coplanar geometry to three equivalent Dy(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_DySCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.614
_cell_length_b   6.661
_cell_length_c   6.787
_cell_angle_alpha   90.000
_cell_angle_beta   100.764
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   293.727
_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
  Dy  Dy0  1  0.312  0.456  0.206  1.0
  Dy  Dy1  1  0.688  0.544  0.794  1.0
  Dy  Dy2  1  0.312  0.044  0.706  1.0
  Dy  Dy3  1  0.688  0.956  0.294  1.0
  S  S4  1  0.436  0.758  0.988  1.0
  S  S5  1  0.436  0.742  0.488  1.0
  S  S6  1  0.564  0.242  0.012  1.0
  S  S7  1  0.564  0.258  0.512  1.0
  Cl  Cl8  1  0.936  0.662  0.165  1.0
  Cl  Cl9  1  0.064  0.162  0.335  1.0
  Cl  Cl10  1  0.064  0.338  0.835  1.0
  Cl  Cl11  1  0.936  0.838  0.665  1.0
[/CIF]
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The material described by DySCl is Baddeleyite-derived structured and crystallizes in the monoclinic P2_1/c space group. Dy(1) is bonded to four equivalent S(1) and three equivalent Cl(1) atoms to form a mixture of distorted edge and corner-sharing DyS4Cl3 pentagonal bipyramids. S(1) is bonded to four equivalent Dy(1) atoms to form a mixture of edge and corner-sharing SDy4 tetrahedra. Cl(1) is bonded in a distorted trigonal non-coplanar geometry to three equivalent Dy(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_DySCl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.614
_cell_length_b   6.661
_cell_length_c   6.787
_cell_angle_alpha   90.000
_cell_angle_beta   100.764
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   293.727
_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
  Dy  Dy0  1  0.312  0.456  0.206  1.0
  Dy  Dy1  1  0.688  0.544  0.794  1.0
  Dy  Dy2  1  0.312  0.044  0.706  1.0
  Dy  Dy3  1  0.688  0.956  0.294  1.0
  S  S4  1  0.436  0.758  0.988  1.0
  S  S5  1  0.436  0.742  0.488  1.0
  S  S6  1  0.564  0.242  0.012  1.0
  S  S7  1  0.564  0.258  0.512  1.0
  Cl  Cl8  1  0.936  0.662  0.165  1.0
  Cl  Cl9  1  0.064  0.162  0.335  1.0
  Cl  Cl10  1  0.064  0.338  0.835  1.0
  Cl  Cl11  1  0.936  0.838  0.665  1.0
[/CIF]
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