The material described by Pr2CdS4 crystallizes in the tetragonal I-42d space group. Pr(1) is bonded in a 8-coordinate geometry to eight equivalent S(1) atoms. Cd(1) is bonded in a distorted square co-planar geometry to four equivalent S(1) atoms. S(1) is bonded in a 5-coordinate geometry to four equivalent Pr(1) and one Cd(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Pr2CdS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.497
_cell_length_b   7.497
_cell_length_c   7.497
_cell_angle_alpha   110.792
_cell_angle_beta   110.792
_cell_angle_gamma   106.861
_symmetry_Int_Tables_number   1
_cell_volume   323.809
_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
  Pr  Pr0  1  0.375  0.987  0.112  1.0
  Pr  Pr1  1  0.737  0.625  0.612  1.0
  Pr  Pr2  1  0.875  0.263  0.888  1.0
  Pr  Pr3  1  0.013  0.125  0.388  1.0
  Cd  Cd4  1  0.250  0.750  0.500  1.0
  Cd  Cd5  1  0.500  0.500  0.000  1.0
  S  S6  1  0.118  0.993  0.735  1.0
  S  S7  1  0.492  0.257  0.625  1.0
  S  S8  1  0.632  0.867  0.375  1.0
  S  S9  1  0.258  0.383  0.265  1.0
  S  S10  1  0.007  0.742  0.125  1.0
  S  S11  1  0.617  0.882  0.875  1.0
  S  S12  1  0.133  0.508  0.765  1.0
  S  S13  1  0.743  0.368  0.235  1.0
[/CIF]
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The material described by Pr2CdS4 crystallizes in the tetragonal I-42d space group. Pr(1) is bonded in a 8-coordinate geometry to eight equivalent S(1) atoms. Cd(1) is bonded in a distorted square co-planar geometry to four equivalent S(1) atoms. S(1) is bonded in a 5-coordinate geometry to four equivalent Pr(1) and one Cd(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Pr2CdS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.497
_cell_length_b   7.497
_cell_length_c   7.497
_cell_angle_alpha   110.792
_cell_angle_beta   110.792
_cell_angle_gamma   106.861
_symmetry_Int_Tables_number   1
_cell_volume   323.809
_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
  Pr  Pr0  1  0.375  0.987  0.112  1.0
  Pr  Pr1  1  0.737  0.625  0.612  1.0
  Pr  Pr2  1  0.875  0.263  0.888  1.0
  Pr  Pr3  1  0.013  0.125  0.388  1.0
  Cd  Cd4  1  0.250  0.750  0.500  1.0
  Cd  Cd5  1  0.500  0.500  0.000  1.0
  S  S6  1  0.118  0.993  0.735  1.0
  S  S7  1  0.492  0.257  0.625  1.0
  S  S8  1  0.632  0.867  0.375  1.0
  S  S9  1  0.258  0.383  0.265  1.0
  S  S10  1  0.007  0.742  0.125  1.0
  S  S11  1  0.617  0.882  0.875  1.0
  S  S12  1  0.133  0.508  0.765  1.0
  S  S13  1  0.743  0.368  0.235  1.0
[/CIF]
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