The material structure described by NaPdPS4 crystallizes in the tetragonal I4/mcm space group. Na(1) is bonded in a 8-coordinate geometry to eight equivalent S(1) atoms. Pd(1) is bonded in a square co-planar geometry to four equivalent S(1) atoms. P(1) is bonded in a tetrahedral geometry to four equivalent S(1) atoms. S(1) is bonded to two equivalent Na(1), one Pd(1), and one P(1) atom to form a mixture of corner and edge-sharing SNa2PPd trigonal pyramids. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaPPdS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.160
_cell_length_b   8.160
_cell_length_c   8.160
_cell_angle_alpha   125.662
_cell_angle_beta   125.662
_cell_angle_gamma   80.444
_symmetry_Int_Tables_number   1
_cell_volume   345.946
_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
  Na  Na0  1  0.250  0.250  0.000  1.0
  Na  Na1  1  0.750  0.750  0.000  1.0
  P  P2  1  0.250  0.750  0.500  1.0
  P  P3  1  0.750  0.250  0.500  1.0
  Pd  Pd4  1  0.500  0.000  0.500  1.0
  Pd  Pd5  1  0.000  0.500  0.500  1.0
  S  S6  1  0.710  0.210  0.204  1.0
  S  S7  1  0.994  0.494  0.204  1.0
  S  S8  1  0.506  0.710  0.500  1.0
  S  S9  1  0.210  0.006  0.500  1.0
  S  S10  1  0.290  0.790  0.796  1.0
  S  S11  1  0.494  0.290  0.500  1.0
  S  S12  1  0.790  0.994  0.500  1.0
  S  S13  1  0.006  0.506  0.796  1.0
[/CIF]
.
The material structure described by NaPdPS4 crystallizes in the tetragonal I4/mcm space group. Na(1) is bonded in a 8-coordinate geometry to eight equivalent S(1) atoms. Pd(1) is bonded in a square co-planar geometry to four equivalent S(1) atoms. P(1) is bonded in a tetrahedral geometry to four equivalent S(1) atoms. S(1) is bonded to two equivalent Na(1), one Pd(1), and one P(1) atom to form a mixture of corner and edge-sharing SNa2PPd trigonal pyramids. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaPPdS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.160
_cell_length_b   8.160
_cell_length_c   8.160
_cell_angle_alpha   125.662
_cell_angle_beta   125.662
_cell_angle_gamma   80.444
_symmetry_Int_Tables_number   1
_cell_volume   345.946
_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
  Na  Na0  1  0.250  0.250  0.000  1.0
  Na  Na1  1  0.750  0.750  0.000  1.0
  P  P2  1  0.250  0.750  0.500  1.0
  P  P3  1  0.750  0.250  0.500  1.0
  Pd  Pd4  1  0.500  0.000  0.500  1.0
  Pd  Pd5  1  0.000  0.500  0.500  1.0
  S  S6  1  0.710  0.210  0.204  1.0
  S  S7  1  0.994  0.494  0.204  1.0
  S  S8  1  0.506  0.710  0.500  1.0
  S  S9  1  0.210  0.006  0.500  1.0
  S  S10  1  0.290  0.790  0.796  1.0
  S  S11  1  0.494  0.290  0.500  1.0
  S  S12  1  0.790  0.994  0.500  1.0
  S  S13  1  0.006  0.506  0.796  1.0
[/CIF]
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