The material described by NdAsS crystallizes in the orthorhombic Pnma space group. Nd(1) is bonded in a 9-coordinate geometry to four equivalent As(1) and five equivalent S(1) atoms. As(1) is bonded in a 6-coordinate geometry to four equivalent Nd(1) and two equivalent As(1) atoms. S(1) is bonded to five equivalent Nd(1) atoms to form a mixture of distorted edge and corner-sharing SNd5 trigonal bipyramids. is represented by the CIF file [CIF]
data_NdAsS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.982
_cell_length_b   3.914
_cell_length_c   17.541
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   89.985
_symmetry_Int_Tables_number   1
_cell_volume   273.394
_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
  Nd  Nd0  1  0.772  0.250  0.146  1.0
  Nd  Nd1  1  0.728  0.250  0.646  1.0
  Nd  Nd2  1  0.228  0.750  0.854  1.0
  Nd  Nd3  1  0.272  0.750  0.354  1.0
  As  As4  1  0.795  0.751  0.498  1.0
  As  As5  1  0.705  0.749  0.998  1.0
  As  As6  1  0.205  0.249  0.502  1.0
  As  As7  1  0.295  0.251  0.002  1.0
  S  S8  1  0.770  0.250  0.313  1.0
  S  S9  1  0.730  0.250  0.813  1.0
  S  S10  1  0.230  0.750  0.687  1.0
  S  S11  1  0.270  0.750  0.187  1.0
[/CIF]
.
The material described by NdAsS crystallizes in the orthorhombic Pnma space group. Nd(1) is bonded in a 9-coordinate geometry to four equivalent As(1) and five equivalent S(1) atoms. As(1) is bonded in a 6-coordinate geometry to four equivalent Nd(1) and two equivalent As(1) atoms. S(1) is bonded to five equivalent Nd(1) atoms to form a mixture of distorted edge and corner-sharing SNd5 trigonal bipyramids. is represented by the CIF file [CIF]
data_NdAsS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.982
_cell_length_b   3.914
_cell_length_c   17.541
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   89.985
_symmetry_Int_Tables_number   1
_cell_volume   273.394
_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
  Nd  Nd0  1  0.772  0.250  0.146  1.0
  Nd  Nd1  1  0.728  0.250  0.646  1.0
  Nd  Nd2  1  0.228  0.750  0.854  1.0
  Nd  Nd3  1  0.272  0.750  0.354  1.0
  As  As4  1  0.795  0.751  0.498  1.0
  As  As5  1  0.705  0.749  0.998  1.0
  As  As6  1  0.205  0.249  0.502  1.0
  As  As7  1  0.295  0.251  0.002  1.0
  S  S8  1  0.770  0.250  0.313  1.0
  S  S9  1  0.730  0.250  0.813  1.0
  S  S10  1  0.230  0.750  0.687  1.0
  S  S11  1  0.270  0.750  0.187  1.0
[/CIF]
.