The crystal structure described by HgZnC4(NSe)4 crystallizes in the tetragonal I-4 space group. Hg(1) is bonded in a tetrahedral geometry to four equivalent Se(1) atoms. Zn(1) is bonded in a tetrahedral geometry to four equivalent N(1) atoms. C(1) is bonded in a single-bond geometry to one N(1) and one Se(1) atom. N(1) is bonded in a linear geometry to one Zn(1) and one C(1) atom. Se(1) is bonded in an L-shaped geometry to one Hg(1) and one C(1) atom. is represented by the CIF card [CIF]
data_ZnHgC4(SeN)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.922
_cell_length_b   8.500
_cell_length_c   8.500
_cell_angle_alpha   85.192
_cell_angle_beta   73.171
_cell_angle_gamma   73.171
_symmetry_Int_Tables_number   1
_cell_volume   325.738
_cell_formula_units_Z   1
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
  Zn  Zn0  1  0.750  0.500  0.500  1.0
  Hg  Hg1  1  0.000  0.000  0.000  1.0
  C  C2  1  0.611  0.357  0.211  1.0
  C  C3  1  0.178  0.643  0.789  1.0
  C  C4  1  0.032  0.789  0.357  1.0
  C  C5  1  0.179  0.211  0.643  1.0
  Se  Se6  1  0.539  0.276  0.041  1.0
  Se  Se7  1  0.856  0.724  0.959  1.0
  Se  Se8  1  0.185  0.959  0.276  1.0
  Se  Se9  1  0.420  0.041  0.724  1.0
  N  N10  1  0.652  0.413  0.321  1.0
  N  N11  1  0.386  0.587  0.679  1.0
  N  N12  1  0.935  0.679  0.413  1.0
  N  N13  1  0.027  0.321  0.587  1.0
[/CIF]
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The crystal structure described by HgZnC4(NSe)4 crystallizes in the tetragonal I-4 space group. Hg(1) is bonded in a tetrahedral geometry to four equivalent Se(1) atoms. Zn(1) is bonded in a tetrahedral geometry to four equivalent N(1) atoms. C(1) is bonded in a single-bond geometry to one N(1) and one Se(1) atom. N(1) is bonded in a linear geometry to one Zn(1) and one C(1) atom. Se(1) is bonded in an L-shaped geometry to one Hg(1) and one C(1) atom. is represented by the CIF card [CIF]
data_ZnHgC4(SeN)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.922
_cell_length_b   8.500
_cell_length_c   8.500
_cell_angle_alpha   85.192
_cell_angle_beta   73.171
_cell_angle_gamma   73.171
_symmetry_Int_Tables_number   1
_cell_volume   325.738
_cell_formula_units_Z   1
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
  Zn  Zn0  1  0.750  0.500  0.500  1.0
  Hg  Hg1  1  0.000  0.000  0.000  1.0
  C  C2  1  0.611  0.357  0.211  1.0
  C  C3  1  0.178  0.643  0.789  1.0
  C  C4  1  0.032  0.789  0.357  1.0
  C  C5  1  0.179  0.211  0.643  1.0
  Se  Se6  1  0.539  0.276  0.041  1.0
  Se  Se7  1  0.856  0.724  0.959  1.0
  Se  Se8  1  0.185  0.959  0.276  1.0
  Se  Se9  1  0.420  0.041  0.724  1.0
  N  N10  1  0.652  0.413  0.321  1.0
  N  N11  1  0.386  0.587  0.679  1.0
  N  N12  1  0.935  0.679  0.413  1.0
  N  N13  1  0.027  0.321  0.587  1.0
[/CIF]
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