The structure described by Zn3SbN crystallizes in the orthorhombic Imma space group. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a distorted bent 150 degrees geometry to two equivalent Sb(1) and two equivalent N(1) atoms. In the second Zn site, Zn(2) is bonded in a 2-coordinate geometry to three equivalent Sb(1) and two equivalent N(1) atoms. Sb(1) is bonded in a 7-coordinate geometry to three equivalent Zn(2) and four equivalent Zn(1) atoms. N(1) is bonded to two equivalent Zn(2) and four equivalent Zn(1) atoms to form corner-sharing NZn6 octahedra. The corner-sharing octahedral tilt angles range from 20-22°. is represented by the CIF card [CIF]
data_Zn3SbN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.914
_cell_length_b   6.064
_cell_length_c   6.104
_cell_angle_alpha   120.220
_cell_angle_beta   90.000
_cell_angle_gamma   119.188
_symmetry_Int_Tables_number   1
_cell_volume   156.148
_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
  Zn  Zn0  1  0.207  0.914  0.707  1.0
  Zn  Zn1  1  0.293  0.086  0.293  1.0
  Zn  Zn2  1  0.793  0.086  0.293  1.0
  Zn  Zn3  1  0.707  0.914  0.707  1.0
  Zn  Zn4  1  0.750  0.500  0.182  1.0
  Zn  Zn5  1  0.250  0.500  0.818  1.0
  Sb  Sb6  1  0.250  0.500  0.253  1.0
  Sb  Sb7  1  0.750  0.500  0.747  1.0
  N  N8  1  0.500  0.000  0.000  1.0
  N  N9  1  0.000  0.000  0.500  1.0
[/CIF]
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The structure described by Zn3SbN crystallizes in the orthorhombic Imma space group. There are two inequivalent Zn sites. In the first Zn site, Zn(1) is bonded in a distorted bent 150 degrees geometry to two equivalent Sb(1) and two equivalent N(1) atoms. In the second Zn site, Zn(2) is bonded in a 2-coordinate geometry to three equivalent Sb(1) and two equivalent N(1) atoms. Sb(1) is bonded in a 7-coordinate geometry to three equivalent Zn(2) and four equivalent Zn(1) atoms. N(1) is bonded to two equivalent Zn(2) and four equivalent Zn(1) atoms to form corner-sharing NZn6 octahedra. The corner-sharing octahedral tilt angles range from 20-22°. is represented by the CIF card [CIF]
data_Zn3SbN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.914
_cell_length_b   6.064
_cell_length_c   6.104
_cell_angle_alpha   120.220
_cell_angle_beta   90.000
_cell_angle_gamma   119.188
_symmetry_Int_Tables_number   1
_cell_volume   156.148
_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
  Zn  Zn0  1  0.207  0.914  0.707  1.0
  Zn  Zn1  1  0.293  0.086  0.293  1.0
  Zn  Zn2  1  0.793  0.086  0.293  1.0
  Zn  Zn3  1  0.707  0.914  0.707  1.0
  Zn  Zn4  1  0.750  0.500  0.182  1.0
  Zn  Zn5  1  0.250  0.500  0.818  1.0
  Sb  Sb6  1  0.250  0.500  0.253  1.0
  Sb  Sb7  1  0.750  0.500  0.747  1.0
  N  N8  1  0.500  0.000  0.000  1.0
  N  N9  1  0.000  0.000  0.500  1.0
[/CIF]
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