The compound described by ZnGa2S4 crystallizes in the tetragonal P-42m space group. Zn(1) is bonded to four equivalent S(1) atoms to form ZnS4 tetrahedra that share corners with eight equivalent Ga(1)S4 tetrahedra. Ga(1) is bonded to four equivalent S(1) atoms to form GaS4 tetrahedra that share corners with four equivalent Zn(1)S4 tetrahedra and corners with four equivalent Ga(1)S4 tetrahedra. S(1) is bonded in a trigonal non-coplanar geometry to one Zn(1) and two equivalent Ga(1) atoms. is represented by the CIF card [CIF]
data_Zn(GaS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.195
_cell_length_b   5.195
_cell_length_c   5.369
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   144.864
_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  0.000  0.000  0.000  1.0
  Ga  Ga1  1  0.000  0.500  0.500  1.0
  Ga  Ga2  1  0.500  0.000  0.500  1.0
  S  S3  1  0.738  0.738  0.245  1.0
  S  S4  1  0.262  0.262  0.245  1.0
  S  S5  1  0.262  0.738  0.755  1.0
  S  S6  1  0.738  0.262  0.755  1.0
[/CIF]
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The compound described by ZnGa2S4 crystallizes in the tetragonal P-42m space group. Zn(1) is bonded to four equivalent S(1) atoms to form ZnS4 tetrahedra that share corners with eight equivalent Ga(1)S4 tetrahedra. Ga(1) is bonded to four equivalent S(1) atoms to form GaS4 tetrahedra that share corners with four equivalent Zn(1)S4 tetrahedra and corners with four equivalent Ga(1)S4 tetrahedra. S(1) is bonded in a trigonal non-coplanar geometry to one Zn(1) and two equivalent Ga(1) atoms. is represented by the CIF card [CIF]
data_Zn(GaS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.195
_cell_length_b   5.195
_cell_length_c   5.369
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   144.864
_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  0.000  0.000  0.000  1.0
  Ga  Ga1  1  0.000  0.500  0.500  1.0
  Ga  Ga2  1  0.500  0.000  0.500  1.0
  S  S3  1  0.738  0.738  0.245  1.0
  S  S4  1  0.262  0.262  0.245  1.0
  S  S5  1  0.262  0.738  0.755  1.0
  S  S6  1  0.738  0.262  0.755  1.0
[/CIF]
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