The material structure described by AgBF4 crystallizes in the orthorhombic Pnma space group. Ag(1) is bonded in a 6-coordinate geometry to one F(1), one F(2), and four equivalent F(3) atoms. B(1) is bonded in a tetrahedral geometry to one F(1), one F(2), and two equivalent F(3) atoms. There are three inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one Ag(1) and one B(1) atom. In the second F site, F(2) is bonded in a single-bond geometry to one Ag(1) and one B(1) atom. In the third F site, F(3) is bonded in a single-bond geometry to two equivalent Ag(1) and one B(1) atom. is represented by the CIF card [CIF]
data_AgBF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.241
_cell_length_b   6.686
_cell_length_c   8.001
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   280.356
_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
  Ag  Ag0  1  0.250  0.167  0.179  1.0
  Ag  Ag1  1  0.750  0.833  0.821  1.0
  Ag  Ag2  1  0.750  0.667  0.321  1.0
  Ag  Ag3  1  0.250  0.333  0.679  1.0
  B  B4  1  0.750  0.185  0.434  1.0
  B  B5  1  0.250  0.815  0.566  1.0
  B  B6  1  0.250  0.685  0.066  1.0
  B  B7  1  0.750  0.315  0.934  1.0
  F  F8  1  0.750  0.416  0.087  1.0
  F  F9  1  0.250  0.584  0.913  1.0
  F  F10  1  0.250  0.916  0.413  1.0
  F  F11  1  0.750  0.084  0.587  1.0
  F  F12  1  0.750  0.449  0.800  1.0
  F  F13  1  0.250  0.551  0.200  1.0
  F  F14  1  0.250  0.949  0.700  1.0
  F  F15  1  0.750  0.051  0.300  1.0
  F  F16  1  0.531  0.191  0.923  1.0
  F  F17  1  0.031  0.809  0.077  1.0
  F  F18  1  0.469  0.691  0.577  1.0
  F  F19  1  0.969  0.309  0.423  1.0
  F  F20  1  0.469  0.809  0.077  1.0
  F  F21  1  0.969  0.191  0.923  1.0
  F  F22  1  0.531  0.309  0.423  1.0
  F  F23  1  0.031  0.691  0.577  1.0
[/CIF]
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The material structure described by AgBF4 crystallizes in the orthorhombic Pnma space group. Ag(1) is bonded in a 6-coordinate geometry to one F(1), one F(2), and four equivalent F(3) atoms. B(1) is bonded in a tetrahedral geometry to one F(1), one F(2), and two equivalent F(3) atoms. There are three inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to one Ag(1) and one B(1) atom. In the second F site, F(2) is bonded in a single-bond geometry to one Ag(1) and one B(1) atom. In the third F site, F(3) is bonded in a single-bond geometry to two equivalent Ag(1) and one B(1) atom. is represented by the CIF card [CIF]
data_AgBF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.241
_cell_length_b   6.686
_cell_length_c   8.001
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   280.356
_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
  Ag  Ag0  1  0.250  0.167  0.179  1.0
  Ag  Ag1  1  0.750  0.833  0.821  1.0
  Ag  Ag2  1  0.750  0.667  0.321  1.0
  Ag  Ag3  1  0.250  0.333  0.679  1.0
  B  B4  1  0.750  0.185  0.434  1.0
  B  B5  1  0.250  0.815  0.566  1.0
  B  B6  1  0.250  0.685  0.066  1.0
  B  B7  1  0.750  0.315  0.934  1.0
  F  F8  1  0.750  0.416  0.087  1.0
  F  F9  1  0.250  0.584  0.913  1.0
  F  F10  1  0.250  0.916  0.413  1.0
  F  F11  1  0.750  0.084  0.587  1.0
  F  F12  1  0.750  0.449  0.800  1.0
  F  F13  1  0.250  0.551  0.200  1.0
  F  F14  1  0.250  0.949  0.700  1.0
  F  F15  1  0.750  0.051  0.300  1.0
  F  F16  1  0.531  0.191  0.923  1.0
  F  F17  1  0.031  0.809  0.077  1.0
  F  F18  1  0.469  0.691  0.577  1.0
  F  F19  1  0.969  0.309  0.423  1.0
  F  F20  1  0.469  0.809  0.077  1.0
  F  F21  1  0.969  0.191  0.923  1.0
  F  F22  1  0.531  0.309  0.423  1.0
  F  F23  1  0.031  0.691  0.577  1.0
[/CIF]
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