The structure described by LiB2BiO5 crystallizes in the monoclinic C2 space group. Li(1) is bonded in a distorted trigonal pyramidal geometry to two equivalent O(1) and two equivalent O(2) atoms. B(1) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(3) atom. Bi(1) is bonded in a 10-coordinate geometry to two equivalent O(3), four equivalent O(1), and four equivalent O(2) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to one Li(1), one B(1), and two equivalent Bi(1) atoms. In the second O site, O(2) is bonded in a distorted water-like geometry to one Li(1), one B(1), and two equivalent Bi(1) atoms. In the third O site, O(3) is bonded in a bent 120 degrees geometry to two equivalent B(1) and two equivalent Bi(1) atoms. is represented by the CIF card [CIF]
data_LiBiB2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.285
_cell_length_b   5.285
_cell_length_c   3.842
_cell_angle_alpha   86.143
_cell_angle_beta   86.143
_cell_angle_gamma   110.060
_symmetry_Int_Tables_number   1
_cell_volume   100.109
_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
  Li  Li0  1  0.399  0.601  0.500  1.0
  Bi  Bi1  1  0.013  0.987  0.000  1.0
  B  B2  1  0.876  0.490  0.629  1.0
  B  B3  1  0.510  0.124  0.371  1.0
  O  O4  1  0.788  0.700  0.532  1.0
  O  O5  1  0.471  0.929  0.148  1.0
  O  O6  1  0.765  0.235  0.500  1.0
  O  O7  1  0.071  0.529  0.852  1.0
  O  O8  1  0.300  0.212  0.468  1.0
[/CIF]
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The structure described by LiB2BiO5 crystallizes in the monoclinic C2 space group. Li(1) is bonded in a distorted trigonal pyramidal geometry to two equivalent O(1) and two equivalent O(2) atoms. B(1) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(3) atom. Bi(1) is bonded in a 10-coordinate geometry to two equivalent O(3), four equivalent O(1), and four equivalent O(2) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to one Li(1), one B(1), and two equivalent Bi(1) atoms. In the second O site, O(2) is bonded in a distorted water-like geometry to one Li(1), one B(1), and two equivalent Bi(1) atoms. In the third O site, O(3) is bonded in a bent 120 degrees geometry to two equivalent B(1) and two equivalent Bi(1) atoms. is represented by the CIF card [CIF]
data_LiBiB2O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.285
_cell_length_b   5.285
_cell_length_c   3.842
_cell_angle_alpha   86.143
_cell_angle_beta   86.143
_cell_angle_gamma   110.060
_symmetry_Int_Tables_number   1
_cell_volume   100.109
_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
  Li  Li0  1  0.399  0.601  0.500  1.0
  Bi  Bi1  1  0.013  0.987  0.000  1.0
  B  B2  1  0.876  0.490  0.629  1.0
  B  B3  1  0.510  0.124  0.371  1.0
  O  O4  1  0.788  0.700  0.532  1.0
  O  O5  1  0.471  0.929  0.148  1.0
  O  O6  1  0.765  0.235  0.500  1.0
  O  O7  1  0.071  0.529  0.852  1.0
  O  O8  1  0.300  0.212  0.468  1.0
[/CIF]
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