The material structure described by LiMnBO3 crystallizes in the monoclinic P2_1/c space group. Li(1) is bonded in a 4-coordinate geometry to one O(2), one O(3), and two equivalent O(1) atoms. Mn(1) is bonded in a 5-coordinate geometry to one O(3), 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. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 5-coordinate geometry to two equivalent Li(1), two equivalent Mn(1), and one B(1) atom. In the second O site, O(2) is bonded in a 4-coordinate geometry to one Li(1), two equivalent Mn(1), and one B(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Li(1), one Mn(1), and one B(1) atom. is represented by the CIF card [CIF]
data_LiMnBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.047
_cell_length_b   7.699
_cell_length_c   5.599
_cell_angle_alpha   89.986
_cell_angle_beta   71.761
_cell_angle_gamma   89.991
_symmetry_Int_Tables_number   1
_cell_volume   288.546
_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
  Li  Li0  1  0.091  0.062  0.763  1.0
  Li  Li1  1  0.408  0.562  0.737  1.0
  Li  Li2  1  0.591  0.439  0.263  1.0
  Li  Li3  1  0.908  0.938  0.236  1.0
  Mn  Mn4  1  0.257  0.249  0.143  1.0
  Mn  Mn5  1  0.243  0.750  0.357  1.0
  Mn  Mn6  1  0.757  0.250  0.643  1.0
  Mn  Mn7  1  0.743  0.750  0.857  1.0
  B  B8  1  0.194  0.372  0.609  1.0
  B  B9  1  0.306  0.872  0.891  1.0
  B  B10  1  0.694  0.128  0.108  1.0
  B  B11  1  0.806  0.628  0.392  1.0
  O  O12  1  0.193  0.987  0.075  1.0
  O  O13  1  0.078  0.250  0.531  1.0
  O  O14  1  0.307  0.487  0.424  1.0
  O  O15  1  0.214  0.372  0.843  1.0
  O  O16  1  0.287  0.872  0.657  1.0
  O  O17  1  0.578  0.250  0.031  1.0
  O  O18  1  0.422  0.750  0.969  1.0
  O  O19  1  0.714  0.128  0.343  1.0
  O  O20  1  0.786  0.628  0.157  1.0
  O  O21  1  0.693  0.513  0.576  1.0
  O  O22  1  0.922  0.750  0.469  1.0
  O  O23  1  0.807  0.013  0.924  1.0
[/CIF]
.
The material structure described by LiMnBO3 crystallizes in the monoclinic P2_1/c space group. Li(1) is bonded in a 4-coordinate geometry to one O(2), one O(3), and two equivalent O(1) atoms. Mn(1) is bonded in a 5-coordinate geometry to one O(3), 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. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 5-coordinate geometry to two equivalent Li(1), two equivalent Mn(1), and one B(1) atom. In the second O site, O(2) is bonded in a 4-coordinate geometry to one Li(1), two equivalent Mn(1), and one B(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Li(1), one Mn(1), and one B(1) atom. is represented by the CIF card [CIF]
data_LiMnBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.047
_cell_length_b   7.699
_cell_length_c   5.599
_cell_angle_alpha   89.986
_cell_angle_beta   71.761
_cell_angle_gamma   89.991
_symmetry_Int_Tables_number   1
_cell_volume   288.546
_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
  Li  Li0  1  0.091  0.062  0.763  1.0
  Li  Li1  1  0.408  0.562  0.737  1.0
  Li  Li2  1  0.591  0.439  0.263  1.0
  Li  Li3  1  0.908  0.938  0.236  1.0
  Mn  Mn4  1  0.257  0.249  0.143  1.0
  Mn  Mn5  1  0.243  0.750  0.357  1.0
  Mn  Mn6  1  0.757  0.250  0.643  1.0
  Mn  Mn7  1  0.743  0.750  0.857  1.0
  B  B8  1  0.194  0.372  0.609  1.0
  B  B9  1  0.306  0.872  0.891  1.0
  B  B10  1  0.694  0.128  0.108  1.0
  B  B11  1  0.806  0.628  0.392  1.0
  O  O12  1  0.193  0.987  0.075  1.0
  O  O13  1  0.078  0.250  0.531  1.0
  O  O14  1  0.307  0.487  0.424  1.0
  O  O15  1  0.214  0.372  0.843  1.0
  O  O16  1  0.287  0.872  0.657  1.0
  O  O17  1  0.578  0.250  0.031  1.0
  O  O18  1  0.422  0.750  0.969  1.0
  O  O19  1  0.714  0.128  0.343  1.0
  O  O20  1  0.786  0.628  0.157  1.0
  O  O21  1  0.693  0.513  0.576  1.0
  O  O22  1  0.922  0.750  0.469  1.0
  O  O23  1  0.807  0.013  0.924  1.0
[/CIF]
.