The compound described by LiMnBO3 crystallizes in the orthorhombic Pbca space group. Li(1) is bonded in a 6-coordinate geometry to one O(1), one O(2), and four equivalent O(3) atoms. Mn(1) is bonded to one O(3), three equivalent O(1), and three equivalent O(2) atoms to form a mixture of distorted corner and edge-sharing MnO7 pentagonal bipyramids. 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 one Li(1), three equivalent Mn(1), and one B(1) atom. In the second O site, O(2) is bonded to one Li(1), three equivalent Mn(1), and one B(1) atom to form a mixture of distorted corner and edge-sharing OLiMn3B trigonal bipyramids. In the third O site, O(3) is bonded in a 6-coordinate geometry to four equivalent Li(1), one Mn(1), and one B(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiMnBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.833
_cell_length_b   6.022
_cell_length_c   13.028
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   457.636
_cell_formula_units_Z   8
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  0.488  0.782  0.247  1.0
  Li  Li1  1  0.988  0.718  0.247  1.0
  Li  Li2  1  0.488  0.282  0.253  1.0
  Li  Li3  1  0.988  0.218  0.253  1.0
  Li  Li4  1  0.012  0.782  0.747  1.0
  Li  Li5  1  0.512  0.718  0.747  1.0
  Li  Li6  1  0.012  0.282  0.753  1.0
  Li  Li7  1  0.512  0.218  0.753  1.0
  Mn  Mn8  1  0.749  0.991  0.067  1.0
  Mn  Mn9  1  0.249  0.509  0.067  1.0
  Mn  Mn10  1  0.249  0.009  0.433  1.0
  Mn  Mn11  1  0.749  0.491  0.433  1.0
  Mn  Mn12  1  0.751  0.991  0.567  1.0
  Mn  Mn13  1  0.251  0.509  0.567  1.0
  Mn  Mn14  1  0.751  0.491  0.933  1.0
  Mn  Mn15  1  0.251  0.009  0.933  1.0
  B  B16  1  0.748  0.485  0.146  1.0
  B  B17  1  0.248  0.015  0.146  1.0
  B  B18  1  0.748  0.985  0.354  1.0
  B  B19  1  0.248  0.515  0.354  1.0
  B  B20  1  0.752  0.485  0.646  1.0
  B  B21  1  0.252  0.015  0.646  1.0
  B  B22  1  0.752  0.985  0.854  1.0
  B  B23  1  0.252  0.515  0.854  1.0
  O  O24  1  0.590  0.357  0.092  1.0
  O  O25  1  0.090  0.143  0.092  1.0
  O  O26  1  0.392  0.872  0.091  1.0
  O  O27  1  0.892  0.628  0.091  1.0
  O  O28  1  0.763  0.971  0.249  1.0
  O  O29  1  0.263  0.529  0.249  1.0
  O  O30  1  0.763  0.471  0.251  1.0
  O  O31  1  0.263  0.029  0.251  1.0
  O  O32  1  0.392  0.372  0.409  1.0
  O  O33  1  0.892  0.128  0.409  1.0
  O  O34  1  0.590  0.857  0.408  1.0
  O  O35  1  0.090  0.643  0.408  1.0
  O  O36  1  0.910  0.357  0.592  1.0
  O  O37  1  0.410  0.143  0.592  1.0
  O  O38  1  0.108  0.872  0.591  1.0
  O  O39  1  0.608  0.628  0.591  1.0
  O  O40  1  0.737  0.971  0.749  1.0
  O  O41  1  0.237  0.529  0.749  1.0
  O  O42  1  0.737  0.471  0.751  1.0
  O  O43  1  0.237  0.029  0.751  1.0
  O  O44  1  0.108  0.372  0.909  1.0
  O  O45  1  0.608  0.128  0.909  1.0
  O  O46  1  0.910  0.857  0.908  1.0
  O  O47  1  0.410  0.643  0.908  1.0
[/CIF]
.
The compound described by LiMnBO3 crystallizes in the orthorhombic Pbca space group. Li(1) is bonded in a 6-coordinate geometry to one O(1), one O(2), and four equivalent O(3) atoms. Mn(1) is bonded to one O(3), three equivalent O(1), and three equivalent O(2) atoms to form a mixture of distorted corner and edge-sharing MnO7 pentagonal bipyramids. 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 one Li(1), three equivalent Mn(1), and one B(1) atom. In the second O site, O(2) is bonded to one Li(1), three equivalent Mn(1), and one B(1) atom to form a mixture of distorted corner and edge-sharing OLiMn3B trigonal bipyramids. In the third O site, O(3) is bonded in a 6-coordinate geometry to four equivalent Li(1), one Mn(1), and one B(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiMnBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.833
_cell_length_b   6.022
_cell_length_c   13.028
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   457.636
_cell_formula_units_Z   8
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  0.488  0.782  0.247  1.0
  Li  Li1  1  0.988  0.718  0.247  1.0
  Li  Li2  1  0.488  0.282  0.253  1.0
  Li  Li3  1  0.988  0.218  0.253  1.0
  Li  Li4  1  0.012  0.782  0.747  1.0
  Li  Li5  1  0.512  0.718  0.747  1.0
  Li  Li6  1  0.012  0.282  0.753  1.0
  Li  Li7  1  0.512  0.218  0.753  1.0
  Mn  Mn8  1  0.749  0.991  0.067  1.0
  Mn  Mn9  1  0.249  0.509  0.067  1.0
  Mn  Mn10  1  0.249  0.009  0.433  1.0
  Mn  Mn11  1  0.749  0.491  0.433  1.0
  Mn  Mn12  1  0.751  0.991  0.567  1.0
  Mn  Mn13  1  0.251  0.509  0.567  1.0
  Mn  Mn14  1  0.751  0.491  0.933  1.0
  Mn  Mn15  1  0.251  0.009  0.933  1.0
  B  B16  1  0.748  0.485  0.146  1.0
  B  B17  1  0.248  0.015  0.146  1.0
  B  B18  1  0.748  0.985  0.354  1.0
  B  B19  1  0.248  0.515  0.354  1.0
  B  B20  1  0.752  0.485  0.646  1.0
  B  B21  1  0.252  0.015  0.646  1.0
  B  B22  1  0.752  0.985  0.854  1.0
  B  B23  1  0.252  0.515  0.854  1.0
  O  O24  1  0.590  0.357  0.092  1.0
  O  O25  1  0.090  0.143  0.092  1.0
  O  O26  1  0.392  0.872  0.091  1.0
  O  O27  1  0.892  0.628  0.091  1.0
  O  O28  1  0.763  0.971  0.249  1.0
  O  O29  1  0.263  0.529  0.249  1.0
  O  O30  1  0.763  0.471  0.251  1.0
  O  O31  1  0.263  0.029  0.251  1.0
  O  O32  1  0.392  0.372  0.409  1.0
  O  O33  1  0.892  0.128  0.409  1.0
  O  O34  1  0.590  0.857  0.408  1.0
  O  O35  1  0.090  0.643  0.408  1.0
  O  O36  1  0.910  0.357  0.592  1.0
  O  O37  1  0.410  0.143  0.592  1.0
  O  O38  1  0.108  0.872  0.591  1.0
  O  O39  1  0.608  0.628  0.591  1.0
  O  O40  1  0.737  0.971  0.749  1.0
  O  O41  1  0.237  0.529  0.749  1.0
  O  O42  1  0.737  0.471  0.751  1.0
  O  O43  1  0.237  0.029  0.751  1.0
  O  O44  1  0.108  0.372  0.909  1.0
  O  O45  1  0.608  0.128  0.909  1.0
  O  O46  1  0.910  0.857  0.908  1.0
  O  O47  1  0.410  0.643  0.908  1.0
[/CIF]
.