The material described by GdB2HO5 crystallizes in the monoclinic P2_1 space group. There are two inequivalent Gd sites. In the first Gd site, Gd(1) is bonded in a 9-coordinate geometry to one H(1), one O(1), one O(10), one O(3), one O(4), one O(5), one O(6), one O(7), and one O(9) atom. In the second Gd site, Gd(2) is bonded in a 8-coordinate geometry to one O(10), one O(2), one O(3), one O(4), one O(5), one O(6), one O(8), and one O(9) atom. There are four inequivalent B sites. In the first B site, B(1) is bonded in a tetrahedral geometry to one O(2), one O(4), one O(7), and one O(9) atom. In the second B site, B(2) is bonded in a tetrahedral geometry to one O(1), one O(10), one O(3), and one O(8) atom. In the third B site, B(3) is bonded in a trigonal planar geometry to one O(1), one O(5), and one O(7) atom. In the fourth B site, B(4) is bonded in a trigonal planar geometry to one O(2), one O(6), and one O(8) atom. There are two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one Gd(1) and one O(4) atom. In the second H site, H(2) is bonded in a distorted linear geometry to one O(3) and one O(9) atom. There are ten inequivalent O sites. In the first O site, O(9) is bonded in a 4-coordinate geometry to one Gd(1), one Gd(2), one B(1), and one H(2) atom. In the second O site, O(10) is bonded in a 3-coordinate geometry to one Gd(1), one Gd(2), and one B(2) atom. In the third O site, O(1) is bonded in a 2-coordinate geometry to one Gd(1), one B(2), and one B(3) atom. In the fourth O site, O(2) is bonded in a 2-coordinate geometry to one Gd(2), one B(1), and one B(4) atom. In the fifth O site, O(3) is bonded in a distorted water-like geometry to one Gd(1), one Gd(2), one B(2), and one H(2) atom. In the sixth O site, O(4) is bonded in a distorted water-like geometry to one Gd(1), one Gd(2), one B(1), and one H(1) atom. In the seventh O site, O(5) is bonded in a distorted single-bond geometry to one Gd(1), one Gd(2), and one B(3) atom. In the eighth O site, O(6) is bonded in a distorted trigonal planar geometry to one Gd(1), one Gd(2), and one B(4) atom. In the ninth O site, O(7) is bonded in a distorted bent 120 degrees geometry to one Gd(1), one B(1), and one B(3) atom. In the tenth O site, O(8) is bonded in a distorted bent 120 degrees geometry to one Gd(2), one B(2), and one B(4) atom. is represented by the CIF file [CIF]
data_GdB2HO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.597
_cell_length_b   5.684
_cell_length_c   11.867
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   101.836
_symmetry_Int_Tables_number   1
_cell_volume   369.502
_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
  Gd  Gd0  1  0.312  0.207  0.577  1.0
  Gd  Gd1  1  0.188  0.293  0.077  1.0
  Gd  Gd2  1  0.652  0.767  0.450  1.0
  Gd  Gd3  1  0.848  0.733  0.950  1.0
  B  B4  1  0.398  0.113  0.869  1.0
  B  B5  1  0.102  0.387  0.369  1.0
  B  B6  1  0.628  0.904  0.148  1.0
  B  B7  1  0.872  0.596  0.648  1.0
  B  B8  1  0.387  0.134  0.289  1.0
  B  B9  1  0.113  0.366  0.789  1.0
  B  B10  1  0.643  0.893  0.728  1.0
  B  B11  1  0.857  0.607  0.228  1.0
  H  H12  1  0.423  0.461  0.900  1.0
  H  H13  1  0.077  0.039  0.400  1.0
  H  H14  1  0.372  0.818  0.022  1.0
  H  H15  1  0.128  0.682  0.522  1.0
  O  O16  1  0.473  0.074  0.186  1.0
  O  O17  1  0.027  0.426  0.686  1.0
  O  O18  1  0.580  0.977  0.832  1.0
  O  O19  1  0.920  0.523  0.332  1.0
  O  O20  1  0.472  0.722  0.068  1.0
  O  O21  1  0.028  0.778  0.568  1.0
  O  O22  1  0.529  0.352  0.925  1.0
  O  O23  1  0.971  0.148  0.425  1.0
  O  O24  1  0.413  0.042  0.393  1.0
  O  O25  1  0.087  0.458  0.893  1.0
  O  O26  1  0.567  0.948  0.625  1.0
  O  O27  1  0.933  0.552  0.125  1.0
  O  O28  1  0.261  0.194  0.773  1.0
  O  O29  1  0.239  0.306  0.273  1.0
  O  O30  1  0.697  0.765  0.245  1.0
  O  O31  1  0.803  0.735  0.745  1.0
  O  O32  1  0.271  0.516  0.450  1.0
  O  O33  1  0.229  0.984  0.950  1.0
  O  O34  1  0.661  0.478  0.586  1.0
  O  O35  1  0.839  0.022  0.086  1.0
[/CIF]
.
The material described by GdB2HO5 crystallizes in the monoclinic P2_1 space group. There are two inequivalent Gd sites. In the first Gd site, Gd(1) is bonded in a 9-coordinate geometry to one H(1), one O(1), one O(10), one O(3), one O(4), one O(5), one O(6), one O(7), and one O(9) atom. In the second Gd site, Gd(2) is bonded in a 8-coordinate geometry to one O(10), one O(2), one O(3), one O(4), one O(5), one O(6), one O(8), and one O(9) atom. There are four inequivalent B sites. In the first B site, B(1) is bonded in a tetrahedral geometry to one O(2), one O(4), one O(7), and one O(9) atom. In the second B site, B(2) is bonded in a tetrahedral geometry to one O(1), one O(10), one O(3), and one O(8) atom. In the third B site, B(3) is bonded in a trigonal planar geometry to one O(1), one O(5), and one O(7) atom. In the fourth B site, B(4) is bonded in a trigonal planar geometry to one O(2), one O(6), and one O(8) atom. There are two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one Gd(1) and one O(4) atom. In the second H site, H(2) is bonded in a distorted linear geometry to one O(3) and one O(9) atom. There are ten inequivalent O sites. In the first O site, O(9) is bonded in a 4-coordinate geometry to one Gd(1), one Gd(2), one B(1), and one H(2) atom. In the second O site, O(10) is bonded in a 3-coordinate geometry to one Gd(1), one Gd(2), and one B(2) atom. In the third O site, O(1) is bonded in a 2-coordinate geometry to one Gd(1), one B(2), and one B(3) atom. In the fourth O site, O(2) is bonded in a 2-coordinate geometry to one Gd(2), one B(1), and one B(4) atom. In the fifth O site, O(3) is bonded in a distorted water-like geometry to one Gd(1), one Gd(2), one B(2), and one H(2) atom. In the sixth O site, O(4) is bonded in a distorted water-like geometry to one Gd(1), one Gd(2), one B(1), and one H(1) atom. In the seventh O site, O(5) is bonded in a distorted single-bond geometry to one Gd(1), one Gd(2), and one B(3) atom. In the eighth O site, O(6) is bonded in a distorted trigonal planar geometry to one Gd(1), one Gd(2), and one B(4) atom. In the ninth O site, O(7) is bonded in a distorted bent 120 degrees geometry to one Gd(1), one B(1), and one B(3) atom. In the tenth O site, O(8) is bonded in a distorted bent 120 degrees geometry to one Gd(2), one B(2), and one B(4) atom. is represented by the CIF file [CIF]
data_GdB2HO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.597
_cell_length_b   5.684
_cell_length_c   11.867
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   101.836
_symmetry_Int_Tables_number   1
_cell_volume   369.502
_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
  Gd  Gd0  1  0.312  0.207  0.577  1.0
  Gd  Gd1  1  0.188  0.293  0.077  1.0
  Gd  Gd2  1  0.652  0.767  0.450  1.0
  Gd  Gd3  1  0.848  0.733  0.950  1.0
  B  B4  1  0.398  0.113  0.869  1.0
  B  B5  1  0.102  0.387  0.369  1.0
  B  B6  1  0.628  0.904  0.148  1.0
  B  B7  1  0.872  0.596  0.648  1.0
  B  B8  1  0.387  0.134  0.289  1.0
  B  B9  1  0.113  0.366  0.789  1.0
  B  B10  1  0.643  0.893  0.728  1.0
  B  B11  1  0.857  0.607  0.228  1.0
  H  H12  1  0.423  0.461  0.900  1.0
  H  H13  1  0.077  0.039  0.400  1.0
  H  H14  1  0.372  0.818  0.022  1.0
  H  H15  1  0.128  0.682  0.522  1.0
  O  O16  1  0.473  0.074  0.186  1.0
  O  O17  1  0.027  0.426  0.686  1.0
  O  O18  1  0.580  0.977  0.832  1.0
  O  O19  1  0.920  0.523  0.332  1.0
  O  O20  1  0.472  0.722  0.068  1.0
  O  O21  1  0.028  0.778  0.568  1.0
  O  O22  1  0.529  0.352  0.925  1.0
  O  O23  1  0.971  0.148  0.425  1.0
  O  O24  1  0.413  0.042  0.393  1.0
  O  O25  1  0.087  0.458  0.893  1.0
  O  O26  1  0.567  0.948  0.625  1.0
  O  O27  1  0.933  0.552  0.125  1.0
  O  O28  1  0.261  0.194  0.773  1.0
  O  O29  1  0.239  0.306  0.273  1.0
  O  O30  1  0.697  0.765  0.245  1.0
  O  O31  1  0.803  0.735  0.745  1.0
  O  O32  1  0.271  0.516  0.450  1.0
  O  O33  1  0.229  0.984  0.950  1.0
  O  O34  1  0.661  0.478  0.586  1.0
  O  O35  1  0.839  0.022  0.086  1.0
[/CIF]
.