The material described by DyBO3 crystallizes in the triclinic P-1 space group. There are two inequivalent Dy sites. In the first Dy site, Dy(1) is bonded in a 8-coordinate geometry to one O(2), one O(3), one O(5), one O(6), two equivalent O(1), and two equivalent O(4) atoms. In the second Dy site, Dy(2) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(4), one O(6), two equivalent O(3), and two equivalent O(5) atoms. There are two inequivalent B sites. In the first B site, B(1) is bonded in a trigonal planar geometry to one O(3), one O(5), and one O(6) atom. In the second B site, B(2) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(4) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Dy(2), two equivalent Dy(1), and one B(2) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one Dy(1), one Dy(2), and one B(2) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to one Dy(1), two equivalent Dy(2), and one B(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one Dy(2), two equivalent Dy(1), and one B(2) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one Dy(1), two equivalent Dy(2), and one B(1) atom. In the sixth O site, O(6) is bonded in a 1-coordinate geometry to one Dy(1), one Dy(2), and one B(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_DyBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.106
_cell_length_b   6.356
_cell_length_c   6.352
_cell_angle_alpha   92.322
_cell_angle_beta   108.475
_cell_angle_gamma   107.812
_symmetry_Int_Tables_number   1
_cell_volume   220.043
_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
  Dy  Dy0  1  0.556  0.272  0.846  1.0
  Dy  Dy1  1  0.444  0.728  0.154  1.0
  Dy  Dy2  1  0.939  0.819  0.720  1.0
  Dy  Dy3  1  0.061  0.181  0.280  1.0
  B  B4  1  0.988  0.281  0.768  1.0
  B  B5  1  0.012  0.719  0.232  1.0
  B  B6  1  0.476  0.761  0.712  1.0
  B  B7  1  0.524  0.239  0.288  1.0
  O  O8  1  0.410  0.355  0.132  1.0
  O  O9  1  0.590  0.645  0.868  1.0
  O  O10  1  0.468  0.228  0.478  1.0
  O  O11  1  0.532  0.772  0.522  1.0
  O  O12  1  0.880  0.796  0.339  1.0
  O  O13  1  0.120  0.204  0.661  1.0
  O  O14  1  0.653  0.123  0.219  1.0
  O  O15  1  0.347  0.877  0.781  1.0
  O  O16  1  0.130  0.872  0.116  1.0
  O  O17  1  0.870  0.128  0.884  1.0
  O  O18  1  0.047  0.520  0.235  1.0
  O  O19  1  0.953  0.480  0.765  1.0
[/CIF]
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The material described by DyBO3 crystallizes in the triclinic P-1 space group. There are two inequivalent Dy sites. In the first Dy site, Dy(1) is bonded in a 8-coordinate geometry to one O(2), one O(3), one O(5), one O(6), two equivalent O(1), and two equivalent O(4) atoms. In the second Dy site, Dy(2) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(4), one O(6), two equivalent O(3), and two equivalent O(5) atoms. There are two inequivalent B sites. In the first B site, B(1) is bonded in a trigonal planar geometry to one O(3), one O(5), and one O(6) atom. In the second B site, B(2) is bonded in a trigonal planar geometry to one O(1), one O(2), and one O(4) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Dy(2), two equivalent Dy(1), and one B(2) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one Dy(1), one Dy(2), and one B(2) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to one Dy(1), two equivalent Dy(2), and one B(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one Dy(2), two equivalent Dy(1), and one B(2) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one Dy(1), two equivalent Dy(2), and one B(1) atom. In the sixth O site, O(6) is bonded in a 1-coordinate geometry to one Dy(1), one Dy(2), and one B(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_DyBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.106
_cell_length_b   6.356
_cell_length_c   6.352
_cell_angle_alpha   92.322
_cell_angle_beta   108.475
_cell_angle_gamma   107.812
_symmetry_Int_Tables_number   1
_cell_volume   220.043
_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
  Dy  Dy0  1  0.556  0.272  0.846  1.0
  Dy  Dy1  1  0.444  0.728  0.154  1.0
  Dy  Dy2  1  0.939  0.819  0.720  1.0
  Dy  Dy3  1  0.061  0.181  0.280  1.0
  B  B4  1  0.988  0.281  0.768  1.0
  B  B5  1  0.012  0.719  0.232  1.0
  B  B6  1  0.476  0.761  0.712  1.0
  B  B7  1  0.524  0.239  0.288  1.0
  O  O8  1  0.410  0.355  0.132  1.0
  O  O9  1  0.590  0.645  0.868  1.0
  O  O10  1  0.468  0.228  0.478  1.0
  O  O11  1  0.532  0.772  0.522  1.0
  O  O12  1  0.880  0.796  0.339  1.0
  O  O13  1  0.120  0.204  0.661  1.0
  O  O14  1  0.653  0.123  0.219  1.0
  O  O15  1  0.347  0.877  0.781  1.0
  O  O16  1  0.130  0.872  0.116  1.0
  O  O17  1  0.870  0.128  0.884  1.0
  O  O18  1  0.047  0.520  0.235  1.0
  O  O19  1  0.953  0.480  0.765  1.0
[/CIF]
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