The compound described by LaBO3 is Potassium chlorate structured and crystallizes in the monoclinic P2_1/m space group. La(1) is bonded in a 9-coordinate geometry to three equivalent O(2) and six equivalent O(1) atoms. B(1) is bonded in a trigonal planar geometry to one O(2) and two equivalent O(1) atoms. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to three equivalent La(1) and one B(1) atom. In the second O site, O(2) is bonded in a 1-coordinate geometry to three equivalent La(1) and one B(1) atom. is represented by the CIF card [CIF]
data_LaBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.179
_cell_length_b   5.089
_cell_length_c   6.314
_cell_angle_alpha   90.000
_cell_angle_beta   107.686
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   127.944
_cell_formula_units_Z   2
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
  La  La0  1  0.621  0.250  0.776  1.0
  La  La1  1  0.379  0.750  0.224  1.0
  B  B2  1  0.997  0.250  0.253  1.0
  B  B3  1  0.003  0.750  0.747  1.0
  O  O4  1  0.841  0.017  0.172  1.0
  O  O5  1  0.159  0.517  0.828  1.0
  O  O6  1  0.673  0.750  0.616  1.0
  O  O7  1  0.327  0.250  0.384  1.0
  O  O8  1  0.159  0.983  0.828  1.0
  O  O9  1  0.841  0.483  0.172  1.0
[/CIF]
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The compound described by LaBO3 is Potassium chlorate structured and crystallizes in the monoclinic P2_1/m space group. La(1) is bonded in a 9-coordinate geometry to three equivalent O(2) and six equivalent O(1) atoms. B(1) is bonded in a trigonal planar geometry to one O(2) and two equivalent O(1) atoms. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to three equivalent La(1) and one B(1) atom. In the second O site, O(2) is bonded in a 1-coordinate geometry to three equivalent La(1) and one B(1) atom. is represented by the CIF card [CIF]
data_LaBO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.179
_cell_length_b   5.089
_cell_length_c   6.314
_cell_angle_alpha   90.000
_cell_angle_beta   107.686
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   127.944
_cell_formula_units_Z   2
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
  La  La0  1  0.621  0.250  0.776  1.0
  La  La1  1  0.379  0.750  0.224  1.0
  B  B2  1  0.997  0.250  0.253  1.0
  B  B3  1  0.003  0.750  0.747  1.0
  O  O4  1  0.841  0.017  0.172  1.0
  O  O5  1  0.159  0.517  0.828  1.0
  O  O6  1  0.673  0.750  0.616  1.0
  O  O7  1  0.327  0.250  0.384  1.0
  O  O8  1  0.159  0.983  0.828  1.0
  O  O9  1  0.841  0.483  0.172  1.0
[/CIF]
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