The crystal structure described by TbWO4Cl crystallizes in the monoclinic C2/m space group. Tb(1) is bonded in a 8-coordinate geometry to one O(1), one O(2), four equivalent O(3), and two equivalent Cl(1) atoms. W(1) is bonded in a tetrahedral geometry to one O(1), one O(2), and two equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a linear geometry to one Tb(1) and one W(1) atom. In the second O site, O(2) is bonded in a linear geometry to one Tb(1) and one W(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to two equivalent Tb(1) and one W(1) atom. Cl(1) is bonded in a water-like geometry to two equivalent Tb(1) atoms. is represented by the CIF card [CIF]
data_TbWClO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.386
_cell_length_b   6.386
_cell_length_c   7.003
_cell_angle_alpha   75.729
_cell_angle_beta   75.729
_cell_angle_gamma   70.739
_symmetry_Int_Tables_number   1
_cell_volume   256.952
_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
  Tb  Tb0  1  0.778  0.778  0.118  1.0
  Tb  Tb1  1  0.222  0.222  0.882  1.0
  W  W2  1  0.637  0.637  0.734  1.0
  W  W3  1  0.363  0.363  0.266  1.0
  Cl  Cl4  1  0.988  0.988  0.771  1.0
  Cl  Cl5  1  0.012  0.012  0.229  1.0
  O  O6  1  0.704  0.704  0.466  1.0
  O  O7  1  0.296  0.296  0.534  1.0
  O  O8  1  0.545  0.545  0.196  1.0
  O  O9  1  0.455  0.455  0.804  1.0
  O  O10  1  0.109  0.492  0.154  1.0
  O  O11  1  0.492  0.109  0.154  1.0
  O  O12  1  0.891  0.508  0.846  1.0
  O  O13  1  0.508  0.891  0.846  1.0
[/CIF]
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The crystal structure described by TbWO4Cl crystallizes in the monoclinic C2/m space group. Tb(1) is bonded in a 8-coordinate geometry to one O(1), one O(2), four equivalent O(3), and two equivalent Cl(1) atoms. W(1) is bonded in a tetrahedral geometry to one O(1), one O(2), and two equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded in a linear geometry to one Tb(1) and one W(1) atom. In the second O site, O(2) is bonded in a linear geometry to one Tb(1) and one W(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to two equivalent Tb(1) and one W(1) atom. Cl(1) is bonded in a water-like geometry to two equivalent Tb(1) atoms. is represented by the CIF card [CIF]
data_TbWClO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.386
_cell_length_b   6.386
_cell_length_c   7.003
_cell_angle_alpha   75.729
_cell_angle_beta   75.729
_cell_angle_gamma   70.739
_symmetry_Int_Tables_number   1
_cell_volume   256.952
_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
  Tb  Tb0  1  0.778  0.778  0.118  1.0
  Tb  Tb1  1  0.222  0.222  0.882  1.0
  W  W2  1  0.637  0.637  0.734  1.0
  W  W3  1  0.363  0.363  0.266  1.0
  Cl  Cl4  1  0.988  0.988  0.771  1.0
  Cl  Cl5  1  0.012  0.012  0.229  1.0
  O  O6  1  0.704  0.704  0.466  1.0
  O  O7  1  0.296  0.296  0.534  1.0
  O  O8  1  0.545  0.545  0.196  1.0
  O  O9  1  0.455  0.455  0.804  1.0
  O  O10  1  0.109  0.492  0.154  1.0
  O  O11  1  0.492  0.109  0.154  1.0
  O  O12  1  0.891  0.508  0.846  1.0
  O  O13  1  0.508  0.891  0.846  1.0
[/CIF]
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