The structure described by BaBiO2Cl crystallizes in the orthorhombic Cmcm space group. Ba(1) is bonded in a 8-coordinate geometry to four equivalent O(1) and four equivalent Cl(1) atoms. Bi(1) is bonded in a 4-coordinate geometry to four equivalent O(1) atoms. O(1) is bonded to two equivalent Ba(1) and two equivalent Bi(1) atoms to form OBa2Bi2 tetrahedra that share corners with four equivalent O(1)Ba2Bi2 tetrahedra, corners with eight equivalent Cl(1)Ba4 tetrahedra, and edges with four equivalent O(1)Ba2Bi2 tetrahedra. Cl(1) is bonded to four equivalent Ba(1) atoms to form ClBa4 tetrahedra that share corners with four equivalent Cl(1)Ba4 tetrahedra, corners with sixteen equivalent O(1)Ba2Bi2 tetrahedra, and edges with four equivalent Cl(1)Ba4 tetrahedra. is represented by the CIF card [CIF]
data_BaBiClO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.336
_cell_length_b   7.336
_cell_length_c   5.784
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   131.775
_symmetry_Int_Tables_number   1
_cell_volume   232.141
_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
  Ba  Ba0  1  0.617  0.383  0.750  1.0
  Ba  Ba1  1  0.383  0.617  0.250  1.0
  Bi  Bi2  1  0.926  0.074  0.750  1.0
  Bi  Bi3  1  0.074  0.926  0.250  1.0
  Cl  Cl4  1  0.254  0.746  0.750  1.0
  Cl  Cl5  1  0.746  0.254  0.250  1.0
  O  O6  1  0.772  0.772  0.500  1.0
  O  O7  1  0.228  0.228  0.500  1.0
  O  O8  1  0.772  0.772  0.000  1.0
  O  O9  1  0.228  0.228  0.000  1.0
[/CIF]
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The structure described by BaBiO2Cl crystallizes in the orthorhombic Cmcm space group. Ba(1) is bonded in a 8-coordinate geometry to four equivalent O(1) and four equivalent Cl(1) atoms. Bi(1) is bonded in a 4-coordinate geometry to four equivalent O(1) atoms. O(1) is bonded to two equivalent Ba(1) and two equivalent Bi(1) atoms to form OBa2Bi2 tetrahedra that share corners with four equivalent O(1)Ba2Bi2 tetrahedra, corners with eight equivalent Cl(1)Ba4 tetrahedra, and edges with four equivalent O(1)Ba2Bi2 tetrahedra. Cl(1) is bonded to four equivalent Ba(1) atoms to form ClBa4 tetrahedra that share corners with four equivalent Cl(1)Ba4 tetrahedra, corners with sixteen equivalent O(1)Ba2Bi2 tetrahedra, and edges with four equivalent Cl(1)Ba4 tetrahedra. is represented by the CIF card [CIF]
data_BaBiClO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.336
_cell_length_b   7.336
_cell_length_c   5.784
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   131.775
_symmetry_Int_Tables_number   1
_cell_volume   232.141
_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
  Ba  Ba0  1  0.617  0.383  0.750  1.0
  Ba  Ba1  1  0.383  0.617  0.250  1.0
  Bi  Bi2  1  0.926  0.074  0.750  1.0
  Bi  Bi3  1  0.074  0.926  0.250  1.0
  Cl  Cl4  1  0.254  0.746  0.750  1.0
  Cl  Cl5  1  0.746  0.254  0.250  1.0
  O  O6  1  0.772  0.772  0.500  1.0
  O  O7  1  0.228  0.228  0.500  1.0
  O  O8  1  0.772  0.772  0.000  1.0
  O  O9  1  0.228  0.228  0.000  1.0
[/CIF]
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