The material described by Y(CO2)3 crystallizes in the trigonal R3m space group. Y(1) is bonded in a 9-coordinate geometry to three equivalent O(1) and six equivalent O(2) atoms. C(1) is bonded in a bent 120 degrees geometry to one O(1) and one O(2) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Y(1) and one C(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent Y(1) and one C(1) atom. is represented by the CIF card [CIF]
data_Y(CO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.216
_cell_length_b   6.216
_cell_length_c   6.216
_cell_angle_alpha   115.536
_cell_angle_beta   115.536
_cell_angle_gamma   115.536
_symmetry_Int_Tables_number   1
_cell_volume   127.604
_cell_formula_units_Z   1
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
  Y  Y0  1  0.000  0.000  0.000  1.0
  C  C1  1  0.618  0.161  0.618  1.0
  C  C2  1  0.618  0.618  0.161  1.0
  C  C3  1  0.161  0.618  0.618  1.0
  O  O4  1  0.877  0.269  0.877  1.0
  O  O5  1  0.877  0.877  0.269  1.0
  O  O6  1  0.269  0.877  0.877  1.0
  O  O7  1  0.584  0.333  0.584  1.0
  O  O8  1  0.584  0.584  0.333  1.0
  O  O9  1  0.333  0.584  0.584  1.0
[/CIF]
.
The material described by Y(CO2)3 crystallizes in the trigonal R3m space group. Y(1) is bonded in a 9-coordinate geometry to three equivalent O(1) and six equivalent O(2) atoms. C(1) is bonded in a bent 120 degrees geometry to one O(1) and one O(2) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Y(1) and one C(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent Y(1) and one C(1) atom. is represented by the CIF card [CIF]
data_Y(CO2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.216
_cell_length_b   6.216
_cell_length_c   6.216
_cell_angle_alpha   115.536
_cell_angle_beta   115.536
_cell_angle_gamma   115.536
_symmetry_Int_Tables_number   1
_cell_volume   127.604
_cell_formula_units_Z   1
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
  Y  Y0  1  0.000  0.000  0.000  1.0
  C  C1  1  0.618  0.161  0.618  1.0
  C  C2  1  0.618  0.618  0.161  1.0
  C  C3  1  0.161  0.618  0.618  1.0
  O  O4  1  0.877  0.269  0.877  1.0
  O  O5  1  0.877  0.877  0.269  1.0
  O  O6  1  0.269  0.877  0.877  1.0
  O  O7  1  0.584  0.333  0.584  1.0
  O  O8  1  0.584  0.584  0.333  1.0
  O  O9  1  0.333  0.584  0.584  1.0
[/CIF]
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