The material structure described by LiCo(CO)4 is high (beta) Cristobalite-derived structured and crystallizes in the cubic P-43m space group. Li(1) is bonded in a tetrahedral geometry to four equivalent O(1) atoms. Co(1) is bonded in a tetrahedral geometry to four equivalent C(1) atoms. C(1) is bonded in a linear geometry to one Co(1) and one O(1) atom. O(1) is bonded in a linear geometry to one Li(1) and one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiCo(CO)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.627
_cell_length_b   5.627
_cell_length_c   5.627
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   178.185
_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
  Li  Li0  1  0.000  0.000  0.000  1.0
  Co  Co1  1  0.500  0.500  0.500  1.0
  C  C2  1  0.322  0.678  0.678  1.0
  C  C3  1  0.678  0.678  0.322  1.0
  C  C4  1  0.322  0.322  0.322  1.0
  C  C5  1  0.678  0.322  0.678  1.0
  O  O6  1  0.201  0.799  0.799  1.0
  O  O7  1  0.201  0.201  0.201  1.0
  O  O8  1  0.799  0.799  0.201  1.0
  O  O9  1  0.799  0.201  0.799  1.0
[/CIF]
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The material structure described by LiCo(CO)4 is high (beta) Cristobalite-derived structured and crystallizes in the cubic P-43m space group. Li(1) is bonded in a tetrahedral geometry to four equivalent O(1) atoms. Co(1) is bonded in a tetrahedral geometry to four equivalent C(1) atoms. C(1) is bonded in a linear geometry to one Co(1) and one O(1) atom. O(1) is bonded in a linear geometry to one Li(1) and one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiCo(CO)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.627
_cell_length_b   5.627
_cell_length_c   5.627
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   178.185
_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
  Li  Li0  1  0.000  0.000  0.000  1.0
  Co  Co1  1  0.500  0.500  0.500  1.0
  C  C2  1  0.322  0.678  0.678  1.0
  C  C3  1  0.678  0.678  0.322  1.0
  C  C4  1  0.322  0.322  0.322  1.0
  C  C5  1  0.678  0.322  0.678  1.0
  O  O6  1  0.201  0.799  0.799  1.0
  O  O7  1  0.201  0.201  0.201  1.0
  O  O8  1  0.799  0.799  0.201  1.0
  O  O9  1  0.799  0.201  0.799  1.0
[/CIF]
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