The compound described by C crystallizes in the cubic Pm-3m space group. There are two inequivalent C sites. In the first C site, C(1) is bonded to two equivalent C(1) and two equivalent C(2) atoms to form a mixture of corner and edge-sharing CC4 tetrahedra. In the second C site, C(2) is bonded in a trigonal planar geometry to three equivalent C(1) atoms. is represented by the CIF file [CIF]
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.184
_cell_length_b   5.184
_cell_length_c   5.184
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   139.283
_cell_formula_units_Z   20
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
  C  C0  1  0.500  0.151  0.849  1.0
  C  C1  1  0.151  0.151  0.500  1.0
  C  C2  1  0.151  0.500  0.849  1.0
  C  C3  1  0.500  0.849  0.151  1.0
  C  C4  1  0.151  0.849  0.500  1.0
  C  C5  1  0.151  0.500  0.151  1.0
  C  C6  1  0.500  0.151  0.151  1.0
  C  C7  1  0.849  0.151  0.500  1.0
  C  C8  1  0.849  0.500  0.151  1.0
  C  C9  1  0.500  0.849  0.849  1.0
  C  C10  1  0.849  0.849  0.500  1.0
  C  C11  1  0.849  0.500  0.849  1.0
  C  C12  1  0.262  0.262  0.738  1.0
  C  C13  1  0.262  0.738  0.262  1.0
  C  C14  1  0.738  0.262  0.262  1.0
  C  C15  1  0.738  0.738  0.738  1.0
  C  C16  1  0.738  0.738  0.262  1.0
  C  C17  1  0.738  0.262  0.738  1.0
  C  C18  1  0.262  0.738  0.738  1.0
  C  C19  1  0.262  0.262  0.262  1.0
[/CIF]
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The compound described by C crystallizes in the cubic Pm-3m space group. There are two inequivalent C sites. In the first C site, C(1) is bonded to two equivalent C(1) and two equivalent C(2) atoms to form a mixture of corner and edge-sharing CC4 tetrahedra. In the second C site, C(2) is bonded in a trigonal planar geometry to three equivalent C(1) atoms. is represented by the CIF file [CIF]
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.184
_cell_length_b   5.184
_cell_length_c   5.184
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   139.283
_cell_formula_units_Z   20
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
  C  C0  1  0.500  0.151  0.849  1.0
  C  C1  1  0.151  0.151  0.500  1.0
  C  C2  1  0.151  0.500  0.849  1.0
  C  C3  1  0.500  0.849  0.151  1.0
  C  C4  1  0.151  0.849  0.500  1.0
  C  C5  1  0.151  0.500  0.151  1.0
  C  C6  1  0.500  0.151  0.151  1.0
  C  C7  1  0.849  0.151  0.500  1.0
  C  C8  1  0.849  0.500  0.151  1.0
  C  C9  1  0.500  0.849  0.849  1.0
  C  C10  1  0.849  0.849  0.500  1.0
  C  C11  1  0.849  0.500  0.849  1.0
  C  C12  1  0.262  0.262  0.738  1.0
  C  C13  1  0.262  0.738  0.262  1.0
  C  C14  1  0.738  0.262  0.262  1.0
  C  C15  1  0.738  0.738  0.738  1.0
  C  C16  1  0.738  0.738  0.262  1.0
  C  C17  1  0.738  0.262  0.738  1.0
  C  C18  1  0.262  0.738  0.738  1.0
  C  C19  1  0.262  0.262  0.262  1.0
[/CIF]
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