The material structure described by CCl3F is Silicon tetrafluoride-derived structured and crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of eight trichlorofluoromethane molecules. C(1) is bonded in a tetrahedral geometry to one Cl(1), one Cl(2), one Cl(3), and one F(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one C(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one C(1) atom. In the third Cl site, Cl(3) is bonded in a single-bond geometry to one C(1) atom. F(1) is bonded in a single-bond geometry to one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_CCl3F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.970
_cell_length_b   9.723
_cell_length_c   15.918
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   923.976
_cell_formula_units_Z   8
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  0.099  0.412  0.361  1.0
  C  C1  1  0.599  0.088  0.639  1.0
  C  C2  1  0.901  0.912  0.139  1.0
  C  C3  1  0.401  0.588  0.861  1.0
  C  C4  1  0.901  0.588  0.639  1.0
  C  C5  1  0.401  0.912  0.361  1.0
  C  C6  1  0.099  0.088  0.861  1.0
  C  C7  1  0.599  0.412  0.139  1.0
  Cl  Cl8  1  0.939  0.321  0.436  1.0
  Cl  Cl9  1  0.439  0.179  0.564  1.0
  Cl  Cl10  1  0.061  0.821  0.064  1.0
  Cl  Cl11  1  0.561  0.679  0.936  1.0
  Cl  Cl12  1  0.061  0.679  0.564  1.0
  Cl  Cl13  1  0.561  0.821  0.436  1.0
  Cl  Cl14  1  0.939  0.179  0.936  1.0
  Cl  Cl15  1  0.439  0.321  0.064  1.0
  Cl  Cl16  1  0.372  0.441  0.399  1.0
  Cl  Cl17  1  0.872  0.059  0.601  1.0
  Cl  Cl18  1  0.628  0.941  0.101  1.0
  Cl  Cl19  1  0.128  0.559  0.899  1.0
  Cl  Cl20  1  0.628  0.559  0.601  1.0
  Cl  Cl21  1  0.128  0.941  0.399  1.0
  Cl  Cl22  1  0.372  0.059  0.899  1.0
  Cl  Cl23  1  0.872  0.441  0.101  1.0
  Cl  Cl24  1  0.967  0.567  0.334  1.0
  Cl  Cl25  1  0.467  0.933  0.666  1.0
  Cl  Cl26  1  0.033  0.067  0.166  1.0
  Cl  Cl27  1  0.533  0.433  0.834  1.0
  Cl  Cl28  1  0.033  0.433  0.666  1.0
  Cl  Cl29  1  0.533  0.067  0.334  1.0
  Cl  Cl30  1  0.967  0.933  0.834  1.0
  Cl  Cl31  1  0.467  0.567  0.166  1.0
  F  F32  1  0.114  0.332  0.291  1.0
  F  F33  1  0.614  0.168  0.709  1.0
  F  F34  1  0.886  0.832  0.209  1.0
  F  F35  1  0.386  0.668  0.791  1.0
  F  F36  1  0.886  0.668  0.709  1.0
  F  F37  1  0.386  0.832  0.291  1.0
  F  F38  1  0.114  0.168  0.791  1.0
  F  F39  1  0.614  0.332  0.209  1.0
[/CIF]
.
The material structure described by CCl3F is Silicon tetrafluoride-derived structured and crystallizes in the orthorhombic Pbca space group. The structure is zero-dimensional and consists of eight trichlorofluoromethane molecules. C(1) is bonded in a tetrahedral geometry to one Cl(1), one Cl(2), one Cl(3), and one F(1) atom. There are three inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one C(1) atom. In the second Cl site, Cl(2) is bonded in a single-bond geometry to one C(1) atom. In the third Cl site, Cl(3) is bonded in a single-bond geometry to one C(1) atom. F(1) is bonded in a single-bond geometry to one C(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_CCl3F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.970
_cell_length_b   9.723
_cell_length_c   15.918
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   923.976
_cell_formula_units_Z   8
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  0.099  0.412  0.361  1.0
  C  C1  1  0.599  0.088  0.639  1.0
  C  C2  1  0.901  0.912  0.139  1.0
  C  C3  1  0.401  0.588  0.861  1.0
  C  C4  1  0.901  0.588  0.639  1.0
  C  C5  1  0.401  0.912  0.361  1.0
  C  C6  1  0.099  0.088  0.861  1.0
  C  C7  1  0.599  0.412  0.139  1.0
  Cl  Cl8  1  0.939  0.321  0.436  1.0
  Cl  Cl9  1  0.439  0.179  0.564  1.0
  Cl  Cl10  1  0.061  0.821  0.064  1.0
  Cl  Cl11  1  0.561  0.679  0.936  1.0
  Cl  Cl12  1  0.061  0.679  0.564  1.0
  Cl  Cl13  1  0.561  0.821  0.436  1.0
  Cl  Cl14  1  0.939  0.179  0.936  1.0
  Cl  Cl15  1  0.439  0.321  0.064  1.0
  Cl  Cl16  1  0.372  0.441  0.399  1.0
  Cl  Cl17  1  0.872  0.059  0.601  1.0
  Cl  Cl18  1  0.628  0.941  0.101  1.0
  Cl  Cl19  1  0.128  0.559  0.899  1.0
  Cl  Cl20  1  0.628  0.559  0.601  1.0
  Cl  Cl21  1  0.128  0.941  0.399  1.0
  Cl  Cl22  1  0.372  0.059  0.899  1.0
  Cl  Cl23  1  0.872  0.441  0.101  1.0
  Cl  Cl24  1  0.967  0.567  0.334  1.0
  Cl  Cl25  1  0.467  0.933  0.666  1.0
  Cl  Cl26  1  0.033  0.067  0.166  1.0
  Cl  Cl27  1  0.533  0.433  0.834  1.0
  Cl  Cl28  1  0.033  0.433  0.666  1.0
  Cl  Cl29  1  0.533  0.067  0.334  1.0
  Cl  Cl30  1  0.967  0.933  0.834  1.0
  Cl  Cl31  1  0.467  0.567  0.166  1.0
  F  F32  1  0.114  0.332  0.291  1.0
  F  F33  1  0.614  0.168  0.709  1.0
  F  F34  1  0.886  0.832  0.209  1.0
  F  F35  1  0.386  0.668  0.791  1.0
  F  F36  1  0.886  0.668  0.709  1.0
  F  F37  1  0.386  0.832  0.291  1.0
  F  F38  1  0.114  0.168  0.791  1.0
  F  F39  1  0.614  0.332  0.209  1.0
[/CIF]
.