#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/46/7204638.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_7204638
loop_
_publ_author_name
'Zou, Lei'
'Xu, Wei'
'Jia, Chunyang'
'Zhang, Deqing'
'Wang, Quanrui'
'Zhu, Daoben'
_publ_section_title
;
 Cation radical salts of ethylenedisulfanyl-bridged dimeric
 ethylenedithiotetrathiafulvalene with
 2,3,5,6-tetrafluoro-7,7,8,8-tetracyanoquinodimethane (TCNQF4), PF6?,
 AsF6?and BF4?: synthesis, structure and conducting properties
;
_journal_issue                   7
_journal_name_full               'Journal of Materials Chemistry'
_journal_page_first              1646
_journal_paper_doi               10.1039/b303102k
_journal_volume                  13
_journal_year                    2003
_chemical_formula_sum            'C18.5 H15 As Cl F6 S14'
_chemical_formula_weight         910.53
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                97.26(3)
_cell_angle_beta                 99.53(3)
_cell_angle_gamma                100.75(3)
_cell_formula_units_Z            2
_cell_length_a                   7.8300(16)
_cell_length_b                   13.263(3)
_cell_length_c                   15.691(3)
_cell_measurement_temperature    293(2)
_cell_volume                     1557.9(6)
_computing_cell_refinement       'RAPID AUTO (Riogaku, 2001)'
_computing_data_collection       'RAPID AUTO (Riogaku, 2001)'
_computing_data_reduction        'RAPID AUTO (Riogaku, 2001)'
_computing_molecular_graphics    'SHELXTL (Siemens, 1994)'
_computing_publication_material  'SHELXTL (Siemens, 1994)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.959
_diffrn_measured_fraction_theta_max 0.959
_diffrn_measurement_device_type  'Rigaku R-AXIS RAPID IP'
_diffrn_measurement_method       Oscillation
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'rotating anode'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0391
_diffrn_reflns_av_sigmaI/netI    0.0636
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            10510
_diffrn_reflns_theta_full        27.34
_diffrn_reflns_theta_max         27.34
_diffrn_reflns_theta_min         1.90
_exptl_absorpt_coefficient_mu    2.167
_exptl_absorpt_correction_T_max  1.2899
_exptl_absorpt_correction_T_min  0.7051
_exptl_absorpt_correction_type   T.Higashi
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    1.939
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             906
_exptl_crystal_size_max          0.4
_exptl_crystal_size_mid          0.3
_exptl_crystal_size_min          0.04
_refine_diff_density_max         0.580
_refine_diff_density_min         -0.788
_refine_diff_density_rms         0.086
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.938
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     424
_refine_ls_number_reflns         6736
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.938
_refine_ls_R_factor_all          0.0785
_refine_ls_R_factor_gt           0.0453
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0600P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1062
_refine_ls_wR_factor_ref         0.1139
_reflns_number_gt                4155
_reflns_number_total             6736
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b303102k.txt
_cod_data_source_block           1-AsF6
_cod_original_cell_volume        1557.9(5)
_cod_original_sg_symbol_H-M      P-1
_cod_original_formula_sum        'C18.50 H15 As Cl F6 S14'
_cod_database_code               7204638
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Cl1 Cl 0.8241(3) 0.43461(14) 1.00064(13) 0.1228(6) Uani 1 1 d . . .
As1 As 0.29613(6) 0.20423(3) 1.00645(3) 0.05460(15) Uani 1 1 d . . .
S1 S 0.17949(17) 0.37020(10) 0.68979(9) 0.0721(4) Uani 1 1 d . . .
S2 S 0.62015(17) 0.49251(9) 0.78663(7) 0.0632(3) Uani 1 1 d . . .
S3 S 0.31836(13) 0.34689(7) 0.52751(7) 0.0482(3) Uani 1 1 d . . .
S4 S 0.68762(13) 0.44113(8) 0.61008(7) 0.0498(3) Uani 1 1 d . . .
S5 S 0.44179(12) 0.29660(7) 0.34159(7) 0.0439(2) Uani 1 1 d . . .
S6 S 0.81066(13) 0.38614(8) 0.42805(7) 0.0471(2) Uani 1 1 d . . .
S7 S 0.96364(14) 0.34068(8) 0.27341(8) 0.0578(3) Uani 1 1 d . . .
S8 S 1.00615(14) 0.08820(8) 0.21248(7) 0.0532(3) Uani 1 1 d . . .
S9 S 0.76452(13) -0.10531(7) 0.38106(7) 0.0482(3) Uani 1 1 d . . .
S10 S 0.90214(13) 0.11803(7) 0.38907(7) 0.0465(2) Uani 1 1 d . . .
S11 S 0.66522(13) -0.05417(7) 0.57466(7) 0.0445(2) Uani 1 1 d . . .
S12 S 0.80530(14) 0.16774(7) 0.57713(7) 0.0488(3) Uani 1 1 d . . .
S13 S 0.57636(14) -0.02563(8) 0.74988(8) 0.0553(3) Uani 1 1 d . . .
S14 S 0.75495(19) 0.23625(8) 0.75539(8) 0.0703(4) Uani 1 1 d . . .
C1 C 0.4393(9) 0.4409(7) 0.8354(4) 0.131(3) Uani 1 1 d . . .
H1A H 0.4572 0.3735 0.8481 0.157 Uiso 1 1 calc R . .
H1B H 0.4551 0.4850 0.8916 0.157 Uiso 1 1 calc R . .
C2 C 0.2687(9) 0.4271(7) 0.7988(4) 0.129(3) Uani 1 1 d . . .
H2A H 0.2395 0.4952 0.8061 0.155 Uiso 1 1 calc R . .
H2B H 0.2027 0.3864 0.8345 0.155 Uiso 1 1 calc R . .
C3 C 0.5333(5) 0.4362(3) 0.6779(3) 0.0466(9) Uani 1 1 d . . .
C4 C 0.3640(5) 0.3911(3) 0.6402(3) 0.0472(10) Uani 1 1 d . . .
C5 C 0.5371(5) 0.3797(3) 0.5153(2) 0.0402(9) Uani 1 1 d . . .
C6 C 0.5883(5) 0.3575(3) 0.4374(2) 0.0389(8) Uani 1 1 d . . .
C7 C 0.7705(5) 0.3345(3) 0.3162(3) 0.0420(9) Uani 1 1 d . . .
C8 C 0.6024(5) 0.2951(3) 0.2778(3) 0.0438(9) Uani 1 1 d . . .
H8A H 0.5719 0.2676 0.2185 0.053 Uiso 1 1 calc R . .
C9 C 0.8863(5) 0.2623(3) 0.1651(3) 0.0533(11) Uani 1 1 d . . .
H9A H 0.7862 0.2864 0.1357 0.064 Uiso 1 1 calc R . .
H9B H 0.9799 0.2751 0.1318 0.064 Uiso 1 1 calc R . .
C10 C 0.8316(5) 0.1470(3) 0.1616(3) 0.0500(10) Uani 1 1 d . . .
H10A H 0.7927 0.1142 0.1008 0.060 Uiso 1 1 calc R . .
H10B H 0.7314 0.1330 0.1905 0.060 Uiso 1 1 calc R . .
C11 C 0.8464(5) -0.0668(3) 0.2927(3) 0.0473(10) Uani 1 1 d . . .
H11A H 0.8459 -0.1155 0.2445 0.057 Uiso 1 1 calc R . .
C12 C 0.9112(5) 0.0345(3) 0.2941(3) 0.0424(9) Uani 1 1 d . . .
C13 C 0.8008(5) 0.0203(3) 0.4392(2) 0.0396(9) Uani 1 1 d . . .
C14 C 0.7603(5) 0.0413(3) 0.5202(3) 0.0412(9) Uani 1 1 d . . .
C15 C 0.6627(5) 0.0319(3) 0.6686(2) 0.0413(9) Uani 1 1 d . . .
C16 C 0.7328(5) 0.1340(3) 0.6699(3) 0.0442(9) Uani 1 1 d . . .
C17 C 0.6552(10) 0.0745(4) 0.8440(3) 0.109(2) Uani 1 1 d . . .
H17A H 0.5549 0.0779 0.8724 0.131 Uiso 1 1 calc R . .
H17B H 0.7396 0.0488 0.8837 0.131 Uiso 1 1 calc R . .
C18 C 0.7274(13) 0.1682(5) 0.8416(4) 0.181(5) Uani 1 1 d . . .
H18A H 0.8466 0.1772 0.8751 0.218 Uiso 1 1 calc R . .
H18B H 0.6676 0.2094 0.8776 0.218 Uiso 1 1 calc R . .
C19 C 1.0373(19) 0.501(2) 1.0438(9) 0.204(10) Uani 0.50 1 d P . .
F1 F 0.228(2) 0.2229(14) 0.9018(9) 0.159(7) Uani 0.50 1 d P . .
F2 F 0.328(3) 0.1972(17) 1.1113(8) 0.197(12) Uani 0.50 1 d P . .
F3 F 0.0884(11) 0.1642(16) 1.0066(8) 0.137(5) Uani 0.50 1 d P . .
F4 F 0.3048(17) 0.0845(7) 0.9644(11) 0.165(5) Uani 0.50 1 d P . .
F5 F 0.5063(12) 0.2360(15) 1.0051(13) 0.185(7) Uani 0.50 1 d P . .
F6 F 0.307(3) 0.3269(9) 1.0317(12) 0.179(7) Uani 0.50 1 d P . .
F11 F 0.448(3) 0.1552(14) 1.0534(15) 0.223(7) Uani 0.50 1 d P . .
F12 F 0.130(3) 0.258(2) 0.9771(13) 0.254(9) Uani 0.50 1 d P . .
F13 F 0.447(4) 0.308(2) 1.0159(14) 0.280(16) Uani 0.50 1 d P . .
F14 F 0.155(3) 0.0933(13) 0.9994(10) 0.212(9) Uani 0.50 1 d P . .
F15 F 0.306(2) 0.1857(15) 0.9049(6) 0.158(8) Uani 0.50 1 d P . .
F16 F 0.278(2) 0.251(2) 1.1066(12) 0.222(12) Uani 0.50 1 d P . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
As As 0.0499 2.0058 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C19 Cl1 C19 50.1(9) 2_767 . ?
F11 As1 F15 105.2(11) . . ?
F11 As1 F6 118.8(8) . . ?
F15 As1 F6 105.5(10) . . ?
F11 As1 F13 86.3(11) . . ?
F15 As1 F13 86.8(11) . . ?
F6 As1 F13 44.8(11) . . ?
F11 As1 F3 123.7(13) . . ?
F15 As1 F3 103.5(7) . . ?
F6 As1 F3 98.1(10) . . ?
F13 As1 F3 142.6(17) . . ?
F11 As1 F12 168.7(13) . . ?
F15 As1 F12 86.0(7) . . ?
F6 As1 F12 57.6(10) . . ?
F13 As1 F12 95.6(17) . . ?
F3 As1 F12 50.6(8) . . ?
F11 As1 F5 53.4(8) . . ?
F15 As1 F5 75.5(9) . . ?
F6 As1 F5 85.9(8) . . ?
F13 As1 F5 41.4(11) . . ?
F3 As1 F5 176.0(10) . . ?
F12 As1 F5 132.9(14) . . ?
F11 As1 F2 57.1(7) . . ?
F15 As1 F2 161.8(13) . . ?
F6 As1 F2 88.4(9) . . ?
F13 As1 F2 95.3(8) . . ?
F3 As1 F2 85.6(9) . . ?
F12 As1 F2 111.7(14) . . ?
F5 As1 F2 94.2(9) . . ?
F11 As1 F14 89.2(13) . . ?
F15 As1 F14 93.7(9) . . ?
F6 As1 F14 139.1(14) . . ?
F13 As1 F14 175.4(17) . . ?
F3 As1 F14 41.6(7) . . ?
F12 As1 F14 89.0(9) . . ?
F5 As1 F14 134.4(13) . . ?
F2 As1 F14 82.8(7) . . ?
F11 As1 F16 85.4(9) . . ?
F15 As1 F16 166.1(14) . . ?
F6 As1 F16 60.9(10) . . ?
F13 As1 F16 84.9(11) . . ?
F3 As1 F16 76.9(7) . . ?
F12 As1 F16 83.7(12) . . ?
F5 As1 F16 105.0(8) . . ?
F2 As1 F16 31.1(10) . . ?
F14 As1 F16 95.4(12) . . ?
F11 As1 F4 62.7(7) . . ?
F15 As1 F4 64.1(7) . . ?
F6 As1 F4 168.6(11) . . ?
F13 As1 F4 126.8(16) . . ?
F3 As1 F4 89.2(6) . . ?
F12 As1 F4 123.3(9) . . ?
F5 As1 F4 86.8(8) . . ?
F2 As1 F4 100.9(12) . . ?
F14 As1 F4 49.9(8) . . ?
F16 As1 F4 129.7(14) . . ?
F11 As1 F1 134.7(13) . . ?
F15 As1 F1 29.7(7) . . ?
F6 As1 F1 84.8(9) . . ?
F13 As1 F1 86.5(9) . . ?
F3 As1 F1 85.9(7) . . ?
F12 As1 F1 56.6(7) . . ?
F5 As1 F1 94.8(10) . . ?
F2 As1 F1 168.3(13) . . ?
F14 As1 F1 96.2(7) . . ?
F16 As1 F1 138.2(14) . . ?
F4 As1 F1 87.1(7) . . ?
C4 S1 C2 102.4(3) . . ?
C3 S2 C1 99.3(3) . . ?
C5 S3 C4 94.93(19) . . ?
C3 S4 C5 95.63(19) . . ?
C8 S5 C6 95.37(18) . . ?
C6 S6 C7 94.96(18) . . ?
C7 S7 C9 103.28(19) . . ?
C12 S8 C10 101.67(18) . . ?
C11 S9 C13 94.94(18) . . ?
C13 S10 C12 95.21(18) . . ?
C14 S11 C15 95.27(18) . . ?
C16 S12 C14 95.71(18) . . ?
C15 S13 C17 102.5(2) . . ?
C18 S14 C16 100.8(3) . . ?
C2 C1 S2 124.9(5) . . ?
C1 C2 S1 123.9(5) . . ?
C4 C3 S4 116.7(3) . . ?
C4 C3 S2 128.8(3) . . ?
S4 C3 S2 114.6(2) . . ?
C3 C4 S1 128.3(3) . . ?
C3 C4 S3 117.4(3) . . ?
S1 C4 S3 114.3(2) . . ?
C6 C5 S3 122.6(3) . . ?
C6 C5 S4 122.2(3) . . ?
S3 C5 S4 115.3(2) . . ?
C5 C6 S5 123.4(3) . . ?
C5 C6 S6 121.6(3) . . ?
S5 C6 S6 114.9(2) . . ?
C8 C7 S7 130.1(3) . . ?
C8 C7 S6 116.7(3) . . ?
S7 C7 S6 113.2(2) . . ?
C7 C8 S5 118.1(3) . . ?
C10 C9 S7 116.6(3) . . ?
C9 C10 S8 114.0(3) . . ?
C12 C11 S9 119.1(3) . . ?
C11 C12 S8 125.8(3) . . ?
C11 C12 S10 115.6(3) . . ?
S8 C12 S10 118.5(2) . . ?
C14 C13 S10 121.6(3) . . ?
C14 C13 S9 123.2(3) . . ?
S10 C13 S9 115.1(2) . . ?
C13 C14 S11 123.4(3) . . ?
C13 C14 S12 121.5(3) . . ?
S11 C14 S12 115.1(2) . . ?
C16 C15 S13 128.2(3) . . ?
C16 C15 S11 116.6(3) . . ?
S13 C15 S11 115.1(2) . . ?
C15 C16 S12 117.2(3) . . ?
C15 C16 S14 126.8(3) . . ?
S12 C16 S14 115.9(2) . . ?
C18 C17 S13 124.6(5) . . ?
C17 C18 S14 132.4(5) . . ?
C19 C19 Cl1 70.6(12) 2_767 2_767 ?
C19 C19 Cl1 59.3(10) 2_767 . ?
Cl1 C19 Cl1 129.9(9) 2_767 . ?
F15 F1 F12 126.7(16) . . ?
F15 F1 As1 68.3(11) . . ?
F12 F1 As1 59.1(6) . . ?
F16 F2 F11 127.9(17) . . ?
F16 F2 As1 75.4(12) . . ?
F11 F2 As1 59.5(6) . . ?
F14 F3 F12 128.6(14) . . ?
F14 F3 As1 70.7(8) . . ?
F12 F3 As1 65.0(7) . . ?
F14 F4 As1 64.6(6) . . ?
F14 F4 F11 94.2(14) . . ?
As1 F4 F11 56.3(4) . . ?
F14 F4 F15 98.0(10) . . ?
As1 F4 F15 56.2(5) . . ?
F11 F4 F15 95.3(10) . . ?
F13 F5 F11 114.7(17) . . ?
F13 F5 As1 68.6(10) . . ?
F11 F5 As1 61.7(6) . . ?
F13 F6 F12 118.4(14) . . ?
F13 F6 As1 67.7(9) . . ?
F12 F6 As1 61.7(7) . . ?
F13 F6 F16 98.8(15) . . ?
F12 F6 F16 85.8(16) . . ?
As1 F6 F16 60.9(7) . . ?
F5 F11 F2 106.8(10) . . ?
F5 F11 As1 65.0(6) . . ?
F2 F11 As1 63.5(5) . . ?
F5 F11 F4 92.1(14) . . ?
F2 F11 F4 104.1(12) . . ?
As1 F11 F4 61.0(5) . . ?
F3 F12 F6 111.8(12) . . ?
F3 F12 F1 99.4(12) . . ?
F6 F12 F1 91.0(16) . . ?
F3 F12 As1 64.4(6) . . ?
F6 F12 As1 60.8(7) . . ?
F1 F12 As1 64.3(6) . . ?
F5 F13 F6 136.9(14) . . ?
F5 F13 As1 70.0(8) . . ?
F6 F13 As1 67.5(8) . . ?
F3 F14 F4 128.4(13) . . ?
F3 F14 As1 67.7(7) . . ?
F4 F14 As1 65.5(7) . . ?
F1 F15 As1 82.0(14) . . ?
F1 F15 F4 124.1(18) . . ?
As1 F15 F4 59.7(5) . . ?
F2 F16 As1 73.5(14) . . ?
F2 F16 F6 123.3(19) . . ?
As1 F16 F6 58.1(7) . . ?
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Cl1 C19 1.565(16) 2_767 ?
Cl1 C19 1.717(15) . ?
As1 F11 1.579(8) . ?
As1 F15 1.598(9) . ?
As1 F6 1.609(9) . ?
As1 F13 1.611(11) . ?
As1 F3 1.615(7) . ?
As1 F12 1.622(10) . ?
As1 F5 1.625(8) . ?
As1 F2 1.640(9) . ?
As1 F14 1.647(10) . ?
As1 F16 1.656(12) . ?
As1 F4 1.659(7) . ?
As1 F1 1.703(11) . ?
S1 C4 1.746(4) . ?
S1 C2 1.751(6) . ?
S2 C3 1.742(4) . ?
S2 C1 1.786(6) . ?
S3 C5 1.735(4) . ?
S3 C4 1.746(4) . ?
S4 C3 1.735(4) . ?
S4 C5 1.738(4) . ?
S5 C8 1.733(4) . ?
S5 C6 1.734(4) . ?
S6 C6 1.747(4) . ?
S6 C7 1.756(4) . ?
S7 C7 1.746(4) . ?
S7 C9 1.821(4) . ?
S8 C12 1.747(4) . ?
S8 C10 1.818(4) . ?
S9 C11 1.717(4) . ?
S9 C13 1.744(4) . ?
S10 C13 1.735(4) . ?
S10 C12 1.760(4) . ?
S11 C14 1.738(4) . ?
S11 C15 1.752(4) . ?
S12 C16 1.728(4) . ?
S12 C14 1.741(4) . ?
S13 C15 1.733(4) . ?
S13 C17 1.796(5) . ?
S14 C18 1.739(6) . ?
S14 C16 1.744(4) . ?
C1 C2 1.333(8) . ?
C3 C4 1.349(5) . ?
C5 C6 1.362(5) . ?
C7 C8 1.330(5) . ?
C9 C10 1.501(5) . ?
C11 C12 1.340(5) . ?
C13 C14 1.367(5) . ?
C15 C16 1.359(5) . ?
C17 C18 1.274(7) . ?
C19 C19 1.40(3) 2_767 ?
C19 Cl1 1.565(15) 2_767 ?
F1 F15 0.85(2) . ?
F1 F12 1.58(2) . ?
F2 F16 0.88(3) . ?
F2 F11 1.54(2) . ?
F3 F14 1.16(2) . ?
F3 F12 1.383(19) . ?
F4 F14 1.39(2) . ?
F4 F11 1.685(18) . ?
F4 F15 1.729(18) . ?
F5 F13 1.14(3) . ?
F5 F11 1.44(2) . ?
F6 F13 1.23(3) . ?
F6 F12 1.56(3) . ?
F6 F16 1.66(3) . ?
