#------------------------------------------------------------------------------
#$Date: 2016-03-25 11:12:59 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179780 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/76/7007637.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_7007637
loop_
_publ_author_name
'Melnick, Jonathan G.'
'Parkin, Gerard'
_publ_section_title
;
 Methyl and arylchalcogenolate complexes of cadmium in a sulfur rich
 coordination environment: syntheses and structural characterization of
 the tris(2-mercapto-1-tert-butylimidazolyl)hydroborato cadmium
 complexes [Tm(Bu(t))]CdMe, and [Tm(Bu(t))]CdEAr (E = O, S, Se, Te) and
 analysis of the bonding in chalcogenolate compounds.
;
_journal_issue                   35
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              4207
_journal_page_last               4210
_journal_paper_doi               10.1039/b607916d
_journal_year                    2006
_chemical_formula_sum            'C37 H50 B Cd N6 S4'
_chemical_formula_weight         830.28
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 104.6080(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   15.0659(9)
_cell_length_b                   10.9688(6)
_cell_length_c                   25.4342(16)
_cell_measurement_reflns_used    4220
_cell_measurement_temperature    243(2)
_cell_measurement_theta_max      27.098
_cell_measurement_theta_min      2.544
_cell_volume                     4067.3(4)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      243(2)
_diffrn_measured_fraction_theta_full 0.937
_diffrn_measured_fraction_theta_max 0.937
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0829
_diffrn_reflns_av_sigmaI/netI    0.1333
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       5
_diffrn_reflns_limit_k_min       -14
_diffrn_reflns_limit_l_max       33
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            27846
_diffrn_reflns_theta_full        28.28
_diffrn_reflns_theta_max         28.28
_diffrn_reflns_theta_min         1.43
_exptl_absorpt_coefficient_mu    0.776
_exptl_absorpt_correction_T_max  0.7466
_exptl_absorpt_correction_T_min  0.7466
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            COLORLESS
_exptl_crystal_density_diffrn    1.356
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       BLOCK
_exptl_crystal_F_000             1724
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.40
_exptl_crystal_size_min          0.40
_refine_diff_density_max         0.415
_refine_diff_density_min         -0.395
_refine_diff_density_rms         0.088
_refine_ls_extinction_coef       0.00002(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.002
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     447
_refine_ls_number_reflns         9449
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.002
_refine_ls_R_factor_all          0.1312
_refine_ls_R_factor_gt           0.0480
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0070P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0538
_refine_ls_wR_factor_ref         0.0631
_reflns_number_gt                4851
_reflns_number_total             9449
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b607916d.txt
_cod_data_source_block           tolcds10
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'MONOCLINIC' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'EMPIRICAL' changed to
'empirical' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      P2(1)/n
_cod_database_code               7007637
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'
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
Cd Cd -0.036854(19) 0.88091(2) -0.846882(12) 0.03502(9) Uani 1 1 d . . .
S1 S -0.07148(7) 0.69987(8) -0.79119(4) 0.0390(3) Uani 1 1 d . . .
S2 S -0.20203(7) 0.95646(8) -0.88264(4) 0.0339(3) Uani 1 1 d . . .
S3 S -0.00995(7) 0.75891(7) -0.92747(4) 0.0350(3) Uani 1 1 d . . .
S4 S 0.06181(7) 1.05849(8) -0.81404(5) 0.0523(3) Uani 1 1 d . . .
B B -0.2212(3) 0.6510(3) -0.91769(19) 0.0321(11) Uani 1 1 d . . .
H1 H -0.2796(16) 0.5919(19) -0.9411(9) 0.009(7) Uiso 1 1 d . . .
N11 N -0.2426(2) 0.6767(2) -0.86185(12) 0.0288(7) Uani 1 1 d . . .
N12 N -0.2478(2) 0.7116(2) -0.77734(12) 0.0313(8) Uani 1 1 d . . .
N21 N -0.22833(18) 0.7661(2) -0.95478(11) 0.0287(7) Uani 1 1 d . . .
N22 N -0.22248(19) 0.9440(2) -0.99334(12) 0.0301(8) Uani 1 1 d . . .
N31 N -0.1295(2) 0.5817(2) -0.91100(11) 0.0301(8) Uani 1 1 d . . .
N32 N 0.0116(2) 0.5147(2) -0.90006(11) 0.0306(8) Uani 1 1 d . . .
C11 C -0.1896(3) 0.6977(3) -0.81109(15) 0.0302(9) Uani 1 1 d . . .
C12 C -0.3330(3) 0.6787(3) -0.85976(16) 0.0369(10) Uani 1 1 d . . .
H12A H -0.3838 0.6664 -0.8894 0.044 Uiso 1 1 calc R . .
C13 C -0.3367(3) 0.7009(3) -0.80907(16) 0.0390(10) Uani 1 1 d . . .
H13A H -0.3904 0.7080 -0.7969 0.047 Uiso 1 1 calc R . .
C14 C -0.2225(3) 0.7401(3) -0.71791(15) 0.0400(10) Uani 1 1 d . . .
C15 C -0.3102(3) 0.7339(4) -0.69730(16) 0.0641(13) Uani 1 1 d . . .
H15A H -0.2953 0.7524 -0.6588 0.096 Uiso 1 1 calc R . .
H15B H -0.3362 0.6526 -0.7033 0.096 Uiso 1 1 calc R . .
H15C H -0.3545 0.7927 -0.7169 0.096 Uiso 1 1 calc R . .
C16 C -0.1554(3) 0.6447(3) -0.68654(14) 0.0517(11) Uani 1 1 d . . .
H16A H -0.0969 0.6529 -0.6956 0.078 Uiso 1 1 calc R . .
H16B H -0.1799 0.5638 -0.6963 0.078 Uiso 1 1 calc R . .
H16C H -0.1469 0.6572 -0.6478 0.078 Uiso 1 1 calc R . .
C17 C -0.1832(3) 0.8688(3) -0.70960(15) 0.0680(14) Uani 1 1 d . . .
H17A H -0.1242 0.8706 -0.7184 0.102 Uiso 1 1 calc R . .
H17B H -0.1755 0.8928 -0.6720 0.102 Uiso 1 1 calc R . .
H17C H -0.2248 0.9249 -0.7331 0.102 Uiso 1 1 calc R . .
C21 C -0.2169(2) 0.8873(3) -0.94476(13) 0.0281(8) Uani 1 1 d . . .
C22 C -0.2409(2) 0.7487(3) -1.00992(15) 0.0361(10) Uani 1 1 d . . .
H22A H -0.2510 0.6731 -1.0278 0.043 Uiso 1 1 calc R . .
C23 C -0.2365(2) 0.8554(3) -1.03364(15) 0.0370(10) Uani 1 1 d . . .
H23A H -0.2419 0.8687 -1.0708 0.044 Uiso 1 1 calc R . .
C24 C -0.2064(3) 1.0784(3) -1.00270(15) 0.0383(10) Uani 1 1 d . . .
C25 C -0.2188(3) 1.0997(3) -1.06374(15) 0.0604(13) Uani 1 1 d . . .
H25A H -0.1716 1.0560 -1.0758 0.091 Uiso 1 1 calc R . .
H25B H -0.2141 1.1862 -1.0705 0.091 Uiso 1 1 calc R . .
H25C H -0.2787 1.0704 -1.0835 0.091 Uiso 1 1 calc R . .
C26 C -0.2762(3) 1.1552(3) -0.98353(15) 0.0514(12) Uani 1 1 d . . .
H26A H -0.2664 1.1464 -0.9445 0.077 Uiso 1 1 calc R . .
H26B H -0.3376 1.1282 -1.0016 0.077 Uiso 1 1 calc R . .
H26C H -0.2690 1.2402 -0.9923 0.077 Uiso 1 1 calc R . .
C27 C -0.1070(2) 1.1101(3) -0.97208(15) 0.0524(11) Uani 1 1 d . . .
H27A H -0.0649 1.0570 -0.9844 0.079 Uiso 1 1 calc R . .
H27B H -0.0995 1.0990 -0.9334 0.079 Uiso 1 1 calc R . .
H27C H -0.0942 1.1943 -0.9793 0.079 Uiso 1 1 calc R . .
C31 C -0.0437(2) 0.6165(3) -0.91193(13) 0.0288(9) Uani 1 1 d . . .
C32 C -0.1281(3) 0.4596(3) -0.89861(15) 0.0410(11) Uani 1 1 d . . .
H32A H -0.1787 0.4129 -0.8953 0.049 Uiso 1 1 calc R . .
C33 C -0.0424(3) 0.4185(3) -0.89206(14) 0.0368(10) Uani 1 1 d . . .
H33A H -0.0225 0.3380 -0.8835 0.044 Uiso 1 1 calc R . .
C34 C 0.1126(3) 0.5070(3) -0.89585(15) 0.0323(10) Uani 1 1 d . . .
C35 C 0.1452(2) 0.3763(3) -0.87966(14) 0.0484(11) Uani 1 1 d . . .
H35A H 0.1328 0.3562 -0.8451 0.073 Uiso 1 1 calc R . .
H35B H 0.2106 0.3704 -0.8765 0.073 Uiso 1 1 calc R . .
H35C H 0.1128 0.3199 -0.9072 0.073 Uiso 1 1 calc R . .
C36 C 0.1633(2) 0.5931(3) -0.85056(14) 0.0477(11) Uani 1 1 d . . .
H36A H 0.1506 0.5695 -0.8164 0.072 Uiso 1 1 calc R . .
H36B H 0.1425 0.6761 -0.8594 0.072 Uiso 1 1 calc R . .
H36C H 0.2288 0.5883 -0.8473 0.072 Uiso 1 1 calc R . .
C37 C 0.1312(2) 0.5375(3) -0.95073(14) 0.0427(11) Uani 1 1 d . . .
H37A H 0.1002 0.4788 -0.9777 0.064 Uiso 1 1 calc R . .
H37B H 0.1966 0.5346 -0.9476 0.064 Uiso 1 1 calc R . .
H37C H 0.1084 0.6187 -0.9618 0.064 Uiso 1 1 calc R . .
C41 C 0.1765(3) 1.0066(3) -0.80235(14) 0.0345(10) Uani 1 1 d . . .
C42 C 0.2052(3) 0.8889(3) -0.78590(14) 0.0417(10) Uani 1 1 d . . .
H42A H 0.1617 0.8320 -0.7805 0.050 Uiso 1 1 calc R . .
C43 C 0.2953(3) 0.8532(3) -0.77728(14) 0.0421(11) Uani 1 1 d . . .
H43A H 0.3119 0.7729 -0.7661 0.051 Uiso 1 1 calc R . .
C44 C 0.3624(3) 0.9339(3) -0.78477(15) 0.0404(10) Uani 1 1 d . . .
C45 C 0.3342(3) 1.0506(3) -0.80096(14) 0.0404(10) Uani 1 1 d . . .
H45A H 0.3778 1.1075 -0.8062 0.049 Uiso 1 1 calc R . .
C46 C 0.2437(3) 1.0867(3) -0.80977(14) 0.0378(10) Uani 1 1 d . . .
H46A H 0.2273 1.1671 -0.8210 0.045 Uiso 1 1 calc R . .
C47 C 0.4615(3) 0.8956(3) -0.77490(17) 0.0669(13) Uani 1 1 d . . .
H47A H 0.4982 0.9649 -0.7802 0.100 Uiso 1 1 calc R . .
H47B H 0.4667 0.8313 -0.8002 0.100 Uiso 1 1 calc R . .
H47C H 0.4833 0.8658 -0.7380 0.100 Uiso 1 1 calc R . .
C101 C 0.0865(3) 1.1311(5) -0.6083(4) 0.100(2) Uani 1 1 d . . .
H10A H 0.0984 1.2153 -0.6070 0.120 Uiso 1 1 calc R . .
C102 C 0.0757(4) 1.0730(9) -0.5632(3) 0.098(2) Uani 1 1 d . . .
H10B H 0.0793 1.1167 -0.5310 0.118 Uiso 1 1 calc R . .
C103 C 0.0596(4) 0.9512(8) -0.5651(3) 0.110(2) Uani 1 1 d . . .
H10C H 0.0518 0.9100 -0.5342 0.131 Uiso 1 1 calc R . .
C104 C 0.0549(4) 0.8899(6) -0.6115(4) 0.121(3) Uani 1 1 d . . .
H10D H 0.0436 0.8055 -0.6130 0.146 Uiso 1 1 calc R . .
C105 C 0.0662(4) 0.9485(8) -0.6557(3) 0.101(2) Uani 1 1 d . . .
H10E H 0.0641 0.9040 -0.6876 0.122 Uiso 1 1 calc R . .
C106 C 0.0804(4) 1.0688(8) -0.6552(3) 0.099(2) Uani 1 1 d . . .
H10F H 0.0859 1.1095 -0.6867 0.119 Uiso 1 1 calc R . .
C201 C 0.0132(4) 0.5575(5) -0.5447(2) 0.0775(16) Uani 1 1 d . . .
H20A H 0.0226 0.5977 -0.5755 0.093 Uiso 1 1 calc R . .
C202 C 0.0485(3) 0.6064(4) -0.4941(3) 0.0749(16) Uani 1 1 d . . .
H20B H 0.0818 0.6798 -0.4905 0.090 Uiso 1 1 calc R . .
C203 C 0.0357(3) 0.5493(5) -0.4491(2) 0.0746(15) Uani 1 1 d . . .
H20D H 0.0599 0.5824 -0.4143 0.090 Uiso 1 1 calc R . .
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'
B B 0.0013 0.0007 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 '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'
Cd Cd -0.8075 1.2024 '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
S4 Cd S2 108.27(3) . . ?
S4 Cd S3 118.68(3) . . ?
S2 Cd S3 102.72(3) . . ?
S4 Cd S1 127.83(4) . . ?
S2 Cd S1 97.56(3) . . ?
S3 Cd S1 97.61(3) . . ?
C11 S1 Cd 100.78(12) . . ?
C21 S2 Cd 94.22(11) . . ?
C31 S3 Cd 100.07(11) . . ?
C41 S4 Cd 106.39(11) . . ?
N31 B N11 111.9(3) . . ?
N31 B N21 112.7(3) . . ?
N11 B N21 113.9(3) . . ?
C11 N11 C12 108.1(3) . . ?
C11 N11 B 133.7(3) . . ?
C12 N11 B 118.1(3) . . ?
C11 N12 C13 107.5(3) . . ?
C11 N12 C14 127.7(3) . . ?
C13 N12 C14 124.7(3) . . ?
C21 N21 C22 107.8(3) . . ?
C21 N21 B 133.8(3) . . ?
C22 N21 B 118.2(3) . . ?
C21 N22 C23 108.1(3) . . ?
C21 N22 C24 127.3(3) . . ?
C23 N22 C24 124.2(3) . . ?
C31 N31 C32 108.6(3) . . ?
C31 N31 B 133.6(3) . . ?
C32 N31 B 117.7(3) . . ?
C33 N32 C31 107.8(3) . . ?
C33 N32 C34 124.9(3) . . ?
C31 N32 C34 127.3(3) . . ?
N11 C11 N12 107.3(3) . . ?
N11 C11 S1 126.7(3) . . ?
N12 C11 S1 125.9(3) . . ?
C13 C12 N11 109.0(3) . . ?
C12 C13 N12 108.0(4) . . ?
N12 C14 C17 109.0(3) . . ?
N12 C14 C16 110.5(3) . . ?
C17 C14 C16 112.2(3) . . ?
N12 C14 C15 108.2(3) . . ?
C17 C14 C15 109.3(3) . . ?
C16 C14 C15 107.6(3) . . ?
N21 C21 N22 107.5(3) . . ?
N21 C21 S2 126.0(3) . . ?
N22 C21 S2 126.5(3) . . ?
C23 C22 N21 109.3(3) . . ?
C22 C23 N22 107.3(3) . . ?
C26 C24 N22 109.7(3) . . ?
C26 C24 C25 108.8(3) . . ?
N22 C24 C25 108.8(3) . . ?
C26 C24 C27 112.0(3) . . ?
N22 C24 C27 108.1(3) . . ?
C25 C24 C27 109.4(3) . . ?
N31 C31 N32 107.1(3) . . ?
N31 C31 S3 126.8(3) . . ?
N32 C31 S3 126.0(3) . . ?
C33 C32 N31 108.4(3) . . ?
C32 C33 N32 108.1(3) . . ?
N32 C34 C37 109.8(3) . . ?
N32 C34 C36 108.8(3) . . ?
C37 C34 C36 112.3(3) . . ?
N32 C34 C35 108.7(3) . . ?
C37 C34 C35 109.2(3) . . ?
C36 C34 C35 107.9(3) . . ?
C46 C41 C42 116.5(3) . . ?
C46 C41 S4 119.1(3) . . ?
C42 C41 S4 124.3(3) . . ?
C43 C42 C41 122.0(4) . . ?
C42 C43 C44 121.2(3) . . ?
C45 C44 C43 116.8(4) . . ?
C45 C44 C47 121.8(4) . . ?
C43 C44 C47 121.4(3) . . ?
C44 C45 C46 122.1(4) . . ?
C45 C46 C41 121.3(3) . . ?
C106 C101 C102 120.6(7) . . ?
C103 C102 C101 119.4(7) . . ?
C104 C103 C102 119.6(7) . . ?
C105 C104 C103 120.4(7) . . ?
C106 C105 C104 121.2(7) . . ?
C105 C106 C101 118.7(7) . . ?
C203 C201 C202 120.8(5) 3_564 . ?
C203 C202 C201 120.3(5) . . ?
C202 C203 C201 118.8(5) . 3_564 ?
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
Cd S4 2.4648(10) . ?
Cd S2 2.5622(10) . ?
Cd S3 2.5643(10) . ?
Cd S1 2.5680(10) . ?
S1 C11 1.724(4) . ?
S2 C21 1.716(3) . ?
S3 C31 1.720(3) . ?
S4 C41 1.772(4) . ?
B N31 1.549(5) . ?
B N11 1.559(5) . ?
B N21 1.564(4) . ?
N11 C11 1.355(4) . ?
N11 C12 1.376(4) . ?
N12 C11 1.381(4) . ?
N12 C13 1.384(4) . ?
N12 C14 1.496(4) . ?
N21 C21 1.356(4) . ?
N21 C22 1.380(4) . ?
N22 C21 1.367(4) . ?
N22 C23 1.389(4) . ?
N22 C24 1.522(4) . ?
N31 C31 1.353(4) . ?
N31 C32 1.375(4) . ?
N32 C33 1.378(4) . ?
N32 C31 1.380(4) . ?
N32 C34 1.501(4) . ?
C12 C13 1.327(4) . ?
C14 C17 1.525(4) . ?
C14 C16 1.532(4) . ?
C14 C15 1.542(5) . ?
C22 C23 1.327(4) . ?
C24 C26 1.520(4) . ?
C24 C25 1.534(4) . ?
C24 C27 1.543(4) . ?
C32 C33 1.337(4) . ?
C34 C37 1.528(4) . ?
C34 C36 1.536(4) . ?
C34 C35 1.537(4) . ?
C41 C46 1.389(4) . ?
C41 C42 1.392(4) . ?
C42 C43 1.376(4) . ?
C43 C44 1.393(5) . ?
C44 C45 1.379(4) . ?
C44 C47 1.510(5) . ?
C45 C46 1.382(4) . ?
C101 C106 1.358(7) . ?
C101 C102 1.358(7) . ?
C102 C103 1.356(7) . ?
C103 C104 1.344(7) . ?
C104 C105 1.343(7) . ?
C105 C106 1.336(7) . ?
C201 C203 1.372(5) 3_564 ?
C201 C202 1.372(6) . ?
C202 C203 1.361(6) . ?
C203 C201 1.372(5) 3_564 ?
