#------------------------------------------------------------------------------
#$Date: 2016-03-25 10:35:12 +0100 (vie 25 de mar de 2016) $
#$Revision: 179797 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/93/7009399.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_7009399
loop_
_publ_author_name
'Rabe, Gerd W.'
'Heise, Henrike'
'Liable-Sands, Louise M.'
'Guzei, Ilia A.'
'Rheingold, Arnold L.'
_publ_section_title
;
 Synthesis and crystal structure determination of two monomeric alkali
 metal phosphide derivatives: [M{P(H)C6H2-t-Bu3-2,4,6}(18-crown-6)]
 (M = K or Rb)
;
_journal_issue                   12
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              1863
_journal_paper_doi               10.1039/b000653j
_journal_year                    2000
_chemical_formula_sum            'C30 H54 K O6 P'
_chemical_formula_weight         580.80
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL
_cell_angle_alpha                90.00
_cell_angle_beta                 106.6550(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   40.7745(2)
_cell_length_b                   9.0007(2)
_cell_length_c                   19.1484(3)
_cell_measurement_reflns_used    6608
_cell_measurement_temperature    223(2)
_cell_measurement_theta_max      25.0
_cell_measurement_theta_min      2.0
_cell_volume                     6732.63(19)
_computing_cell_refinement       'Siemens SAINT'
_computing_data_collection       'Siemens SMART'
_computing_data_reduction        SAINT
_computing_molecular_graphics    XP
_computing_publication_material  XCIF
_computing_structure_refinement  'SHELXL-5.03 (Sheldrick, 1994)'
_computing_structure_solution    'SHELXS-5.03 (Sheldrick, 1994)'
_diffrn_ambient_temperature      223(2)
_diffrn_measurement_device       'Siemens P4/CCD'
_diffrn_measurement_method       'phi, omega'
_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  0.0374
_diffrn_reflns_av_sigmaI/netI    0.0741
_diffrn_reflns_limit_h_max       54
_diffrn_reflns_limit_h_min       -54
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -1
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -1
_diffrn_reflns_number            10746
_diffrn_reflns_theta_max         28.39
_diffrn_reflns_theta_min         1.04
_exptl_absorpt_coefficient_mu    0.242
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.146
_exptl_crystal_density_meas      ?
_exptl_crystal_description       block
_exptl_crystal_F_000             2528
_exptl_crystal_size_max          0.45
_exptl_crystal_size_mid          0.40
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.689
_refine_diff_density_min         -0.387
_refine_diff_density_rms         0.068
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   1.146
_refine_ls_goodness_of_fit_obs   1.230
_refine_ls_hydrogen_treatment    'idealized contributions'
_refine_ls_matrix_type           full
_refine_ls_number_parameters     371
_refine_ls_number_reflns         6856
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.214
_refine_ls_restrained_S_obs      1.230
_refine_ls_R_factor_all          0.0881
_refine_ls_R_factor_obs          0.0572
_refine_ls_shift/esd_max         0.001
_refine_ls_shift/esd_mean        0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0800P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_all         0.1809
_refine_ls_wR_factor_obs         0.1509
_reflns_number_observed          4742
_reflns_number_total             6861
_reflns_observed_criterion       >2sigma(I)
_cod_data_source_file            b000653j.txt
_cod_data_source_block           rabx
_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.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 

The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc
w=1/[\s^2^(Fo^2^)+(0.0800P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3' was
changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to
'w=1/[\s^2^(Fo^2^)+(0.0800P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        6732.6(2)
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               7009399
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -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_thermal_displace_type
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_group
K1 K 0.664028(13) 0.89538(6) 0.60809(3) 0.0368(2) Uani 1 d . .
P1 P 0.64977(2) 1.21214(8) 0.69966(4) 0.0383(2) Uani 1 d . .
O21 O 0.68195(5) 0.7511(2) 0.74860(10) 0.0491(5) Uani 1 d . .
O22 O 0.61517(5) 0.7439(2) 0.65313(11) 0.0445(5) Uani 1 d . .
O23 O 0.60356(5) 0.7846(2) 0.50337(11) 0.0481(5) Uani 1 d . .
O24 O 0.65619(5) 0.9094(2) 0.45314(10) 0.0506(5) Uani 1 d . .
O25 O 0.72277(5) 0.8725(2) 0.54440(11) 0.0493(5) Uani 1 d . .
O26 O 0.73309(5) 0.8856(2) 0.69518(11) 0.0510(5) Uani 1 d . .
C1 C 0.57992(6) 1.2353(3) 0.60484(12) 0.0282(5) Uani 1 d . .
C2 C 0.55703(6) 1.2528(3) 0.53503(13) 0.0314(5) Uani 1 d . .
H2A H 0.53369(6) 1.2346(3) 0.52912(13) 0.038 Uiso 1 calc R .
C3 C 0.56673(6) 1.2950(3) 0.47428(13) 0.0306(5) Uani 1 d . .
C4 C 0.60092(5) 1.3263(3) 0.48554(12) 0.0292(5) Uani 1 d . .
H4A H 0.60796(5) 1.3585(3) 0.44541(12) 0.035 Uiso 1 calc R .
C5 C 0.62578(5) 1.3133(2) 0.55266(12) 0.0259(5) Uani 1 d . .
C6 C 0.61631(5) 1.2565(2) 0.61505(12) 0.0254(5) Uani 1 d . .
C7 C 0.56370(6) 1.1981(3) 0.66764(13) 0.0349(6) Uani 1 d . .
C8 C 0.57324(8) 1.0405(3) 0.6981(2) 0.0463(7) Uani 1 d . .
H8A H 0.56670(8) 0.9689(3) 0.6587(2) 0.070 Uiso 1 calc R .
H8B H 0.56129(8) 1.0184(3) 0.7340(2) 0.070 Uiso 1 calc R .
H8C H 0.59774(8) 1.0349(3) 0.7209(2) 0.070 Uiso 1 calc R .
C9 C 0.57348(8) 1.3163(3) 0.7277(2) 0.0501(7) Uani 1 d . .
H9A H 0.56710(8) 1.4138(3) 0.7065(2) 0.075 Uiso 1 calc R .
H9B H 0.59799(8) 1.3132(3) 0.7507(2) 0.075 Uiso 1 calc R .
H9C H 0.56154(8) 1.2968(3) 0.7638(2) 0.075 Uiso 1 calc R .
C10 C 0.52414(7) 1.1992(4) 0.6415(2) 0.0618(9) Uani 1 d . .
H10A H 0.51615(7) 1.1262(4) 0.6032(2) 0.093 Uiso 1 calc R .
H10B H 0.51617(7) 1.2970(4) 0.6230(2) 0.093 Uiso 1 calc R .
H10C H 0.51528(7) 1.1750(4) 0.6821(2) 0.093 Uiso 1 calc R .
C11 C 0.54070(6) 1.3136(3) 0.39814(14) 0.0417(7) Uani 1 d . .
C12 C 0.50348(11) 1.3071(8) 0.3999(3) 0.060(2) Uani 0.60 d P 1
H12A H 0.49985(11) 1.3805(8) 0.4341(3) 0.091 Uiso 0.60 calc PR 1
H12B H 0.49857(11) 1.2089(8) 0.4152(3) 0.091 Uiso 0.60 calc PR 1
H12C H 0.48840(11) 1.3278(8) 0.3517(3) 0.091 Uiso 0.60 calc PR 1
C13 C 0.54638(14) 1.4719(7) 0.3663(3) 0.060(2) Uani 0.60 d P 1
H13A H 0.54243(14) 1.5493(7) 0.3982(3) 0.090 Uiso 0.60 calc PR 1
H13B H 0.53050(14) 1.4839(7) 0.3181(3) 0.090 Uiso 0.60 calc PR 1
H13C H 0.56967(14) 1.4789(7) 0.3632(3) 0.090 Uiso 0.60 calc PR 1
C14 C 0.5474(2) 1.2022(9) 0.3459(3) 0.073(2) Uani 0.60 d P 1
H14A H 0.5711(2) 1.2087(9) 0.3458(3) 0.109 Uiso 0.60 calc PR 1
H14B H 0.5326(2) 1.2225(9) 0.2973(3) 0.109 Uiso 0.60 calc PR 1
H14C H 0.5428(2) 1.1031(9) 0.3607(3) 0.109 Uiso 0.60 calc PR 1
C12' C 0.5161(2) 1.1703(12) 0.3849(5) 0.074(3) Uani 0.40 d P 2
H12D H 0.5295(2) 1.0816(12) 0.3842(5) 0.111 Uiso 0.40 calc PR 2
H12E H 0.4986(2) 1.1801(12) 0.3386(5) 0.111 Uiso 0.40 calc PR 2
H12F H 0.5054(2) 1.1626(12) 0.4239(5) 0.111 Uiso 0.40 calc PR 2
C13' C 0.5196(3) 1.4416(15) 0.3984(6) 0.114(6) Uani 0.40 d P 2
H13D H 0.5102(3) 1.4355(15) 0.4394(6) 0.171 Uiso 0.40 calc PR 2
H13E H 0.5011(3) 1.4447(15) 0.3533(6) 0.171 Uiso 0.40 calc PR 2
H13F H 0.5334(3) 1.5309(15) 0.4026(6) 0.171 Uiso 0.40 calc PR 2
C14' C 0.5577(3) 1.3061(17) 0.3370(5) 0.086(4) Uani 0.40 d P 2
H14D H 0.5713(3) 1.2162(17) 0.3421(5) 0.128 Uiso 0.40 calc PR 2
H14E H 0.5724(3) 1.3920(17) 0.3398(5) 0.128 Uiso 0.40 calc PR 2
H14F H 0.5402(3) 1.3055(17) 0.2904(5) 0.128 Uiso 0.40 calc PR 2
C15 C 0.66245(5) 1.3697(3) 0.55475(13) 0.0306(5) Uani 1 d . .
C16 C 0.67409(6) 1.4945(3) 0.6114(2) 0.0430(7) Uani 1 d . .
H16A H 0.67408(6) 1.4580(3) 0.6590(2) 0.065 Uiso 1 calc R .
H16B H 0.65851(6) 1.5780(3) 0.5980(2) 0.065 Uiso 1 calc R .
H16C H 0.69701(6) 1.5260(3) 0.6128(2) 0.065 Uiso 1 calc R .
C17 C 0.66343(7) 1.4395(5) 0.4822(2) 0.0680(11) Uani 1 d . .
H17A H 0.64724(7) 1.5211(5) 0.4701(2) 0.102 Uiso 1 calc R .
H17B H 0.65736(7) 1.3652(5) 0.4440(2) 0.102 Uiso 1 calc R .
H17C H 0.68630(7) 1.4764(5) 0.4867(2) 0.102 Uiso 1 calc R .
C18 C 0.68869(6) 1.2427(3) 0.5692(2) 0.0447(7) Uani 1 d . .
H18A H 0.68924(6) 1.1941(3) 0.6147(2) 0.067 Uiso 1 calc R .
H18B H 0.71117(6) 1.2826(3) 0.5723(2) 0.067 Uiso 1 calc R .
H18C H 0.68224(6) 1.1714(3) 0.5297(2) 0.067 Uiso 1 calc R .
C21 C 0.65228(9) 0.7564(4) 0.7730(2) 0.0599(9) Uani 1 d . .
H21A H 0.64511(9) 0.8599(4) 0.7750(2) 0.072 Uiso 1 calc R .
H21B H 0.65740(9) 0.7145(4) 0.8222(2) 0.072 Uiso 1 calc R .
C22 C 0.62421(9) 0.6706(4) 0.7225(2) 0.0586(9) Uani 1 d . .
H22A H 0.63180(9) 0.5688(4) 0.7175(2) 0.070 Uiso 1 calc R .
H22B H 0.60435(9) 0.6661(4) 0.7416(2) 0.070 Uiso 1 calc R .
C23 C 0.58653(7) 0.6791(4) 0.6012(2) 0.0565(8) Uani 1 d . .
H23A H 0.56745(7) 0.6677(4) 0.6224(2) 0.068 Uiso 1 calc R .
H23B H 0.59260(7) 0.5807(4) 0.5868(2) 0.068 Uiso 1 calc R .
C24 C 0.57640(7) 0.7790(4) 0.5365(2) 0.0589(9) Uani 1 d . .
H24A H 0.55555(7) 0.7414(4) 0.5014(2) 0.071 Uiso 1 calc R .
H24B H 0.57171(7) 0.8790(4) 0.5515(2) 0.071 Uiso 1 calc R .
C25 C 0.59692(8) 0.8862(4) 0.4438(2) 0.0599(9) Uani 1 d . .
H25A H 0.59734(8) 0.9884(4) 0.4616(2) 0.072 Uiso 1 calc R .
H25B H 0.57425(8) 0.8669(4) 0.4100(2) 0.072 Uiso 1 calc R .
C26 C 0.62367(8) 0.8663(4) 0.4058(2) 0.0596(9) Uani 1 d . .
H26A H 0.62444(8) 0.7620(4) 0.3916(2) 0.071 Uiso 1 calc R .
H26B H 0.61816(8) 0.9271(4) 0.3615(2) 0.071 Uiso 1 calc R .
C27 C 0.68326(9) 0.8617(4) 0.4260(2) 0.0550(8) Uani 1 d . .
H27A H 0.67898(9) 0.8935(4) 0.3752(2) 0.066 Uiso 1 calc R .
H27B H 0.68478(9) 0.7531(4) 0.4276(2) 0.066 Uiso 1 calc R .
C28 C 0.71613(8) 0.9279(4) 0.4718(2) 0.0554(8) Uani 1 d . .
H28A H 0.73493(8) 0.9009(4) 0.4519(2) 0.067 Uiso 1 calc R .
H28B H 0.71431(8) 1.0364(4) 0.4718(2) 0.067 Uiso 1 calc R .
C29 C 0.75236(7) 0.9382(4) 0.5924(2) 0.0593(9) Uani 1 d . .
H29A H 0.74829(7) 1.0441(4) 0.5983(2) 0.071 Uiso 1 calc R .
H29B H 0.77176(7) 0.9286(4) 0.5721(2) 0.071 Uiso 1 calc R .
C30 C 0.76041(7) 0.8621(4) 0.6646(2) 0.0652(10) Uani 1 d . .
H30A H 0.76353(7) 0.7554(4) 0.6585(2) 0.078 Uiso 1 calc R .
H30B H 0.78168(7) 0.9021(4) 0.6972(2) 0.078 Uiso 1 calc R .
C31 C 0.73980(8) 0.8186(4) 0.7651(2) 0.0662(10) Uani 1 d . .
H31A H 0.75989(8) 0.8648(4) 0.7989(2) 0.079 Uiso 1 calc R .
H31B H 0.74449(8) 0.7124(4) 0.7618(2) 0.079 Uiso 1 calc R .
C32 C 0.70913(9) 0.8392(4) 0.7921(2) 0.0641(9) Uani 1 d . .
H32B H 0.71449(9) 0.8087(4) 0.8433(2) 0.077 Uiso 1 calc R .
H32A H 0.70241(9) 0.9441(4) 0.7887(2) 0.077 Uiso 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'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.2009 0.2494 '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
O22 K1 O26 119.16(6) . . ?
O22 K1 O23 59.53(6) . . ?
O26 K1 O23 155.38(6) . . ?
O22 K1 O21 59.80(6) . . ?
O26 K1 O21 59.60(6) . . ?
O23 K1 O21 115.57(6) . . ?
O22 K1 O24 117.79(6) . . ?
O26 K1 O24 113.81(6) . . ?
O23 K1 O24 58.63(6) . . ?
O21 K1 O24 154.04(6) . . ?
O22 K1 O25 146.21(6) . . ?
O26 K1 O25 57.36(6) . . ?
O23 K1 O25 108.60(6) . . ?
O21 K1 O25 109.32(6) . . ?
O24 K1 O25 56.69(6) . . ?
O22 K1 P1 90.43(4) . . ?
O26 K1 P1 90.59(4) . . ?
O23 K1 P1 113.68(4) . . ?
O21 K1 P1 86.17(4) . . ?
O24 K1 P1 119.69(4) . . ?
O25 K1 P1 122.04(4) . . ?
C6 P1 K1 85.57(7) . . ?
C21 O21 C32 112.6(2) . . ?
C21 O21 K1 106.3(2) . . ?
C32 O21 K1 104.0(2) . . ?
C23 O22 C22 113.6(2) . . ?
C23 O22 K1 120.5(2) . . ?
C22 O22 K1 120.1(2) . . ?
C24 O23 C25 112.6(2) . . ?
C24 O23 K1 108.8(2) . . ?
C25 O23 K1 105.3(2) . . ?
C27 O24 C26 111.4(2) . . ?
C27 O24 K1 119.7(2) . . ?
C26 O24 K1 116.6(2) . . ?
C29 O25 C28 112.0(2) . . ?
C29 O25 K1 109.8(2) . . ?
C28 O25 K1 115.0(2) . . ?
C30 O26 C31 111.4(2) . . ?
C30 O26 K1 121.9(2) . . ?
C31 O26 K1 117.3(2) . . ?
C2 C1 C6 119.3(2) . . ?
C2 C1 C7 116.3(2) . . ?
C6 C1 C7 124.4(2) . . ?
C3 C2 C1 124.0(2) . . ?
C4 C3 C2 116.4(2) . . ?
C4 C3 C11 121.0(2) . . ?
C2 C3 C11 122.5(2) . . ?
C3 C4 C5 124.2(2) . . ?
C4 C5 C6 119.6(2) . . ?
C4 C5 C15 115.6(2) . . ?
C6 C5 C15 124.7(2) . . ?
C5 C6 C1 116.0(2) . . ?
C5 C6 P1 119.8(2) . . ?
C1 C6 P1 124.2(2) . . ?
C9 C7 C8 111.8(2) . . ?
C9 C7 C10 105.1(2) . . ?
C8 C7 C10 104.8(2) . . ?
C9 C7 C1 110.5(2) . . ?
C8 C7 C1 111.8(2) . . ?
C10 C7 C1 112.4(2) . . ?
C13' C11 C14' 116.2(9) . . ?
C14 C11 C12 111.2(4) . . ?
C13' C11 C3 109.4(4) . . ?
C14 C11 C3 110.5(3) . . ?
C14' C11 C3 112.3(4) . . ?
C12 C11 C3 113.1(3) . . ?
C14 C11 C13 105.6(5) . . ?
C12 C11 C13 107.3(4) . . ?
C3 C11 C13 108.8(3) . . ?
C13' C11 C12' 107.3(8) . . ?
C14' C11 C12' 104.1(7) . . ?
C3 C11 C12' 106.9(3) . . ?
C17 C15 C18 105.7(2) . . ?
C17 C15 C16 104.9(2) . . ?
C18 C15 C16 111.0(2) . . ?
C17 C15 C5 112.4(2) . . ?
C18 C15 C5 111.9(2) . . ?
C16 C15 C5 110.7(2) . . ?
O21 C21 C22 109.9(3) . . ?
O22 C22 C21 108.0(3) . . ?
O22 C23 C24 108.1(3) . . ?
O23 C24 C23 109.0(2) . . ?
O23 C25 C26 108.5(2) . . ?
O24 C26 C25 109.6(2) . . ?
O24 C27 C28 109.0(2) . . ?
O25 C28 C27 108.7(2) . . ?
O25 C29 C30 109.2(3) . . ?
O26 C30 C29 108.9(2) . . ?
O26 C31 C32 108.6(2) . . ?
O21 C32 C31 108.4(3) . . ?
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
K1 O22 2.749(2) . ?
K1 O26 2.833(2) . ?
K1 O23 2.874(2) . ?
K1 O21 2.887(2) . ?
K1 O24 2.894(2) . ?
K1 O25 2.990(2) . ?
K1 P1 3.4822(9) . ?
P1 C6 1.838(2) . ?
O21 C21 1.417(4) . ?
O21 C32 1.422(4) . ?
O22 C23 1.424(3) . ?
O22 C22 1.434(4) . ?
O23 C24 1.426(4) . ?
O23 C25 1.427(4) . ?
O24 C27 1.415(4) . ?
O24 C26 1.429(4) . ?
O25 C29 1.419(4) . ?
O25 C28 1.427(4) . ?
O26 C30 1.414(4) . ?
O26 C31 1.421(4) . ?
C1 C2 1.403(3) . ?
C1 C6 1.452(3) . ?
C1 C7 1.566(3) . ?
C2 C3 1.385(3) . ?
C3 C4 1.378(3) . ?
C3 C11 1.547(3) . ?
C4 C5 1.395(3) . ?
C5 C6 1.450(3) . ?
C5 C15 1.569(3) . ?
C7 C9 1.533(4) . ?
C7 C8 1.541(4) . ?
C7 C10 1.546(4) . ?
C11 C13' 1.438(9) . ?
C11 C14 1.496(7) . ?
C11 C14' 1.522(12) . ?
C11 C12 1.529(6) . ?
C11 C13 1.593(6) . ?
C11 C12' 1.608(9) . ?
C15 C17 1.536(4) . ?
C15 C18 1.536(3) . ?
C15 C16 1.538(3) . ?
C21 C22 1.485(5) . ?
C23 C24 1.491(5) . ?
C25 C26 1.484(5) . ?
C27 C28 1.499(5) . ?
C29 C30 1.493(5) . ?
C31 C32 1.496(5) . ?
