#------------------------------------------------------------------------------
#$Date: 2020-10-06 13:36:55 +0300 (Tue, 06 Oct 2020) $
#$Revision: 257878 $
#$URL: svn://www.crystallography.net/cod/cif/7/05/98/7059872.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_7059872
loop_
_publ_author_name
'Shi, Yang'
'Wang, Gangqiang'
'Wang, Hang'
'Deng, Bin'
'Gao, Tao'
'Wang, Jian'
'Guo, Haibing'
'Wu, Minghu'
'Sun, Shaofa'
_publ_section_title
;
 Cu-catalyzed cyclization to construct indoles from
 N-(ortho-chloromethyl)aryl carbamates and terminal alkynes via a one-pot
 reaction
;
_journal_issue                   34
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              14477
_journal_page_last               14480
_journal_paper_doi               10.1039/D0NJ01981J
_journal_volume                  44
_journal_year                    2020
_chemical_formula_moiety         'C18 H17 N O2'
_chemical_formula_sum            'C18 H17 N O2'
_chemical_formula_weight         279.32
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     dual
_audit_creation_date             2019-01-24
_audit_creation_method
;
Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
;
_audit_update_record
;
2020-04-08 deposited with the CCDC.	2020-07-27 downloaded from the CCDC.
;
_cell_angle_alpha                90
_cell_angle_beta                 105.459(11)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   9.7871(13)
_cell_length_b                   28.773(3)
_cell_length_c                   10.9288(12)
_cell_measurement_reflns_used    2881
_cell_measurement_temperature    293.02(10)
_cell_measurement_theta_max      73.2030
_cell_measurement_theta_min      4.4020
_cell_volume                     2966.3(6)
_computing_cell_refinement       'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_data_collection       'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_data_reduction        'CrysAlisPro 1.171.38.43f (Rigaku OD, 2015)'
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'ShelXL (Sheldrick, 2015)'
_computing_structure_solution    'ShelXT (Sheldrick, 2015)'
_diffrn_ambient_environment      air
_diffrn_ambient_temperature      293.02(10)
_diffrn_detector                 'CCD plate'
_diffrn_detector_area_resol_mean 5.2684
_diffrn_detector_type            AtlasS2
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.955
_diffrn_measurement_details
;
List of Runs (angles in degrees, time in seconds):

  # Type    Start    End  Width  tₑₓₚ   ω     θ     κ     φ   Frames
#--------------------------------------------------------------------------
  1  ω     20.00 113.00   1.00    1.00    --   40.98  57.00  90.00   93
  2  ω     96.00 124.00   1.00    1.80    --  107.58 123.00  -4.00   28
  3  ω    112.00 178.00   1.00    1.80    --  107.58  77.00 -30.00   66
  4  ω    144.00 178.00   1.00    1.80    --  107.58  30.00-180.00   34
  5  ω    115.00 140.00   1.00    1.80    --  107.58 -77.00 -90.00   25
  6  ω     80.00 122.00   1.00    1.80    --  107.58  30.00-180.00   42
  7  ω     32.00  68.00   1.00    1.80    --  107.58 -77.00 -90.00   36
  8  ω     37.00 108.00   1.00    1.80    --  107.58 -94.00-120.00   71
  9  ω     43.00 132.00   1.00    1.80    --  107.58 -45.00   0.00   89
 10  ω     29.00 109.00   1.00    1.80    --  107.58 -94.00 -30.00   80
 11  ω    -51.00 -17.00   1.00    1.00    --  -40.98 -37.00-120.00   34
 12  ω   -115.00 -59.00   1.00    1.00    --  -40.98 -37.00-120.00   56
 13  ω    -95.00 -36.00   1.00    1.00    --  -40.98 125.00  90.00   59
;
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'SuperNova, Dual, Cu at zero, AtlasS2'
_diffrn_measurement_method       'ω scans'
_diffrn_orient_matrix_type
'CrysAlisPro convention (1999,Acta A55,543-557)'
_diffrn_orient_matrix_UB_11      -0.0540168000
_diffrn_orient_matrix_UB_12      0.0385907000
_diffrn_orient_matrix_UB_13      -0.0986946000
_diffrn_orient_matrix_UB_21      -0.0369305000
_diffrn_orient_matrix_UB_22      -0.0368384000
_diffrn_orient_matrix_UB_23      -0.1061333000
_diffrn_orient_matrix_UB_31      -0.1496326000
_diffrn_orient_matrix_UB_32      -0.0047920000
_diffrn_orient_matrix_UB_33      0.0192428000
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54184
_diffrn_reflns_av_R_equivalents  0.0635
_diffrn_reflns_av_unetI/netI     0.0681
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.955
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       35
_diffrn_reflns_limit_k_min       -33
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            11974
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.955
_diffrn_reflns_theta_full        67.684
_diffrn_reflns_theta_max         74.954
_diffrn_reflns_theta_min         4.470
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'SuperNova (Cu) X-ray Source'
_exptl_absorpt_coefficient_mu    0.650
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.31671
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
CrysAlisPro 1.171.38.43f (Rigaku Oxford Diffraction, 2015)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colourless
_exptl_crystal_colour_primary    colourless
_exptl_crystal_density_diffrn    1.251
_exptl_crystal_description       block
_exptl_crystal_F_000             1184
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.12
_exptl_crystal_size_min          0.11
_refine_diff_density_max         0.457
_refine_diff_density_min         -0.341
_refine_diff_density_rms         0.094
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.089
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     381
_refine_ls_number_reflns         5845
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.089
_refine_ls_R_factor_all          0.1236
_refine_ls_R_factor_gt           0.0941
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1391P)²+8.9962P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.3152
_refine_ls_wR_factor_ref         0.3292
_reflns_Friedel_coverage         0.000
_reflns_number_gt                4334
_reflns_number_total             5845
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            d0nj01981j2.cif
_cod_data_source_block           fy-o-2
_cod_depositor_comments
;Adding full bibliography for 7059872--7059873.cif.

 Adding full bibliography for 7059872--7059873.cif.
;
_cod_database_code               7059872
_shelx_shelxl_version_number     2018/3
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_reflns_odcompleteness_completeness 99.76
_reflns_odcompleteness_iscentric 1
_reflns_odcompleteness_theta     66.97
_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups, All N(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C00M(H00A,H00B), C9(H9A,H9B), C17(H17A,H17B), C010(H01A,H01B)
2.b Aromatic/amide H refined with riding coordinates:
 N1(H1), N006(H006), C14(H14), C00G(H00G), C00I(H00I), C00K(H00K), C00P(H00P),
 C6(H6), C11(H11), C00T(H00T), C00U(H00U), C00V(H00V), C13(H13), C12(H12),
 C00Y(H00Y), C2(H2), C011(H011), C5(H5), C4(H4), C3(H3)
2.c Idealised Me refined as rotating group:
 C18(H18A,H18B,H18C), C015(H01C,H01D,H01E)
;
_olex2_submission_special_instructions 'No special instructions were received'
_oxdiff_exptl_absorpt_empirical_details
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
;
_oxdiff_exptl_absorpt_empirical_full_max 2.561
_oxdiff_exptl_absorpt_empirical_full_min 0.477
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
O2 O 0.1376(3) 0.47853(11) 0.6660(3) 0.0315(7) Uani 1 1 d . . . . .
O002 O 0.6489(3) 0.48662(10) 0.6684(3) 0.0319(7) Uani 1 1 d . . . . .
O1 O -0.0072(3) 0.50830(11) 0.7773(3) 0.0349(7) Uani 1 1 d . . . . .
O004 O 0.5044(3) 0.50835(11) 0.7890(3) 0.0358(7) Uani 1 1 d . . . . .
N1 N 0.2233(3) 0.53190(12) 0.8115(3) 0.0288(8) Uani 1 1 d . . . . .
H1 H 0.298408 0.528261 0.785853 0.035 Uiso 1 1 calc R . . . .
N006 N 0.7221(3) 0.54189(12) 0.8111(3) 0.0288(8) Uani 1 1 d . . . . .
H006 H 0.790917 0.543020 0.775996 0.035 Uiso 1 1 calc R . . . .
C007 C 0.6615(4) 0.69510(15) 0.5188(4) 0.0271(9) Uani 1 1 d . . . . .
C8 C 0.2912(4) 0.64469(15) 0.7021(4) 0.0284(9) Uani 1 1 d . . . . .
C16 C 0.1086(4) 0.50640(14) 0.7554(4) 0.0266(8) Uani 1 1 d . . . . .
C15 C 0.2284(4) 0.56451(15) 0.9104(4) 0.0282(9) Uani 1 1 d . . . . .
C00B C 0.6157(4) 0.51203(14) 0.7603(4) 0.0267(9) Uani 1 1 d . . . . .
C00C C 0.7318(4) 0.57156(15) 0.9166(4) 0.0279(9) Uani 1 1 d . . . . .
C00D C 0.8021(4) 0.64768(15) 0.7187(4) 0.0295(9) Uani 1 1 d . . . . .
C14 C 0.1648(4) 0.55452(16) 1.0068(4) 0.0315(9) Uani 1 1 d . . . . .
H14 H 0.119830 0.526080 1.007340 0.038 Uiso 1 1 calc R . . . .
C7 C 0.2272(4) 0.66701(15) 0.6116(4) 0.0301(9) Uani 1 1 d . . . . .
C00G C 0.6558(4) 0.74332(16) 0.5261(4) 0.0314(9) Uani 1 1 d . . . . .
H00G H 0.694172 0.758018 0.603387 0.038 Uiso 1 1 calc R . . . .
C00H C 0.7331(4) 0.66837(15) 0.6283(4) 0.0299(9) Uani 1 1 d . . . . .
C00I C 0.6619(4) 0.56154(16) 1.0088(4) 0.0311(9) Uani 1 1 d . . . . .
H00I H 0.604447 0.535342 1.000214 0.037 Uiso 1 1 calc R . . . .
C00J C 0.8183(4) 0.61099(15) 0.9293(4) 0.0296(9) Uani 1 1 d . . . . .
C00K C 0.6039(4) 0.67401(17) 0.4011(4) 0.0333(10) Uani 1 1 d . . . . .
H00K H 0.607856 0.641866 0.393738 0.040 Uiso 1 1 calc R . . . .
C1 C 0.1580(4) 0.69448(15) 0.5037(4) 0.0306(9) Uani 1 1 d . . . . .
C00M C 0.8936(4) 0.62413(15) 0.8294(4) 0.0304(9) Uani 1 1 d . . . . .
H00A H 0.972782 0.644309 0.867882 0.036 Uiso 1 1 calc R . . . .
H00B H 0.931604 0.596185 0.801259 0.036 Uiso 1 1 calc R . . . .
C9 C 0.3760(4) 0.61777(16) 0.8098(4) 0.0308(9) Uani 1 1 d . . . . .
H9A H 0.461412 0.635110 0.849172 0.037 Uiso 1 1 calc R . . . .
H9B H 0.404598 0.588889 0.778066 0.037 Uiso 1 1 calc R . . . .
C10 C 0.2997(4) 0.60655(15) 0.9102(4) 0.0298(9) Uani 1 1 d . . . . .
C00P C 0.5358(4) 0.74846(19) 0.3042(4) 0.0380(11) Uani 1 1 d . . . . .
H00P H 0.493930 0.766270 0.233061 0.046 Uiso 1 1 calc R . . . .
C6 C 0.0121(4) 0.70257(16) 0.4730(4) 0.0339(10) Uani 1 1 d . . . . .
H6 H -0.042020 0.689473 0.522315 0.041 Uiso 1 1 calc R . . . .
C11 C 0.3011(4) 0.63851(17) 1.0058(4) 0.0349(10) Uani 1 1 d . . . . .
H11 H 0.347378 0.666777 1.006407 0.042 Uiso 1 1 calc R . . . .
C17 C 0.0240(4) 0.44819(16) 0.6005(5) 0.0347(10) Uani 1 1 d . . . . .
H17A H -0.059677 0.466160 0.559809 0.042 Uiso 1 1 calc R . . . .
H17B H -0.000315 0.426634 0.659620 0.042 Uiso 1 1 calc R . . . .
C00T C 0.5939(4) 0.76963(17) 0.4203(5) 0.0363(10) Uani 1 1 d . . . . .
H00T H 0.591195 0.801820 0.426931 0.044 Uiso 1 1 calc R . . . .
C00U C 0.8340(5) 0.63891(16) 1.0355(4) 0.0348(10) Uani 1 1 d . . . . .
H00U H 0.892700 0.664817 1.045419 0.042 Uiso 1 1 calc R . . . .
C00V C 0.5407(4) 0.70065(19) 0.2952(4) 0.0386(11) Uani 1 1 d . . . . .
H00V H 0.501498 0.686203 0.217616 0.046 Uiso 1 1 calc R . . . .
C13 C 0.1678(4) 0.58659(18) 1.1021(4) 0.0359(10) Uani 1 1 d . . . . .
H13 H 0.125289 0.579721 1.166542 0.043 Uiso 1 1 calc R . . . .
C12 C 0.2347(5) 0.62899(18) 1.1005(5) 0.0405(11) Uani 1 1 d . . . . .
H12 H 0.234991 0.651025 1.162858 0.049 Uiso 1 1 calc R . . . .
C00Y C 0.7640(5) 0.62907(17) 1.1275(5) 0.0392(11) Uani 1 1 d . . . . .
H00Y H 0.775404 0.648317 1.197879 0.047 Uiso 1 1 calc R . . . .
C2 C 0.2358(5) 0.71430(18) 0.4281(5) 0.0400(11) Uani 1 1 d . . . . .
H2 H 0.333123 0.709239 0.447488 0.048 Uiso 1 1 calc R . . . .
C010 C 0.5476(5) 0.45096(16) 0.6123(5) 0.0362(10) Uani 1 1 d . . . . .
H01A H 0.456733 0.464735 0.570421 0.043 Uiso 1 1 calc R . . . .
H01B H 0.534462 0.429648 0.677039 0.043 Uiso 1 1 calc R . . . .
C011 C 0.6771(5) 0.59034(17) 1.1136(4) 0.0349(10) Uani 1 1 d . . . . .
H011 H 0.628976 0.583641 1.174310 0.042 Uiso 1 1 calc R . . . .
C5 C -0.0525(4) 0.72999(17) 0.3695(5) 0.0389(11) Uani 1 1 d . . . . .
H5 H -0.149644 0.735287 0.349833 0.047 Uiso 1 1 calc R . . . .
C18 C 0.0773(5) 0.42232(18) 0.5029(5) 0.0412(11) Uani 1 1 d . . . . .
H18A H 0.108720 0.444134 0.449722 0.062 Uiso 1 1 calc GR . . . .
H18B H 0.002244 0.403627 0.451815 0.062 Uiso 1 1 calc GR . . . .
H18C H 0.154945 0.402669 0.544818 0.062 Uiso 1 1 calc GR . . . .
C4 C 0.0262(5) 0.74933(18) 0.2962(5) 0.0410(11) Uani 1 1 d . . . . .
H4 H -0.017482 0.767868 0.227177 0.049 Uiso 1 1 calc R . . . .
C015 C 0.6078(5) 0.42577(18) 0.5176(5) 0.0430(11) Uani 1 1 d . . . . .
H01C H 0.628410 0.447745 0.458869 0.065 Uiso 1 1 calc GR . . . .
H01D H 0.539932 0.403516 0.472170 0.065 Uiso 1 1 calc GR . . . .
H01E H 0.693274 0.410010 0.561368 0.065 Uiso 1 1 calc GR . . . .
C3 C 0.1719(5) 0.7413(2) 0.3250(5) 0.0465(13) Uani 1 1 d . . . . .
H3 H 0.225330 0.754050 0.274657 0.056 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 0.0181 0.0091 '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'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 '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
C16 O2 C17 115.8(3) . . ?
C00B O002 C010 115.2(3) . . ?
C16 N1 C15 124.2(3) . . ?
C00B N006 C00C 126.5(3) . . ?
C00G C007 C00H 120.2(4) . . ?
C00G C007 C00K 118.2(4) . . ?
C00K C007 C00H 121.4(4) . . ?
C7 C8 C9 176.9(4) . . ?
O1 C16 O2 123.6(4) . . ?
O1 C16 N1 126.3(4) . . ?
N1 C16 O2 110.1(3) . . ?
C14 C15 N1 120.5(4) . . ?
C14 C15 C10 120.4(4) . . ?
C10 C15 N1 119.1(4) . . ?
O004 C00B O002 123.7(4) . . ?
O004 C00B N006 126.5(4) . . ?
N006 C00B O002 109.8(3) . . ?
C00I C00C N006 121.7(4) . . ?
C00I C00C C00J 119.8(4) . . ?
C00J C00C N006 118.4(4) . . ?
C00H C00D C00M 176.7(4) . . ?
C13 C14 C15 120.5(4) . . ?
C8 C7 C1 177.0(4) . . ?
C00T C00G C007 121.0(4) . . ?
C00D C00H C007 174.9(4) . . ?
C011 C00I C00C 120.6(4) . . ?
C00C C00J C00M 121.8(4) . . ?
C00U C00J C00C 118.8(4) . . ?
C00U C00J C00M 119.4(4) . . ?
C00V C00K C007 120.5(4) . . ?
C6 C1 C7 121.2(4) . . ?
C2 C1 C7 120.3(4) . . ?
C2 C1 C6 118.5(4) . . ?
C00D C00M C00J 113.7(3) . . ?
C8 C9 C10 114.2(3) . . ?
C15 C10 C9 121.9(4) . . ?
C11 C10 C15 118.4(4) . . ?
C11 C10 C9 119.7(4) . . ?
C00V C00P C00T 119.3(4) . . ?
C5 C6 C1 120.4(4) . . ?
C12 C11 C10 121.2(4) . . ?
O2 C17 C18 106.5(4) . . ?
C00G C00T C00P 120.5(5) . . ?
C00J C00U C00Y 121.5(4) . . ?
C00P C00V C00K 120.4(4) . . ?
C14 C13 C12 119.5(4) . . ?
C13 C12 C11 119.9(5) . . ?
C011 C00Y C00U 119.5(4) . . ?
C3 C2 C1 121.2(4) . . ?
O002 C010 C015 106.5(4) . . ?
C00Y C011 C00I 119.8(4) . . ?
C4 C5 C6 120.3(4) . . ?
C5 C4 C3 120.1(4) . . ?
C2 C3 C4 119.6(5) . . ?
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
O2 C16 1.351(5) . ?
O2 C17 1.445(5) . ?
O002 C00B 1.350(5) . ?
O002 C010 1.445(5) . ?
O1 C16 1.221(5) . ?
O004 C00B 1.216(5) . ?
N1 C16 1.344(5) . ?
N1 C15 1.423(5) . ?
N006 C00B 1.350(5) . ?
N006 C00C 1.417(5) . ?
C007 C00G 1.392(6) . ?
C007 C00H 1.438(6) . ?
C007 C00K 1.398(6) . ?
C8 C7 1.205(6) . ?
C8 C9 1.468(6) . ?
C15 C14 1.388(6) . ?
C15 C10 1.397(6) . ?
C00C C00I 1.391(6) . ?
C00C C00J 1.400(6) . ?
C00D C00H 1.196(6) . ?
C00D C00M 1.466(6) . ?
C14 C13 1.386(7) . ?
C7 C1 1.431(6) . ?
C00G C00T 1.380(6) . ?
C00I C011 1.389(6) . ?
C00J C00M 1.519(6) . ?
C00J C00U 1.386(6) . ?
C00K C00V 1.389(6) . ?
C1 C6 1.397(6) . ?
C1 C2 1.387(6) . ?
C9 C10 1.517(6) . ?
C10 C11 1.390(6) . ?
C00P C00T 1.385(7) . ?
C00P C00V 1.381(7) . ?
C6 C5 1.386(6) . ?
C11 C12 1.389(7) . ?
C17 C18 1.504(7) . ?
C00U C00Y 1.388(7) . ?
C13 C12 1.387(7) . ?
C00Y C011 1.386(7) . ?
C2 C3 1.374(7) . ?
C010 C015 1.506(7) . ?
C5 C4 1.369(7) . ?
C4 C3 1.395(7) . ?
