##############################################################################
#                                                                            #
# This CIF contains the data for a data article accepted for                 #
# publication in IUCrData. It conforms to the requirements of                #
# Notes for Authors for IUCrData, and has been                               #
# peer reviewed under the auspices of IUCrData.                              #
#                                                                            #
# Full details of the Crystallographic Information File format               #
# are given in the paper "The Crystallographic Information File (CIF):       #
# a New Standard Archive File for Crystallography" by S. R. Hall, F. H.      #
# Allen and I. D. Brown [Acta Cryst. (1991), A47, 655-685].                  #
#                                                                            #
# The current version of the core CIF dictionary is obtainable from          #
# ftp://ftp.iucr.org/pub/cif_core.dic.                                       #
#                                                                            #
# Software is freely available for graphical display of the structure(s)     #
# in this CIF. For information consult the CIF software page                 #
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#                                                                            #
# This file may be used for bona fide research purposes within the           #
# scientific community so long as proper attribution is given to the data    # 
# article from which it was obtained.                                        #
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##############################################################################
data_I
_audit_creation_method     'SHELXL-2016/6'
_chemical_name_systematic
;
N-[1,4,4-Trimethyltricyclo[6.3.1.0^3,9^]dodec-8(12)-en-2-yl]acetamide
;
_chemical_name_common     ?
_chemical_formula_moiety     'C17 H27 N O'
_chemical_formula_sum     'C17 H27 N O'
_chemical_formula_iupac     'C17 H27 N O'
_chemical_formula_weight     261.39
_chemical_melting_point     ?
_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.
;
_space_group_crystal_system     orthorhombic
_space_group_name_H-M_alt     'P 21 21 21'
_space_group_name_Hall     'P 2ac 2ab'
loop_
    _space_group_symop_operation_xyz
    'x, y, z'
    '-x+1/2, -y, z+1/2'
    '-x, y+1/2, -z+1/2'
    'x+1/2, -y+1/2, -z'
_cell_length_a     9.0275(4)
_cell_length_b     16.9076(7)
_cell_length_c     30.7411(11)
_cell_angle_alpha     90
_cell_angle_beta     90
_cell_angle_gamma     90
_cell_volume     4692.1(3)
_cell_formula_units_Z     12
_cell_measurement_reflns_used     9534
_cell_measurement_theta_min     3
_cell_measurement_theta_max     26.4
_cell_measurement_temperature     180(2)
_exptl_crystal_description     'rectangular plate'
_exptl_crystal_colour     colourless
_exptl_crystal_size_max     0.500
_exptl_crystal_size_mid     0.250
_exptl_crystal_size_min     0.12
_exptl_crystal_density_diffrn     1.110
_exptl_crystal_density_meas     ?
_exptl_crystal_density_method     ?
_exptl_crystal_F_000     1728
_exptl_absorpt_coefficient_mu     0.068
_exptl_absorpt_correction_type     multi-scan
_exptl_absorpt_process_details
;
(CrysAlis PRO; Rigaku Oxford Diffraction, 2015)
;
_shelx_estimated_absorpt_T_min     0.967
_shelx_estimated_absorpt_T_max     0.992
_exptl_absorpt_correction_T_min     0.91098
_exptl_absorpt_correction_T_max     1.00000
_diffrn_ambient_temperature     180(2)
_diffrn_radiation_type     'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator     graphite
_diffrn_measurement_device_type
                           'Rigaku Oxford Diffraction Xcalibur Eos Gemini ultra'
_diffrn_measurement_device     'four-circle diffractometer'
_diffrn_measurement_method     'ω scans'
_diffrn_detector_area_resol_mean     16.1978
_diffrn_reflns_number     26928
_diffrn_reflns_av_R_equivalents     0.0323
_diffrn_reflns_theta_min     3.007
_diffrn_reflns_theta_max     26.370
_diffrn_reflns_theta_full     25.242
_diffrn_measured_fraction_theta_max     0.997
_diffrn_measured_fraction_theta_full     0.997
_diffrn_reflns_limit_h_min     -10
_diffrn_reflns_limit_h_max     11
_diffrn_reflns_limit_k_min     -21
_diffrn_reflns_limit_k_max     20
_diffrn_reflns_limit_l_min     -38
_diffrn_reflns_limit_l_max     37
_refine_special_details
;
 All H atoms attached to C atoms were fixed geometrically and
treated as riding with C---H = 0.99 Å (methylene), 0.98 Å (methyl),
1.0Å (methine) with Uiso(H) = 1.2Ueq(CH and CH₂) or Uiso(H) =
1.5Ueq(CH₃). The coordinates of H atoms attached to N atoms were freely
refined with Uiso(H) = 1.2Ueq(N) and the H attached to hydroxyl O atoms
were fixed geometrically and treated as riding with O---H = 0.84Å and
Uiso(H) = 1.5Ueq(O).
;
_reflns_number_total     9534
_reflns_number_gt     8730
_reflns_threshold_expression     'I > 2σ(I)'
_refine_ls_structure_factor_coef     Fsqd
_refine_ls_matrix_type     full
_refine_ls_R_factor_all     0.0479
_refine_ls_R_factor_gt     0.0429
_refine_ls_wR_factor_gt     0.0986
_refine_ls_wR_factor_ref     0.1016
_refine_ls_goodness_of_fit_ref     1.071
_refine_ls_restrained_S_all     1.071
_refine_ls_number_reflns     9534
_refine_ls_number_parameters     526
_refine_ls_number_restraints     0
_refine_ls_hydrogen_treatment     constr
_refine_ls_weighting_scheme     calc
_refine_ls_weighting_details
              'w=1/[σ²(Fo²)+(0.0470P)²+0.5238P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary     ?
_refine_ls_shift/su_max     0.000
_refine_ls_shift/su_mean     0.000
_refine_diff_density_max     0.366
_refine_diff_density_min     -0.151
_refine_ls_extinction_method     none
_refine_ls_extinction_coef     .
_refine_ls_abs_structure_details
;
Flack x determined using 3320 quotients
[(I⁺)-(I⁻)]/[(I⁺)+(I⁻)]
(Parsons et al.,  2013)
;
_refine_ls_abs_structure_Flack     -0.3(5)
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'
    'N' 'N' 0.0061 0.0033
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
_computing_data_collection
;
CrysAlis PRO (Rigaku Oxford Diffraction, 2015)
;
_computing_cell_refinement
;
CrysAlis PRO (Rigaku Oxford Diffraction, 2015)
;
_computing_data_reduction
;
CrysAlis PRO (Rigaku Oxford Diffraction, 2015)
;
_computing_structure_solution
;
SHELXS2014 (Sheldrick, 2008)
;
_computing_structure_refinement
;
SHELXL2014 (Sheldrick, 2015)
;
_computing_molecular_graphics
;
ORTEP-3 for Windows (Farrugia, 2012) and Mercury (Macrae et al.,
2008)
;
_computing_publication_material
;
SHELXL2014 (Sheldrick, 2015)
;
loop_
    _atom_site_type_symbol
    _atom_site_label
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_U_iso_or_equiv
    _atom_site_adp_type
    _atom_site_calc_flag
    _atom_site_occupancy
    _atom_site_disorder_assembly
    _atom_site_disorder_group
    O O1 1.2729(2) 0.27939(10) 0.21957(5) 0.0355(4) Uani d 1 . .
    O O3 0.8062(2) 0.57328(10) 0.39222(5) 0.0367(4) Uani d 1 . .
    N N1 1.2026(2) 0.26183(11) 0.28991(6) 0.0271(4) Uani d 1 . .
    H H1 1.1510 0.2811 0.3109 0.033 Uiso calc 1 . .
    O O2 1.0471(2) 0.32177(11) 0.36531(5) 0.0435(4) Uani d 1 . .
    N N2 0.9937(2) 0.43161(11) 0.40406(6) 0.0286(4) Uani d 1 . .
    H H2 0.9476 0.4761 0.4041 0.034 Uiso calc 1 . .
    N N3 0.8069(2) 0.69312(11) 0.35888(6) 0.0267(4) Uani d 1 . .
    H H3 0.7722 0.7201 0.3374 0.032 Uiso calc 1 . .
    C C8A 0.9896(2) 0.38980(14) 0.48235(7) 0.0288(5) Uani d 1 . .
    C C10A 1.1816(3) 0.49735(13) 0.50212(7) 0.0297(5) Uani d 1 . .
    H H10A 1.2557 0.5363 0.5113 0.036 Uiso calc 1 . .
    C C5A 1.3599(3) 0.46297(14) 0.43902(7) 0.0291(5) Uani d 1 . .
    C C5B 1.1863(3) 0.74100(14) 0.35737(8) 0.0330(5) Uani d 1 . .
    C C6 1.3768(3) 0.18714(14) 0.33651(7) 0.0286(5) Uani d 1 . .
    H H6 1.3453 0.2319 0.3545 0.034 Uiso calc 1 . .
    C C1B 1.0646(3) 0.85866(14) 0.42509(8) 0.0346(6) Uani d 1 . .
    C C16B 0.7589(2) 0.61863(13) 0.36388(7) 0.0282(5) Uani d 1 . .
    C C17B 0.6396(3) 0.59381(15) 0.33209(8) 0.0370(6) Uani d 1 . .
    H H17A 0.6745 0.5501 0.3150 0.056 Uiso calc 1 . .
    H H17B 0.6162 0.6374 0.3133 0.056 Uiso calc 1 . .
    H H17C 0.5525 0.5782 0.3478 0.056 Uiso calc 1 . .
    C C6B 1.0294(3) 0.77820(12) 0.35998(7) 0.0253(5) Uani d 1 . .
    H H6B 0.9908 0.7802 0.3302 0.030 Uiso calc 1 . .
    C C7A 1.0855(2) 0.41177(12) 0.44174(7) 0.0237(4) Uani d 1 . .
    H H7A 1.1438 0.3649 0.4340 0.028 Uiso calc 1 . .
    C C1A 1.2051(3) 0.41964(15) 0.52530(7) 0.0310(5) Uani d 1 . .
    C C6A 1.1968(2) 0.47923(13) 0.45294(7) 0.0250(4) Uani d 1 . .
    H H6A 1.1640 0.5265 0.4372 0.030 Uiso calc 1 . .
    C C7 1.2724(2) 0.18478(13) 0.29605(7) 0.0252(5) Uani d 1 . .
    H H7 1.3346 0.1749 0.2705 0.030 Uiso calc 1 . .
    C C7B 0.9144(2) 0.73141(13) 0.38758(7) 0.0249(5) Uani d 1 . .
    H H7B 0.9673 0.6901 0.4036 0.030 Uiso calc 1 . .
    C C12A 0.9095(3) 0.46473(16) 0.49821(8) 0.0362(6) Uani d 1 . .
    H H12A 0.8473 0.4519 0.5230 0.043 Uiso calc 1 . .
    H H12B 0.8466 0.4852 0.4752 0.043 Uiso calc 1 . .
    C C10B 1.0316(3) 0.86401(13) 0.37708(7) 0.0313(5) Uani d 1 . .
    H H10B 1.1075 0.8952 0.3621 0.038 Uiso calc 1 . .
    C C4 1.6173(3) 0.12822(17) 0.30345(9) 0.0412(6) Uani d 1 . .
    H H4A 1.7144 0.1447 0.2934 0.049 Uiso calc 1 . .
    H H4B 1.5595 0.1148 0.2779 0.049 Uiso calc 1 . .
    C C9B 0.9623(3) 0.82009(16) 0.44760(8) 0.0372(6) Uani d 1 . .
    H H9B 0.9682 0.8140 0.4776 0.045 Uiso calc 1 . .
    C C5 1.5432(3) 0.20015(15) 0.32539(7) 0.0336(5) Uani d 1 . .
    C C14B 1.1719(3) 0.65226(15) 0.34653(9) 0.0398(6) Uani d 1 . .
    H H14A 1.1050 0.6456 0.3225 0.060 Uiso calc 1 . .
    H H14B 1.1343 0.6245 0.3714 0.060 Uiso calc 1 . .
    H H14C 1.2673 0.6315 0.3389 0.060 Uiso calc 1 . .
    C C16A 0.9779(3) 0.38418(15) 0.36961(7) 0.0333(5) Uani d 1 . .
    C C8 1.1602(3) 0.11518(14) 0.29940(8) 0.0318(5) Uani d 1 . .
    C C3A 1.4772(3) 0.41685(18) 0.51402(8) 0.0415(6) Uani d 1 . .
    H H3A1 1.5095 0.4715 0.5160 0.050 Uiso calc 1 . .
    H H3A2 1.5601 0.3838 0.5225 0.050 Uiso calc 1 . .
    C C12B 0.7612(3) 0.85432(16) 0.39610(8) 0.0396(6) Uani d 1 . .
    H H12C 0.6880 0.8328 0.3763 0.048 Uiso calc 1 . .
    H H12D 0.7111 0.8895 0.4162 0.048 Uiso calc 1 . .
    C C11A 1.0239(3) 0.52780(16) 0.51135(9) 0.0386(6) Uani d 1 . .
    H H11A 1.0138 0.5398 0.5421 0.046 Uiso calc 1 . .
    H H11B 1.0064 0.5760 0.4950 0.046 Uiso calc 1 . .
    C C2A 1.3501(3) 0.40409(17) 0.54694(8) 0.0384(6) Uani d 1 . .
    H H2A1 1.3526 0.3502 0.5577 0.046 Uiso calc 1 . .
    H H2A2 1.3624 0.4396 0.5715 0.046 Uiso calc 1 . .
    C C13A 0.8812(3) 0.32349(16) 0.47200(9) 0.0426(6) Uani d 1 . .
    H H13A 0.9347 0.2782 0.4616 0.064 Uiso calc 1 . .
    H H13B 0.8129 0.3409 0.4501 0.064 Uiso calc 1 . .
    H H13C 0.8276 0.3095 0.4978 0.064 Uiso calc 1 . .
    C C13 1.0527(3) 0.11491(17) 0.26134(9) 0.0419(6) Uani d 1 . .
    H H13D 1.1072 0.1127 0.2345 0.063 Uiso calc 1 . .
    H H13E 0.9940 0.1622 0.2620 0.063 Uiso calc 1 . .
    H H13F 0.9891 0.0696 0.2634 0.063 Uiso calc 1 . .
    C C10 1.3475(3) 0.11117(15) 0.36304(8) 0.0392(6) Uani d 1 . .
    H H10 1.4194 0.1062 0.3868 0.047 Uiso calc 1 . .
    C C8B 0.8356(3) 0.78670(15) 0.42139(7) 0.0327(5) Uani d 1 . .
    C C17A 0.8678(3) 0.41232(19) 0.33585(9) 0.0514(7) Uani d 1 . .
    H H17D 0.8667 0.3760 0.3118 0.077 Uiso calc 1 . .
    H H17E 0.8961 0.4639 0.3257 0.077 Uiso calc 1 . .
    H H17F 0.7708 0.4149 0.3486 0.077 Uiso calc 1 . .
    C C12 1.0776(3) 0.12117(16) 0.34338(8) 0.0394(6) Uani d 1 . .
    H H12E 1.0257 0.1713 0.3451 0.047 Uiso calc 1 . .
    H H12F 1.0050 0.0790 0.3455 0.047 Uiso calc 1 . .
    C C14 1.5592(3) 0.27036(16) 0.29424(8) 0.0390(6) Uani d 1 . .
    H H14D 1.5104 0.3157 0.3064 0.058 Uiso calc 1 . .
    H H14E 1.5149 0.2574 0.2668 0.058 Uiso calc 1 . .
    H H14F 1.6623 0.2820 0.2901 0.058 Uiso calc 1 . .
    C C9 1.2618(3) 0.04393(14) 0.29990(9) 0.0401(6) Uani d 1 . .
    H H9 1.2543 0.0034 0.2796 0.048 Uiso calc 1 . .
    C C4A 1.4388(3) 0.39866(15) 0.46613(7) 0.0338(5) Uani d 1 . .
    H H4A1 1.3770 0.3518 0.4658 0.041 Uiso calc 1 . .
    H H4A2 1.5303 0.3853 0.4513 0.041 Uiso calc 1 . .
    C C16 1.2149(3) 0.30401(14) 0.25332(7) 0.0317(5) Uani d 1 . .
    C C9A 1.1030(3) 0.36573(15) 0.51578(7) 0.0325(5) Uani d 1 . .
    H H9A 1.1016 0.3162 0.5289 0.039 Uiso calc 1 . .
    C C1 1.3629(3) 0.04340(15) 0.33164(9) 0.0419(6) Uani d 1 . .
    C C15A 1.4470(3) 0.54094(16) 0.44141(9) 0.0439(6) Uani d 1 . .
    H H15A 1.5490 0.5313 0.4343 0.066 Uiso calc 1 . .
    H H15B 1.4405 0.5621 0.4703 0.066 Uiso calc 1 . .
    H H15C 1.4060 0.5781 0.4211 0.066 Uiso calc 1 . .
    C C2B 1.2171(3) 0.87902(16) 0.44012(9) 0.0451(7) Uani d 1 . .
    H H2B1 1.2262 0.8684 0.4710 0.054 Uiso calc 1 . .
    H H2B2 1.2358 0.9348 0.4354 0.054 Uiso calc 1 . .
    C C15 1.6263(3) 0.22284(19) 0.36732(9) 0.0481(7) Uani d 1 . .
    H H15D 1.7295 0.2301 0.3609 0.072 Uiso calc 1 . .
    H H15E 1.6152 0.1814 0.3884 0.072 Uiso calc 1 . .
    H H15F 1.5860 0.2711 0.3787 0.072 Uiso calc 1 . .
    C C4B 1.2783(3) 0.74766(15) 0.39976(9) 0.0400(6) Uani d 1 . .
    H H4B1 1.2199 0.7248 0.4231 0.048 Uiso calc 1 . .
    H H4B2 1.3655 0.7148 0.3963 0.048 Uiso calc 1 . .
    C C14A 1.3623(3) 0.43624(16) 0.39113(8) 0.0365(6) Uani d 1 . .
    H H14G 1.3110 0.4744 0.3736 0.055 Uiso calc 1 . .
    H H14H 1.3144 0.3858 0.3886 0.055 Uiso calc 1 . .
    H H14I 1.4630 0.4319 0.3814 0.055 Uiso calc 1 . .
    C C3B 1.3303(3) 0.82954(18) 0.41482(11) 0.0523(8) Uani d 1 . .
    H H3B1 1.4172 0.8226 0.4330 0.063 Uiso calc 1 . .
    H H3B2 1.3605 0.8594 0.3894 0.063 Uiso calc 1 . .
    C C17 1.1539(4) 0.38749(16) 0.25564(9) 0.0561(8) Uani d 1 . .
    H H17G 1.2232 0.4235 0.2427 0.084 Uiso calc 1 . .
    H H17H 1.1383 0.4018 0.2855 0.084 Uiso calc 1 . .
    H H17I 1.0615 0.3900 0.2402 0.084 Uiso calc 1 . .
    C C13B 0.7265(3) 0.7406(2) 0.44942(9) 0.0511(7) Uani d 1 . .
    H H13G 0.7768 0.6972 0.4631 0.077 Uiso calc 1 . .
    H H13H 0.6478 0.7206 0.4315 0.077 Uiso calc 1 . .
    H H13I 0.6860 0.7749 0.4713 0.077 Uiso calc 1 . .
    C C11 1.1887(3) 0.11465(18) 0.38117(8) 0.0462(7) Uani d 1 . .
    H H11C 1.1785 0.1600 0.4002 0.055 Uiso calc 1 . .
    H H11D 1.1684 0.0673 0.3980 0.055 Uiso calc 1 . .
    C C3 1.6374(3) 0.05218(19) 0.33059(11) 0.0560(8) Uani d 1 . .
    H H3A 1.7218 0.0234 0.3192 0.067 Uiso calc 1 . .
    H H3B 1.6609 0.0673 0.3602 0.067 Uiso calc 1 . .
    C C11B 0.8777(3) 0.90048(14) 0.37048(8) 0.0390(6) Uani d 1 . .
    H H11E 0.8786 0.9551 0.3801 0.047 Uiso calc 1 . .
    H H11F 0.8527 0.8998 0.3398 0.047 Uiso calc 1 . .
    C C2 1.5042(4) -0.00377(18) 0.33162(13) 0.0609(9) Uani d 1 . .
    H H2A 1.5066 -0.0382 0.3064 0.073 Uiso calc 1 . .
    H H2B 1.5087 -0.0365 0.3575 0.073 Uiso calc 1 . .
    C C15B 1.2701(4) 0.7791(2) 0.31947(10) 0.0560(8) Uani d 1 . .
    H H15G 1.2692 0.8355 0.3228 0.084 Uiso calc 1 . .
    H H15H 1.2231 0.7650 0.2925 0.084 Uiso calc 1 . .
    H H15I 1.3707 0.7606 0.3193 0.084 Uiso calc 1 . .
_geom_special_details
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;
loop_
    _geom_bond_atom_site_label_1
    _geom_bond_atom_site_label_2
    _geom_bond_site_symmetry_2
    _geom_bond_distance
    _geom_bond_publ_flag
    O1 C16 . 1.234(3) ?
    O3 C16B . 1.237(3) ?
    N1 C16 . 1.336(3) ?
    N1 C7 . 1.459(3) ?
    N1 H1 . 0.8600 ?
    O2 C16A . 1.233(3) ?
    N2 C16A . 1.336(3) ?
    N2 C7A . 1.463(3) ?
    N2 H2 . 0.8600 ?
    N3 C16B . 1.341(3) ?
    N3 C7B . 1.463(3) ?
    N3 H3 . 0.8600 ?
    C8A C9A . 1.506(3) ?
    C8A C13A . 1.522(3) ?
    C8A C12A . 1.538(3) ?
    C8A C7A . 1.564(3) ?
    C10A C1A . 1.510(3) ?
    C10A C11A . 1.540(3) ?
    C10A C6A . 1.549(3) ?
    C10A H10A . 0.9800 ?
    C5A C15A . 1.537(3) ?
    C5A C14A . 1.540(3) ?
    C5A C4A . 1.544(3) ?
    C5A C6A . 1.558(3) ?
    C5B C15B . 1.531(4) ?
    C5B C14B . 1.542(3) ?
    C5B C4B . 1.549(4) ?
    C5B C6B . 1.552(3) ?
    C6 C10 . 1.544(3) ?
    C6 C5 . 1.557(3) ?
    C6 C7 . 1.561(3) ?
    C6 H6 . 0.9800 ?
    C1B C9B . 1.326(4) ?
    C1B C2B . 1.492(4) ?
    C1B C10B . 1.508(3) ?
    C16B C17B . 1.514(3) ?
    C17B H17A . 0.9600 ?
    C17B H17B . 0.9600 ?
    C17B H17C . 0.9600 ?
    C6B C10B . 1.543(3) ?
    C6B C7B . 1.557(3) ?
    C6B H6B . 0.9800 ?
    C7A C6A . 1.558(3) ?
    C7A H7A . 0.9800 ?
    C1A C9A . 1.329(4) ?
    C1A C2A . 1.492(3) ?
    C6A H6A . 0.9800 ?
    C7 C8 . 1.556(3) ?
    C7 H7 . 0.9800 ?
    C7B C8B . 1.568(3) ?
    C7B H7B . 0.9800 ?
    C12A C11A . 1.539(4) ?
    C12A H12A . 0.9700 ?
    C12A H12B . 0.9700 ?
    C10B C11B . 1.533(4) ?
    C10B H10B . 0.9800 ?
    C4 C5 . 1.543(4) ?
    C4 C3 . 1.543(4) ?
    C4 H4A . 0.9700 ?
    C4 H4B . 0.9700 ?
    C9B C8B . 1.509(3) ?
    C9B H9B . 0.9300 ?
    C5 C14 . 1.532(3) ?
    C5 C15 . 1.540(3) ?
    C14B H14A . 0.9600 ?
    C14B H14B . 0.9600 ?
    C14B H14C . 0.9600 ?
    C16A C17A . 1.514(4) ?
    C8 C9 . 1.514(3) ?
    C8 C13 . 1.520(3) ?
    C8 C12 . 1.547(3) ?
    C3A C4A . 1.543(3) ?
    C3A C2A . 1.545(4) ?
    C3A H3A1 . 0.9700 ?
    C3A H3A2 . 0.9700 ?
    C12B C11B . 1.528(4) ?
    C12B C8B . 1.537(3) ?
    C12B H12C . 0.9700 ?
    C12B H12D . 0.9700 ?
    C11A H11A . 0.9700 ?
    C11A H11B . 0.9700 ?
    C2A H2A1 . 0.9700 ?
    C2A H2A2 . 0.9700 ?
    C13A H13A . 0.9600 ?
    C13A H13B . 0.9600 ?
    C13A H13C . 0.9600 ?
    C13 H13D . 0.9600 ?
    C13 H13E . 0.9600 ?
    C13 H13F . 0.9600 ?
    C10 C1 . 1.505(4) ?
    C10 C11 . 1.539(4) ?
    C10 H10 . 0.9800 ?
    C8B C13B . 1.524(4) ?
    C17A H17D . 0.9600 ?
    C17A H17E . 0.9600 ?
    C17A H17F . 0.9600 ?
    C12 C11 . 1.539(4) ?
    C12 H12E . 0.9700 ?
    C12 H12F . 0.9700 ?
    C14 H14D . 0.9600 ?
    C14 H14E . 0.9600 ?
    C14 H14F . 0.9600 ?
    C9 C1 . 1.336(4) ?
    C9 H9 . 0.9300 ?
    C4A H4A1 . 0.9700 ?
    C4A H4A2 . 0.9700 ?
    C16 C17 . 1.517(4) ?
    C9A H9A . 0.9300 ?
    C1 C2 . 1.504(4) ?
    C15A H15A . 0.9600 ?
    C15A H15B . 0.9600 ?
    C15A H15C . 0.9600 ?
    C2B C3B . 1.533(4) ?
    C2B H2B1 . 0.9700 ?
    C2B H2B2 . 0.9700 ?
    C15 H15D . 0.9600 ?
    C15 H15E . 0.9600 ?
    C15 H15F . 0.9600 ?
    C4B C3B . 1.533(4) ?
    C4B H4B1 . 0.9700 ?
    C4B H4B2 . 0.9700 ?
    C14A H14G . 0.9600 ?
    C14A H14H . 0.9600 ?
    C14A H14I . 0.9600 ?
    C3B H3B1 . 0.9700 ?
    C3B H3B2 . 0.9700 ?
    C17 H17G . 0.9600 ?
    C17 H17H . 0.9600 ?
    C17 H17I . 0.9600 ?
    C13B H13G . 0.9600 ?
    C13B H13H . 0.9600 ?
    C13B H13I . 0.9600 ?
    C11 H11C . 0.9700 ?
    C11 H11D . 0.9700 ?
    C3 C2 . 1.530(5) ?
    C3 H3A . 0.9700 ?
    C3 H3B . 0.9700 ?
    C11B H11E . 0.9700 ?
    C11B H11F . 0.9700 ?
    C2 H2A . 0.9700 ?
    C2 H2B . 0.9700 ?
    C15B H15G . 0.9600 ?
    C15B H15H . 0.9600 ?
    C15B H15I . 0.9600 ?
loop_
    _geom_angle_atom_site_label_1
    _geom_angle_atom_site_label_2
    _geom_angle_atom_site_label_3
    _geom_angle_site_symmetry_1
    _geom_angle_site_symmetry_3
    _geom_angle
    _geom_angle_publ_flag
    C16 N1 C7 . . 123.34(18) ?
    C16 N1 H1 . . 118.3 ?
    C7 N1 H1 . . 118.3 ?
    C16A N2 C7A . . 123.41(19) ?
    C16A N2 H2 . . 118.3 ?
    C7A N2 H2 . . 118.3 ?
    C16B N3 C7B . . 124.11(18) ?
    C16B N3 H3 . . 117.9 ?
    C7B N3 H3 . . 117.9 ?
    C9A C8A C13A . . 112.4(2) ?
    C9A C8A C12A . . 109.02(19) ?
    C13A C8A C12A . . 111.75(19) ?
    C9A C8A C7A . . 103.46(17) ?
    C13A C8A C7A . . 111.35(18) ?
    C12A C8A C7A . . 108.52(19) ?
    C1A C10A C11A . . 109.5(2) ?
    C1A C10A C6A . . 106.04(17) ?
    C11A C10A C6A . . 109.11(19) ?
    C1A C10A H10A . . 110.7 ?
    C11A C10A H10A . . 110.7 ?
    C6A C10A H10A . . 110.7 ?
    C15A C5A C14A . . 106.9(2) ?
    C15A C5A C4A . . 110.0(2) ?
    C14A C5A C4A . . 107.63(19) ?
    C15A C5A C6A . . 108.62(19) ?
    C14A C5A C6A . . 109.12(19) ?
    C4A C5A C6A . . 114.34(19) ?
    C15B C5B C14B . . 106.6(2) ?
    C15B C5B C4B . . 110.1(2) ?
    C14B C5B C4B . . 107.3(2) ?
    C15B C5B C6B . . 108.7(2) ?
    C14B C5B C6B . . 109.17(19) ?
    C4B C5B C6B . . 114.59(19) ?
    C10 C6 C5 . . 113.5(2) ?
    C10 C6 C7 . . 107.23(19) ?
    C5 C6 C7 . . 114.29(17) ?
    C10 C6 H6 . . 107.1 ?
    C5 C6 H6 . . 107.1 ?
    C7 C6 H6 . . 107.1 ?
    C9B C1B C2B . . 126.5(2) ?
    C9B C1B C10B . . 113.7(2) ?
    C2B C1B C10B . . 118.1(2) ?
    O3 C16B N3 . . 123.5(2) ?
    O3 C16B C17B . . 121.9(2) ?
    N3 C16B C17B . . 114.6(2) ?
    C16B C17B H17A . . 109.5 ?
    C16B C17B H17B . . 109.5 ?
    H17A C17B H17B . . 109.5 ?
    C16B C17B H17C . . 109.5 ?
    H17A C17B H17C . . 109.5 ?
    H17B C17B H17C . . 109.5 ?
    C10B C6B C5B . . 112.75(19) ?
    C10B C6B C7B . . 107.50(18) ?
    C5B C6B C7B . . 115.53(17) ?
    C10B C6B H6B . . 106.9 ?
    C5B C6B H6B . . 106.9 ?
    C7B C6B H6B . . 106.9 ?
    N2 C7A C6A . . 111.84(17) ?
    N2 C7A C8A . . 111.92(17) ?
    C6A C7A C8A . . 110.75(17) ?
    N2 C7A H7A . . 107.4 ?
    C6A C7A H7A . . 107.4 ?
    C8A C7A H7A . . 107.4 ?
    C9A C1A C2A . . 125.9(2) ?
    C9A C1A C10A . . 113.3(2) ?
    C2A C1A C10A . . 119.1(2) ?
    C10A C6A C5A . . 112.72(18) ?
    C10A C6A C7A . . 107.68(17) ?
    C5A C6A C7A . . 114.81(17) ?
    C10A C6A H6A . . 107.1 ?
    C5A C6A H6A . . 107.1 ?
    C7A C6A H6A . . 107.1 ?
    N1 C7 C8 . . 113.79(18) ?
    N1 C7 C6 . . 109.92(17) ?
    C8 C7 C6 . . 111.06(17) ?
    N1 C7 H7 . . 107.3 ?
    C8 C7 H7 . . 107.3 ?
    C6 C7 H7 . . 107.3 ?
    N3 C7B C6B . . 109.80(16) ?
    N3 C7B C8B . . 111.28(18) ?
    C6B C7B C8B . . 111.14(18) ?
    N3 C7B H7B . . 108.2 ?
    C6B C7B H7B . . 108.2 ?
    C8B C7B H7B . . 108.2 ?
    C8A C12A C11A . . 109.77(18) ?
    C8A C12A H12A . . 109.7 ?
    C11A C12A H12A . . 109.7 ?
    C8A C12A H12B . . 109.7 ?
    C11A C12A H12B . . 109.7 ?
    H12A C12A H12B . . 108.2 ?
    C1B C10B C11B . . 109.4(2) ?
    C1B C10B C6B . . 106.23(18) ?
    C11B C10B C6B . . 108.7(2) ?
    C1B C10B H10B . . 110.8 ?
    C11B C10B H10B . . 110.8 ?
    C6B C10B H10B . . 110.8 ?
    C5 C4 C3 . . 118.1(2) ?
    C5 C4 H4A . . 107.8 ?
    C3 C4 H4A . . 107.8 ?
    C5 C4 H4B . . 107.8 ?
    C3 C4 H4B . . 107.8 ?
    H4A C4 H4B . . 107.1 ?
    C1B C9B C8B . . 115.7(2) ?
    C1B C9B H9B . . 122.2 ?
    C8B C9B H9B . . 122.2 ?
    C14 C5 C15 . . 106.5(2) ?
    C14 C5 C4 . . 107.3(2) ?
    C15 C5 C4 . . 110.6(2) ?
    C14 C5 C6 . . 109.7(2) ?
    C15 C5 C6 . . 108.7(2) ?
    C4 C5 C6 . . 113.8(2) ?
    C5B C14B H14A . . 109.5 ?
    C5B C14B H14B . . 109.5 ?
    H14A C14B H14B . . 109.5 ?
    C5B C14B H14C . . 109.5 ?
    H14A C14B H14C . . 109.5 ?
    H14B C14B H14C . . 109.5 ?
    O2 C16A N2 . . 123.0(2) ?
    O2 C16A C17A . . 121.9(2) ?
    N2 C16A C17A . . 115.2(2) ?
    C9 C8 C13 . . 113.1(2) ?
    C9 C8 C12 . . 109.6(2) ?
    C13 C8 C12 . . 111.4(2) ?
    C9 C8 C7 . . 102.04(17) ?
    C13 C8 C7 . . 111.51(19) ?
    C12 C8 C7 . . 108.78(19) ?
    C4A C3A C2A . . 115.5(2) ?
    C4A C3A H3A1 . . 108.4 ?
    C2A C3A H3A1 . . 108.4 ?
    C4A C3A H3A2 . . 108.4 ?
    C2A C3A H3A2 . . 108.4 ?
    H3A1 C3A H3A2 . . 107.5 ?
    C11B C12B C8B . . 109.9(2) ?
    C11B C12B H12C . . 109.7 ?
    C8B C12B H12C . . 109.7 ?
    C11B C12B H12D . . 109.7 ?
    C8B C12B H12D . . 109.7 ?
    H12C C12B H12D . . 108.2 ?
    C12A C11A C10A . . 109.92(19) ?
    C12A C11A H11A . . 109.7 ?
    C10A C11A H11A . . 109.7 ?
    C12A C11A H11B . . 109.7 ?
    C10A C11A H11B . . 109.7 ?
    H11A C11A H11B . . 108.2 ?
    C1A C2A C3A . . 109.58(19) ?
    C1A C2A H2A1 . . 109.8 ?
    C3A C2A H2A1 . . 109.8 ?
    C1A C2A H2A2 . . 109.8 ?
    C3A C2A H2A2 . . 109.8 ?
    H2A1 C2A H2A2 . . 108.2 ?
    C8A C13A H13A . . 109.5 ?
    C8A C13A H13B . . 109.5 ?
    H13A C13A H13B . . 109.5 ?
    C8A C13A H13C . . 109.5 ?
    H13A C13A H13C . . 109.5 ?
    H13B C13A H13C . . 109.5 ?
    C8 C13 H13D . . 109.5 ?
    C8 C13 H13E . . 109.5 ?
    H13D C13 H13E . . 109.5 ?
    C8 C13 H13F . . 109.5 ?
    H13D C13 H13F . . 109.5 ?
    H13E C13 H13F . . 109.5 ?
    C1 C10 C11 . . 110.4(2) ?
    C1 C10 C6 . . 106.18(19) ?
    C11 C10 C6 . . 108.6(2) ?
    C1 C10 H10 . . 110.5 ?
    C11 C10 H10 . . 110.5 ?
    C6 C10 H10 . . 110.5 ?
    C9B C8B C13B . . 112.3(2) ?
    C9B C8B C12B . . 108.8(2) ?
    C13B C8B C12B . . 112.6(2) ?
    C9B C8B C7B . . 103.50(18) ?
    C13B C8B C7B . . 111.3(2) ?
    C12B C8B C7B . . 107.83(18) ?
    C16A C17A H17D . . 109.5 ?
    C16A C17A H17E . . 109.5 ?
    H17D C17A H17E . . 109.5 ?
    C16A C17A H17F . . 109.5 ?
    H17D C17A H17F . . 109.5 ?
    H17E C17A H17F . . 109.5 ?
    C11 C12 C8 . . 109.9(2) ?
    C11 C12 H12E . . 109.7 ?
    C8 C12 H12E . . 109.7 ?
    C11 C12 H12F . . 109.7 ?
    C8 C12 H12F . . 109.7 ?
    H12E C12 H12F . . 108.2 ?
    C5 C14 H14D . . 109.5 ?
    C5 C14 H14E . . 109.5 ?
    H14D C14 H14E . . 109.5 ?
    C5 C14 H14F . . 109.5 ?
    H14D C14 H14F . . 109.5 ?
    H14E C14 H14F . . 109.5 ?
    C1 C9 C8 . . 115.3(2) ?
    C1 C9 H9 . . 122.4 ?
    C8 C9 H9 . . 122.4 ?
    C3A C4A C5A . . 118.6(2) ?
    C3A C4A H4A1 . . 107.7 ?
    C5A C4A H4A1 . . 107.7 ?
    C3A C4A H4A2 . . 107.7 ?
    C5A C4A H4A2 . . 107.7 ?
    H4A1 C4A H4A2 . . 107.1 ?
    O1 C16 N1 . . 124.2(2) ?
    O1 C16 C17 . . 120.5(2) ?
    N1 C16 C17 . . 115.3(2) ?
    C1A C9A C8A . . 115.9(2) ?
    C1A C9A H9A . . 122.1 ?
    C8A C9A H9A . . 122.1 ?
    C9 C1 C2 . . 125.6(3) ?
    C9 C1 C10 . . 113.6(2) ?
    C2 C1 C10 . . 118.8(3) ?
    C5A C15A H15A . . 109.5 ?
    C5A C15A H15B . . 109.5 ?
    H15A C15A H15B . . 109.5 ?
    C5A C15A H15C . . 109.5 ?
    H15A C15A H15C . . 109.5 ?
    H15B C15A H15C . . 109.5 ?
    C1B C2B C3B . . 109.4(2) ?
    C1B C2B H2B1 . . 109.8 ?
    C3B C2B H2B1 . . 109.8 ?
    C1B C2B H2B2 . . 109.8 ?
    C3B C2B H2B2 . . 109.8 ?
    H2B1 C2B H2B2 . . 108.2 ?
    C5 C15 H15D . . 109.5 ?
    C5 C15 H15E . . 109.5 ?
    H15D C15 H15E . . 109.5 ?
    C5 C15 H15F . . 109.5 ?
    H15D C15 H15F . . 109.5 ?
    H15E C15 H15F . . 109.5 ?
    C3B C4B C5B . . 118.9(2) ?
    C3B C4B H4B1 . . 107.6 ?
    C5B C4B H4B1 . . 107.6 ?
    C3B C4B H4B2 . . 107.6 ?
    C5B C4B H4B2 . . 107.6 ?
    H4B1 C4B H4B2 . . 107.0 ?
    C5A C14A H14G . . 109.5 ?
    C5A C14A H14H . . 109.5 ?
    H14G C14A H14H . . 109.5 ?
    C5A C14A H14I . . 109.5 ?
    H14G C14A H14I . . 109.5 ?
    H14H C14A H14I . . 109.5 ?
    C2B C3B C4B . . 116.2(2) ?
    C2B C3B H3B1 . . 108.2 ?
    C4B C3B H3B1 . . 108.2 ?
    C2B C3B H3B2 . . 108.2 ?
    C4B C3B H3B2 . . 108.2 ?
    H3B1 C3B H3B2 . . 107.4 ?
    C16 C17 H17G . . 109.5 ?
    C16 C17 H17H . . 109.5 ?
    H17G C17 H17H . . 109.5 ?
    C16 C17 H17I . . 109.5 ?
    H17G C17 H17I . . 109.5 ?
    H17H C17 H17I . . 109.5 ?
    C8B C13B H13G . . 109.5 ?
    C8B C13B H13H . . 109.5 ?
    H13G C13B H13H . . 109.5 ?
    C8B C13B H13I . . 109.5 ?
    H13G C13B H13I . . 109.5 ?
    H13H C13B H13I . . 109.5 ?
    C10 C11 C12 . . 109.66(19) ?
    C10 C11 H11C . . 109.7 ?
    C12 C11 H11C . . 109.7 ?
    C10 C11 H11D . . 109.7 ?
    C12 C11 H11D . . 109.7 ?
    H11C C11 H11D . . 108.2 ?
    C2 C3 C4 . . 115.7(2) ?
    C2 C3 H3A . . 108.3 ?
    C4 C3 H3A . . 108.3 ?
    C2 C3 H3B . . 108.3 ?
    C4 C3 H3B . . 108.3 ?
    H3A C3 H3B . . 107.4 ?
    C12B C11B C10B . . 110.48(19) ?
    C12B C11B H11E . . 109.6 ?
    C10B C11B H11E . . 109.6 ?
    C12B C11B H11F . . 109.6 ?
    C10B C11B H11F . . 109.6 ?
    H11E C11B H11F . . 108.1 ?
    C1 C2 C3 . . 109.8(2) ?
    C1 C2 H2A . . 109.7 ?
    C3 C2 H2A . . 109.7 ?
    C1 C2 H2B . . 109.7 ?
    C3 C2 H2B . . 109.7 ?
    H2A C2 H2B . . 108.2 ?
    C5B C15B H15G . . 109.5 ?
    C5B C15B H15H . . 109.5 ?
    H15G C15B H15H . . 109.5 ?
    C5B C15B H15I . . 109.5 ?
    H15G C15B H15I . . 109.5 ?
    H15H C15B H15I . . 109.5 ?
loop_
    _geom_torsion_atom_site_label_1
    _geom_torsion_atom_site_label_2
    _geom_torsion_atom_site_label_3
    _geom_torsion_atom_site_label_4
    _geom_torsion_site_symmetry_1
    _geom_torsion_site_symmetry_2
    _geom_torsion_site_symmetry_3
    _geom_torsion_site_symmetry_4
    _geom_torsion
    _geom_torsion_publ_flag
    C7B N3 C16B O3 . . . . -3.5(3) ?
    C7B N3 C16B C17B . . . . 175.87(19) ?
    C15B C5B C6B C10B . . . . -72.3(3) ?
    C14B C5B C6B C10B . . . . 171.80(19) ?
    C4B C5B C6B C10B . . . . 51.4(3) ?
    C15B C5B C6B C7B . . . . 163.6(2) ?
    C14B C5B C6B C7B . . . . 47.6(3) ?
    C4B C5B C6B C7B . . . . -72.7(2) ?
    C16A N2 C7A C6A . . . . 128.1(2) ?
    C16A N2 C7A C8A . . . . -106.9(2) ?
    C9A C8A C7A N2 . . . . 175.83(18) ?
    C13A C8A C7A N2 . . . . 54.9(2) ?
    C12A C8A C7A N2 . . . . -68.5(2) ?
    C9A C8A C7A C6A . . . . -58.6(2) ?
    C13A C8A C7A C6A . . . . -179.54(19) ?
    C12A C8A C7A C6A . . . . 57.1(2) ?
    C11A C10A C1A C9A . . . . 54.5(2) ?
    C6A C10A C1A C9A . . . . -63.1(2) ?
    C11A C10A C1A C2A . . . . -139.4(2) ?
    C6A C10A C1A C2A . . . . 103.0(2) ?
    C1A C10A C6A C5A . . . . -72.7(2) ?
    C11A C10A C6A C5A . . . . 169.4(2) ?
    C1A C10A C6A C7A . . . . 54.9(2) ?
    C11A C10A C6A C7A . . . . -62.9(2) ?
    C15A C5A C6A C10A . . . . -70.3(2) ?
    C14A C5A C6A C10A . . . . 173.54(19) ?
    C4A C5A C6A C10A . . . . 53.0(3) ?
    C15A C5A C6A C7A . . . . 165.91(19) ?
    C14A C5A C6A C7A . . . . 49.7(2) ?
    C4A C5A C6A C7A . . . . -70.8(2) ?
    N2 C7A C6A C10A . . . . 129.69(18) ?
    C8A C7A C6A C10A . . . . 4.1(2) ?
    N2 C7A C6A C5A . . . . -103.9(2) ?
    C8A C7A C6A C5A . . . . 130.54(19) ?
    C16 N1 C7 C8 . . . . -112.4(2) ?
    C16 N1 C7 C6 . . . . 122.3(2) ?
    C10 C6 C7 N1 . . . . 135.11(19) ?
    C5 C6 C7 N1 . . . . -98.2(2) ?
    C10 C6 C7 C8 . . . . 8.3(2) ?
    C5 C6 C7 C8 . . . . 135.0(2) ?
    C16B N3 C7B C6B . . . . 136.5(2) ?
    C16B N3 C7B C8B . . . . -100.0(2) ?
    C10B C6B C7B N3 . . . . 126.08(18) ?
    C5B C6B C7B N3 . . . . -107.1(2) ?
    C10B C6B C7B C8B . . . . 2.5(2) ?
    C5B C6B C7B C8B . . . . 129.40(19) ?
    C9A C8A C12A C11A . . . . 51.1(3) ?
    C13A C8A C12A C11A . . . . 176.0(2) ?
    C7A C8A C12A C11A . . . . -60.9(2) ?
    C9B C1B C10B C11B . . . . 54.7(3) ?
    C2B C1B C10B C11B . . . . -138.9(2) ?
    C9B C1B C10B C6B . . . . -62.5(3) ?
    C2B C1B C10B C6B . . . . 103.8(2) ?
    C5B C6B C10B C1B . . . . -72.8(2) ?
    C7B C6B C10B C1B . . . . 55.7(2) ?
    C5B C6B C10B C11B . . . . 169.54(19) ?
    C7B C6B C10B C11B . . . . -62.0(2) ?
    C2B C1B C9B C8B . . . . -163.1(2) ?
    C10B C1B C9B C8B . . . . 1.9(3) ?
    C3 C4 C5 C14 . . . . 171.3(2) ?
    C3 C4 C5 C15 . . . . 55.5(3) ?
    C3 C4 C5 C6 . . . . -67.2(3) ?
    C10 C6 C5 C14 . . . . 172.6(2) ?
    C7 C6 C5 C14 . . . . 49.2(3) ?
    C10 C6 C5 C15 . . . . -71.2(3) ?
    C7 C6 C5 C15 . . . . 165.4(2) ?
    C10 C6 C5 C4 . . . . 52.5(3) ?
    C7 C6 C5 C4 . . . . -70.9(3) ?
    C7A N2 C16A O2 . . . . -4.9(4) ?
    C7A N2 C16A C17A . . . . 174.9(2) ?
    N1 C7 C8 C9 . . . . 173.33(19) ?
    C6 C7 C8 C9 . . . . -62.0(2) ?
    N1 C7 C8 C13 . . . . 52.3(2) ?
    C6 C7 C8 C13 . . . . 177.01(19) ?
    N1 C7 C8 C12 . . . . -70.9(2) ?
    C6 C7 C8 C12 . . . . 53.7(2) ?
    C8A C12A C11A C10A . . . . 3.0(3) ?
    C1A C10A C11A C12A . . . . -55.8(3) ?
    C6A C10A C11A C12A . . . . 59.9(3) ?
    C9A C1A C2A C3A . . . . 110.7(3) ?
    C10A C1A C2A C3A . . . . -53.5(3) ?
    C4A C3A C2A C1A . . . . -30.7(3) ?
    C5 C6 C10 C1 . . . . -74.6(3) ?
    C7 C6 C10 C1 . . . . 52.6(2) ?
    C5 C6 C10 C11 . . . . 166.7(2) ?
    C7 C6 C10 C11 . . . . -66.1(2) ?
    C1B C9B C8B C13B . . . . 177.7(2) ?
    C1B C9B C8B C12B . . . . -56.9(3) ?
    C1B C9B C8B C7B . . . . 57.6(3) ?
    C11B C12B C8B C9B . . . . 52.1(2) ?
    C11B C12B C8B C13B . . . . 177.3(2) ?
    C11B C12B C8B C7B . . . . -59.6(2) ?
    N3 C7B C8B C9B . . . . 179.91(18) ?
    C6B C7B C8B C9B . . . . -57.4(2) ?
    N3 C7B C8B C13B . . . . 59.1(2) ?
    C6B C7B C8B C13B . . . . -178.22(19) ?
    N3 C7B C8B C12B . . . . -64.9(2) ?
    C6B C7B C8B C12B . . . . 57.8(2) ?
    C9 C8 C12 C11 . . . . 49.7(3) ?
    C13 C8 C12 C11 . . . . 175.5(2) ?
    C7 C8 C12 C11 . . . . -61.1(3) ?
    C13 C8 C9 C1 . . . . 177.0(2) ?
    C12 C8 C9 C1 . . . . -58.0(3) ?
    C7 C8 C9 C1 . . . . 57.1(3) ?
    C2A C3A C4A C5A . . . . 83.0(3) ?
    C15A C5A C4A C3A . . . . 53.1(3) ?
    C14A C5A C4A C3A . . . . 169.2(2) ?
    C6A C5A C4A C3A . . . . -69.4(3) ?
    C7 N1 C16 O1 . . . . 7.7(4) ?
    C7 N1 C16 C17 . . . . -171.3(2) ?
    C2A C1A C9A C8A . . . . -161.7(2) ?
    C10A C1A C9A C8A . . . . 3.3(3) ?
    C13A C8A C9A C1A . . . . 177.5(2) ?
    C12A C8A C9A C1A . . . . -58.0(3) ?
    C7A C8A C9A C1A . . . . 57.3(2) ?
    C8 C9 C1 C2 . . . . -159.1(2) ?
    C8 C9 C1 C10 . . . . 4.8(3) ?
    C11 C10 C1 C9 . . . . 53.5(3) ?
    C6 C10 C1 C9 . . . . -64.0(3) ?
    C11 C10 C1 C2 . . . . -141.5(2) ?
    C6 C10 C1 C2 . . . . 101.0(3) ?
    C9B C1B C2B C3B . . . . 110.3(3) ?
    C10B C1B C2B C3B . . . . -54.0(3) ?
    C15B C5B C4B C3B . . . . 55.3(3) ?
    C14B C5B C4B C3B . . . . 171.0(2) ?
    C6B C5B C4B C3B . . . . -67.6(3) ?
    C1B C2B C3B C4B . . . . -30.3(4) ?
    C5B C4B C3B C2B . . . . 82.4(3) ?
    C1 C10 C11 C12 . . . . -56.6(3) ?
    C6 C10 C11 C12 . . . . 59.4(3) ?
    C8 C12 C11 C10 . . . . 4.6(3) ?
    C5 C4 C3 C2 . . . . 85.2(4) ?
    C8B C12B C11B C10B . . . . 1.3(3) ?
    C1B C10B C11B C12B . . . . -54.3(3) ?
    C6B C10B C11B C12B . . . . 61.3(2) ?
    C9 C1 C2 C3 . . . . 114.8(3) ?
    C10 C1 C2 C3 . . . . -48.3(4) ?
    C4 C3 C2 C1 . . . . -35.8(4) ?
loop_
    _geom_hbond_atom_site_label_D
    _geom_hbond_atom_site_label_H
    _geom_hbond_atom_site_label_A
    _geom_hbond_site_symmetry_A
    _geom_hbond_distance_DH
    _geom_hbond_distance_HA
    _geom_hbond_distance_DA
    _geom_hbond_angle_DHA
    N1 H1 O2 . 0.86 2.04 2.893(2) 173.4
    N2 H2 O3 . 0.86 2.11 2.956(3) 166.7
    N3 H3 O1 3_755 0.86 2.06 2.909(2) 169.0
data_block
_journal_date_recd_electronic     2017-05-28
_journal_date_accepted     2017-05-30
_journal_name_full     'IUCrData'
_journal_year     2017
_journal_volume     2
_journal_issue      6
_journal_page_first     0
_journal_page_last     0
_journal_paper_category     HO
_journal_paper_doi     10.1107/S2414314617008057
_journal_coeditor_code     SJ4115
_publ_contact_author_name     'Pr Benharref Ahmed'
_publ_contact_author_address
;
Laboratoire de Chimie des Substances Naturelles
"Unité Associé au CNRST (URAC16)"
Faculté des Sciences Semlalia,
BP 2390 Bd My Abdellah,
Université Cadi Ayyad
40000 Marrakech, Morocco
;
_publ_contact_author_email     'benharref@uca.ac.ma'
_publ_contact_author_fax     '0021224437408'
_publ_contact_author_phone     '0021224434649'
_publ_section_title
;
N-[1,4,4-Trimethyltricyclo[6.3.1.0^3,9^]dodec-8(12)-en-2-yl]acetamide
;
loop_
    _publ_author_name
    _publ_author_address
    'Mazoir, Noureddine'
;
Laboratoire de Chimie des Substances Naturelles
"Unité Associé au CNRST (URAC16)"
Faculté des Sciences Semlalia,
BP 2390 Bd My Abdellah,
Université Cadi Ayyad
40000 Marrakech, Morocco
;
    'Benharref,Ahmed'
;
Laboratoire de Chimie des Substances Naturelles
"Unité Associé au CNRST (URAC16)"
Faculté des Sciences Semlalia,
BP 2390 Bd My Abdellah,
Université Cadi Ayyad
40000 Marrakech, Morocco
;
    'Daran, Jean-Claude'
;
Laboratoire de Chimie de Coordination, 205 route de Narbonne,
 31077 Toulouse Cedex 04, France
;
    'Oukhrib, Abdelouahd '
;
Laboratoire de Chimie des Substances Naturelles
"Unité Associé au CNRST (URAC16)"
Faculté des Sciences Semlalia,
BP 2390 Bd My Abdellah,
Université Cadi Ayyad
40000 Marrakech, Morocco
;
    'Ait Elhad, Mustapha'
;
Laboratoire de Chimie des Substances Naturelles
"Unité Associé au CNRST (URAC16)"
Faculté des Sciences Semlalia,
BP 2390 Bd My Abdellah,
Université Cadi Ayyad
40000 Marrakech, Morocco
;
    'Berraho, Moha'
;
Laboratoire de Chimie des Substances Naturelles
"Unité Associé au CNRST (URAC16)"
Faculté des Sciences Semlalia,
BP 2390 Bd My Abdellah,
Université Cadi Ayyad
40000 Marrakech, Morocco
;
_publ_section_synopsis
;
The asymmetric unit of the title compound contains three independent molecules
with almost identical conformations.
;
