##############################################################################
###                                                                        ###
###           Full Paper (Acta Crystallographica Section C)                ###
###                                                                        ###
##############################################################################
#                                                                            #
# This CIF contains the data in a paper accepted for publication in Acta     #
# Crystallographica Section C. It conforms to the editorial and technical    #
# requirements of Notes for Authors for Section C, and has been peer         #
# reviewed under the auspices of the IUCr Commission on Journals.            #
#                                                                            #
# 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. The current version number is 2.1.    #
#                                                                            #
# Software is freely available for graphical display of the structure(s) in  #
# this CIF.  For information consult the CIF home page http://www.iucr.org/  #
# cif/home.html                                                              #
#                                                                            #
#            Copyright International Union of Crystallography                #
#                                                                            #
##############################################################################
data_I
_audit_creation_method     SHELXL97
_chemical_name_systematic
;
Di-tert-butyl ketone hydrazone
;
_chemical_name_common     ?
_chemical_formula_moiety     'C9 H20 N2'
_chemical_formula_sum     'C9 H20 N2'
_chemical_formula_iupac     'C9 H20 N2'
_chemical_formula_weight     156.27
_chemical_melting_point     ?
_symmetry_cell_setting     monoclinic
_symmetry_space_group_name_H-M     'P 21/c'
_symmetry_space_group_name_Hall     '-P 2ybc'
loop_
    _symmetry_equiv_pos_as_xyz
    'x, y, z'
    '-x, y+1/2, -z+1/2'
    '-x, -y, -z'
    'x, -y-1/2, z-1/2'
_cell_length_a     11.5299(8)
_cell_length_b     8.0975(4)
_cell_length_c     10.8937(8)
_cell_angle_alpha     90.00
_cell_angle_beta     101.111(3)
_cell_angle_gamma     90.00
_cell_volume     998.01(11)
_cell_formula_units_Z     4
_cell_measurement_reflns_used     23020
_cell_measurement_theta_min     3.09
_cell_measurement_theta_max     25.67
_cell_measurement_temperature     100(2)
_exptl_crystal_description     irregular
_exptl_crystal_colour     colourless
_exptl_crystal_size_max     0.23
_exptl_crystal_size_mid     0.19
_exptl_crystal_size_min     0.16
_exptl_crystal_density_diffrn     1.040
_exptl_crystal_density_meas     ?
_exptl_crystal_density_method     ?
_exptl_crystal_F_000     352
_exptl_absorpt_coefficient_mu     0.062
_exptl_absorpt_correction_type     none
_exptl_special_details     'crystal-to-detector distance 30 mm'
_diffrn_ambient_temperature     100(2)
_diffrn_radiation_type     MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_source     'fine-focus sealed tube'
_diffrn_radiation_monochromator     graphite
_diffrn_measurement_device_type     'Nonius KappaCCD area-detector'
_diffrn_measurement_method     'two φ and two ω scans with 2° steps'
_diffrn_reflns_number     23020
_diffrn_reflns_av_R_equivalents     0.0382
_diffrn_reflns_theta_min     3.09
_diffrn_reflns_theta_max     25.67
_diffrn_reflns_theta_full     25.67
_diffrn_measured_fraction_theta_max     0.995
_diffrn_measured_fraction_theta_full     0.995
_diffrn_reflns_limit_h_min     -14
_diffrn_reflns_limit_h_max     13
_diffrn_reflns_limit_k_min     -9
_diffrn_reflns_limit_k_max     0
_diffrn_reflns_limit_l_min     0
_diffrn_reflns_limit_l_max     13
_diffrn_standards_number     0
_diffrn_standards_interval_time     0
_diffrn_standards_decay_%     0
_refine_special_details
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;
_reflns_number_total     1884
_reflns_number_gt     1717
_reflns_threshold_expression     I>2σ(I)
_refine_ls_structure_factor_coef     Fsqd
_refine_ls_matrix_type     full
_refine_ls_R_factor_all     0.0427
_refine_ls_R_factor_gt     0.0389
_refine_ls_wR_factor_gt     0.1021
_refine_ls_wR_factor_ref     0.1049
_refine_ls_goodness_of_fit_ref     1.035
_refine_ls_restrained_S_all     1.035
_refine_ls_number_reflns     1884
_refine_ls_number_parameters     112
_refine_ls_number_restraints     0
_refine_ls_hydrogen_treatment     mixed
_refine_ls_weighting_scheme     calc
_refine_ls_weighting_details
       'calc w = 1/[σ²(Fo²)+(0.0544P)²+0.3197P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary     difmap
_refine_ls_shift/su_max     0.000
_refine_ls_shift/su_mean     0.000
_refine_diff_density_max     0.268
_refine_diff_density_min     -0.147
_refine_ls_extinction_method     none
_refine_ls_extinction_coef     ?
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'
    'N' 'N' 0.0061 0.0033
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
_computing_data_collection     'COLLECT (Nonius, 1998)'
_computing_cell_refinement     'HKL2000 (Otwinowski & Minor, 1997)'
_computing_data_reduction     'HKL2000'
_computing_structure_solution     'SHELXS97 (Sheldrick, 1997)'
_computing_structure_refinement     'SHELXL97 (Sheldrick, 1997)'
_computing_molecular_graphics     'SHELXTL (Bruker, 1999)'
_computing_publication_material     'SHELXTL and PLATON (Spek, 2003)'
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_refinement_flags
    _atom_site_occupancy
    _atom_site_disorder_assembly
    _atom_site_disorder_group
    N N1 0.12987(9) 0.09362(13) 0.01219(9) 0.0245(2) Uani d . 1 . .
    H H1 0.0533(13) 0.1035(17) -0.0336(13) 0.029 Uiso d . 1 . .
    H H2 0.1610(12) 0.1948(19) 0.0312(13) 0.029 Uiso d . 1 . .
    N N2 0.12725(8) -0.01011(11) 0.11434(8) 0.0206(2) Uani d . 1 . .
    C C1 0.20987(9) -0.01413(13) 0.21226(10) 0.0192(2) Uani d . 1 . .
    C C2 0.32112(9) 0.09921(13) 0.23046(10) 0.0218(3) Uani d . 1 . .
    C C3 0.28322(11) 0.27995(14) 0.24534(11) 0.0276(3) Uani d . 1 . .
    H H3A 0.3505 0.3512 0.2504 0.041 Uiso calc R 1 . .
    H H3B 0.2516 0.2903 0.3203 0.041 Uiso calc R 1 . .
    H H3C 0.2239 0.3107 0.1745 0.041 Uiso calc R 1 . .
    C C4 0.41908(11) 0.06408(16) 0.34566(11) 0.0306(3) Uani d . 1 . .
    H H4A 0.4808 0.1447 0.3500 0.046 Uiso calc R 1 . .
    H H4B 0.4510 -0.0442 0.3384 0.046 Uiso calc R 1 . .
    H H4C 0.3864 0.0699 0.4202 0.046 Uiso calc R 1 . .
    C C5 0.38405(10) 0.07964(15) 0.11793(11) 0.0282(3) Uani d . 1 . .
    H H5A 0.4509 0.1525 0.1282 0.042 Uiso calc R 1 . .
    H H5B 0.3300 0.1067 0.0420 0.042 Uiso calc R 1 . .
    H H5C 0.4103 -0.0324 0.1138 0.042 Uiso calc R 1 . .
    C C6 0.18503(9) -0.14007(14) 0.31124(10) 0.0222(3) Uani d . 1 . .
    C C7 0.28249(11) -0.27168(15) 0.34220(13) 0.0333(3) Uani d . 1 . .
    H H7A 0.3503 -0.2246 0.3959 0.050 Uiso calc R 1 . .
    H H7B 0.3043 -0.3094 0.2663 0.050 Uiso calc R 1 . .
    H H7C 0.2537 -0.3631 0.3838 0.050 Uiso calc R 1 . .
    C C8 0.16816(11) -0.05157(17) 0.43156(11) 0.0321(3) Uani d . 1 . .
    H H8A 0.1509 -0.1315 0.4906 0.048 Uiso calc R 1 . .
    H H8B 0.1038 0.0252 0.4122 0.048 Uiso calc R 1 . .
    H H8C 0.2392 0.0068 0.4670 0.048 Uiso calc R 1 . .
    C C9 0.06898(10) -0.23344(15) 0.26280(11) 0.0290(3) Uani d . 1 . .
    H H9A 0.0751 -0.2920 0.1877 0.044 Uiso calc R 1 . .
    H H9B 0.0048 -0.1561 0.2453 0.044 Uiso calc R 1 . .
    H H9C 0.0547 -0.3105 0.3252 0.044 Uiso calc R 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
    N1 N2 . 1.3992(13) yes
    N1 H1 . 0.930(15) ?
    N1 H2 . 0.903(16) ?
    C1 N2 . 1.2864(14) yes
    C1 C2 . 1.5585(14) yes
    C1 C6 . 1.5504(15) yes
    C2 C3 . 1.5448(16) ?
    C2 C4 . 1.5444(15) ?
    C2 C5 . 1.5482(15) ?
    C3 H3A . 0.9600 ?
    C3 H3B . 0.9600 ?
    C3 H3C . 0.9600 ?
    C4 H4A . 0.9600 ?
    C4 H4B . 0.9600 ?
    C4 H4C . 0.9600 ?
    C5 H5A . 0.9600 ?
    C5 H5B . 0.9600 ?
    C5 H5C . 0.9600 ?
    C6 C7 . 1.5382(15) ?
    C6 C9 . 1.5389(15) ?
    C6 C8 . 1.5387(16) ?
    C7 H7A . 0.9600 ?
    C7 H7B . 0.9600 ?
    C7 H7C . 0.9600 ?
    C8 H8A . 0.9600 ?
    C8 H8B . 0.9600 ?
    C8 H8C . 0.9600 ?
    C9 H9A . 0.9600 ?
    C9 H9B . 0.9600 ?
    C9 H9C . 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
    N2 N1 H1 . . 108.4(8) ?
    N2 N1 H2 . . 115.5(9) ?
    H1 N1 H2 . . 109.8(12) ?
    N1 N2 C1 . . 123.28(9) yes
    N2 C1 C2 . . 123.39(9) yes
    N2 C1 C6 . . 112.76(9) yes
    C2 C1 C6 . . 123.83(9) yes
    C3 C2 C4 . . 105.46(9) ?
    C3 C2 C5 . . 111.43(9) ?
    C4 C2 C5 . . 104.10(9) ?
    C3 C2 C1 . . 109.19(9) ?
    C4 C2 C1 . . 116.74(9) ?
    C5 C2 C1 . . 109.80(9) ?
    C2 C3 H3A . . 109.5 ?
    C2 C3 H3B . . 109.5 ?
    H3A C3 H3B . . 109.5 ?
    C2 C3 H3C . . 109.5 ?
    H3A C3 H3C . . 109.5 ?
    H3B C3 H3C . . 109.5 ?
    C2 C4 H4A . . 109.5 ?
    C2 C4 H4B . . 109.5 ?
    H4A C4 H4B . . 109.5 ?
    C2 C4 H4C . . 109.5 ?
    H4A C4 H4C . . 109.5 ?
    H4B C4 H4C . . 109.5 ?
    C2 C5 H5A . . 109.5 ?
    C2 C5 H5B . . 109.5 ?
    H5A C5 H5B . . 109.5 ?
    C2 C5 H5C . . 109.5 ?
    H5A C5 H5C . . 109.5 ?
    H5B C5 H5C . . 109.5 ?
    C7 C6 C9 . . 106.56(10) ?
    C7 C6 C8 . . 110.05(10) ?
    C9 C6 C8 . . 106.06(9) ?
    C7 C6 C1 . . 112.53(9) ?
    C9 C6 C1 . . 110.46(9) ?
    C8 C6 C1 . . 110.90(9) ?
    C6 C7 H7A . . 109.5 ?
    C6 C7 H7B . . 109.5 ?
    H7A C7 H7B . . 109.5 ?
    C6 C7 H7C . . 109.5 ?
    H7A C7 H7C . . 109.5 ?
    H7B C7 H7C . . 109.5 ?
    C6 C8 H8A . . 109.5 ?
    C6 C8 H8B . . 109.5 ?
    H8A C8 H8B . . 109.5 ?
    C6 C8 H8C . . 109.5 ?
    H8A C8 H8C . . 109.5 ?
    H8B C8 H8C . . 109.5 ?
    C6 C9 H9A . . 109.5 ?
    C6 C9 H9B . . 109.5 ?
    H9A C9 H9B . . 109.5 ?
    C6 C9 H9C . . 109.5 ?
    H9A C9 H9C . . 109.5 ?
    H9B C9 H9C . . 109.5 ?
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 N2 3 0.930(15) 2.230(15) 3.0937(13) 154.1(12)
data_II
_audit_creation_method     SHELXL97
_chemical_name_systematic
;
di-tert-butyl ketone triphenylphosphoranylidenehydrazone
;
_chemical_name_common     ?
_chemical_formula_moiety     'C27 H33 N2 P'
_chemical_formula_sum     'C27 H33 N2 P'
_chemical_formula_iupac     'C27 H33 N2 P'
_chemical_formula_weight     416.52
_chemical_melting_point     ?
_symmetry_cell_setting     monoclinic
_symmetry_space_group_name_H-M     'P 21/c'
_symmetry_space_group_name_Hall     '-P 2ybc'
loop_
    _symmetry_equiv_pos_as_xyz
    'x, y, z'
    '-x, y+1/2, -z+1/2'
    '-x, -y, -z'
    'x, -y-1/2, z-1/2'
_cell_length_a     29.1768(16)
_cell_length_b     11.6848(7)
_cell_length_c     14.3768(6)
_cell_angle_alpha     90.00
_cell_angle_beta     103.243(3)
_cell_angle_gamma     90.00
_cell_volume     4771.1(4)
_cell_formula_units_Z     8
_cell_measurement_reflns_used     122758
_cell_measurement_theta_min     2.91
_cell_measurement_theta_max     25.68
_cell_measurement_temperature     100(2)
_exptl_crystal_description     platelet
_exptl_crystal_colour     colourless
_exptl_crystal_size_max     0.17
_exptl_crystal_size_mid     0.15
_exptl_crystal_size_min     0.10
_exptl_crystal_density_diffrn     1.160
_exptl_crystal_density_meas     ?
_exptl_crystal_density_method     ?
_exptl_crystal_F_000     1792
_exptl_absorpt_coefficient_mu     0.131
_exptl_absorpt_correction_type     none
_exptl_special_details     'crystal-to-detector distance 30 mm'
_diffrn_ambient_temperature     100(2)
_diffrn_radiation_type     MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_source     'fine-focus sealed tube'
_diffrn_radiation_monochromator     graphite
_diffrn_measurement_device_type     'Nonius KappaCCD area-detector'
_diffrn_measurement_method     'two φ and two ω scans with 2° steps'
_diffrn_reflns_number     122758
_diffrn_reflns_av_R_equivalents     0.0364
_diffrn_reflns_theta_min     2.91
_diffrn_reflns_theta_max     25.68
_diffrn_reflns_theta_full     25.68
_diffrn_measured_fraction_theta_max     0.998
_diffrn_measured_fraction_theta_full     0.998
_diffrn_reflns_limit_h_min     -35
_diffrn_reflns_limit_h_max     34
_diffrn_reflns_limit_k_min     -14
_diffrn_reflns_limit_k_max     0
_diffrn_reflns_limit_l_min     0
_diffrn_reflns_limit_l_max     17
_diffrn_standards_number     0
_diffrn_standards_interval_time     0
_diffrn_standards_decay_%     0
_refine_special_details
;
 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2σ(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;
_reflns_number_total     9059
_reflns_number_gt     6960
_reflns_threshold_expression     I>2σ(I)
_refine_ls_structure_factor_coef     Fsqd
_refine_ls_matrix_type     full
_refine_ls_R_factor_all     0.0662
_refine_ls_R_factor_gt     0.0442
_refine_ls_wR_factor_gt     0.1075
_refine_ls_wR_factor_ref     0.1181
_refine_ls_goodness_of_fit_ref     0.993
_refine_ls_restrained_S_all     0.993
_refine_ls_number_reflns     9059
_refine_ls_number_parameters     553
_refine_ls_number_restraints     0
_refine_ls_hydrogen_treatment     constr
_refine_ls_weighting_scheme     calc
_refine_ls_weighting_details
       'calc w = 1/[σ²(Fo²)+(0.0646P)²+1.2906P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary     difmap
_refine_ls_shift/su_max     0.001
_refine_ls_shift/su_mean     0.000
_refine_diff_density_max     0.182
_refine_diff_density_min     -0.310
_refine_ls_extinction_method     none
_refine_ls_extinction_coef     ?
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'
    'N' 'N' 0.0061 0.0033
                         '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'
_computing_data_collection     'COLLECT (Nonius, 1998)'
_computing_cell_refinement     'HKL2000 (Otwinowski & Minor, 1997)'
_computing_data_reduction     'HKL2000'
_computing_structure_solution     'SHELXS97 (Sheldrick, 1997)'
_computing_structure_refinement     'SHELXL97 (Sheldrick, 1997)'
_computing_molecular_graphics     'SHELXTL (Bruker, 1999)'
_computing_publication_material     'SHELXTL and PLATON (Spek, 2003)'
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_refinement_flags
    _atom_site_occupancy
    _atom_site_disorder_assembly
    _atom_site_disorder_group
    P P1A 0.126578(16) 0.87567(4) 0.35509(3) 0.02327(12) Uani d . 1 . .
    N N1A 0.14460(5) 0.98479(14) 0.42084(11) 0.0266(4) Uani d . 1 . .
    N N2A 0.11641(5) 0.99813(14) 0.48864(10) 0.0263(3) Uani d . 1 . .
    C C1A 0.12476(6) 1.08194(17) 0.54874(12) 0.0259(4) Uani d . 1 . .
    C C2A 0.16387(7) 1.17240(17) 0.55023(13) 0.0287(4) Uani d . 1 . .
    C C3A 0.15162(8) 1.23777(18) 0.45438(14) 0.0365(5) Uani d . 1 . .
    H H3A 0.1462 1.1841 0.4025 0.055 Uiso calc R 1 . .
    H H3B 0.1773 1.2873 0.4499 0.055 Uiso calc R 1 . .
    H H3C 0.1237 1.2826 0.4512 0.055 Uiso calc R 1 . .
    C C4A 0.21186(7) 1.11266(19) 0.56231(16) 0.0363(5) Uani d . 1 . .
    H H4A 0.2118 1.0664 0.5071 0.055 Uiso calc R 1 . .
    H H4B 0.2175 1.0651 0.6182 0.055 Uiso calc R 1 . .
    H H4C 0.2363 1.1693 0.5691 0.055 Uiso calc R 1 . .
    C C5A 0.17153(8) 1.26305(18) 0.63071(14) 0.0353(5) Uani d . 1 . .
    H H5A 0.1928 1.3207 0.6185 0.053 Uiso calc R 1 . .
    H H5B 0.1846 1.2269 0.6909 0.053 Uiso calc R 1 . .
    H H5C 0.1419 1.2977 0.6326 0.053 Uiso calc R 1 . .
    C C6A 0.09036(7) 1.08489(18) 0.61627(13) 0.0304(4) Uani d . 1 . .
    C C7A 0.05684(8) 1.1888(2) 0.59358(15) 0.0399(5) Uani d . 1 . .
    H H7A 0.0749 1.2582 0.6036 0.060 Uiso calc R 1 . .
    H H7B 0.0352 1.1878 0.6349 0.060 Uiso calc R 1 . .
    H H7C 0.0396 1.1849 0.5282 0.060 Uiso calc R 1 . .
    C C8A 0.05893(7) 0.97765(19) 0.60192(14) 0.0349(5) Uani d . 1 . .
    H H8A 0.0369 0.9823 0.6422 0.052 Uiso calc R 1 . .
    H H8B 0.0782 0.9107 0.6183 0.052 Uiso calc R 1 . .
    H H8C 0.0421 0.9730 0.5363 0.052 Uiso calc R 1 . .
    C C9A 0.11642(8) 1.0856(2) 0.72279(14) 0.0387(5) Uani d . 1 . .
    H H9A 0.1271 1.1618 0.7412 0.058 Uiso calc R 1 . .
    H H9B 0.1430 1.0349 0.7322 0.058 Uiso calc R 1 . .
    H H9C 0.0954 1.0607 0.7612 0.058 Uiso calc R 1 . .
    C C10A 0.16748(6) 0.86014(17) 0.27903(12) 0.0244(4) Uani d . 1 . .
    C C11A 0.19999(6) 0.94665(18) 0.27593(13) 0.0270(4) Uani d . 1 . .
    H H11A 0.2008 1.0118 0.3135 0.032 Uiso calc R 1 . .
    C C12A 0.23112(7) 0.93504(19) 0.21645(13) 0.0313(4) Uani d . 1 . .
    H H12A 0.2528 0.9927 0.2142 0.038 Uiso calc R 1 . .
    C C13A 0.23009(7) 0.83822(19) 0.16058(13) 0.0326(5) Uani d . 1 . .
    H H13A 0.2514 0.8308 0.1217 0.039 Uiso calc R 1 . .
    C C14A 0.19749(7) 0.75200(18) 0.16222(13) 0.0309(4) Uani d . 1 . .
    H H14A 0.1968 0.6871 0.1246 0.037 Uiso calc R 1 . .
    C C15A 0.16587(7) 0.76371(18) 0.22069(13) 0.0285(4) Uani d . 1 . .
    H H15A 0.1435 0.7071 0.2210 0.034 Uiso calc R 1 . .
    C C16A 0.12308(6) 0.74199(17) 0.41682(12) 0.0250(4) Uani d . 1 . .
    C C17A 0.15670(7) 0.65539(17) 0.42471(13) 0.0282(4) Uani d . 1 . .
    H H17A 0.1812 0.6626 0.3937 0.034 Uiso calc R 1 . .
    C C18A 0.15360(7) 0.55865(18) 0.47878(14) 0.0326(5) Uani d . 1 . .
    H H18A 0.1758 0.5006 0.4830 0.039 Uiso calc R 1 . .
    C C19A 0.11766(7) 0.54793(18) 0.52643(14) 0.0334(5) Uani d . 1 . .
    H H19A 0.1158 0.4830 0.5628 0.040 Uiso calc R 1 . .
    C C20A 0.08434(7) 0.63420(18) 0.51988(13) 0.0323(5) Uani d . 1 . .
    H H20A 0.0604 0.6275 0.5526 0.039 Uiso calc R 1 . .
    C C21A 0.08671(7) 0.73002(17) 0.46483(13) 0.0280(4) Uani d . 1 . .
    H H21A 0.0640 0.7869 0.4597 0.034 Uiso calc R 1 . .
    C C22A 0.06880(6) 0.88968(17) 0.27444(12) 0.0252(4) Uani d . 1 . .
    C C23A 0.05362(7) 0.99840(18) 0.24230(13) 0.0298(4) Uani d . 1 . .
    H H23A 0.0720 1.0619 0.2651 0.036 Uiso calc R 1 . .
    C C24A 0.01105(7) 1.01247(19) 0.17608(14) 0.0349(5) Uani d . 1 . .
    H H24A 0.0012 1.0853 0.1541 0.042 Uiso calc R 1 . .
    C C25A -0.01659(7) 0.9182(2) 0.14286(14) 0.0358(5) Uani d . 1 . .
    H H25A -0.0452 0.9281 0.0990 0.043 Uiso calc R 1 . .
    C C26A -0.00201(7) 0.8095(2) 0.17439(13) 0.0328(5) Uani d . 1 . .
    H H26A -0.0207 0.7464 0.1518 0.039 Uiso calc R 1 . .
    C C27A 0.04077(7) 0.79520(18) 0.24010(13) 0.0280(4) Uani d . 1 . .
    H H27A 0.0507 0.7222 0.2612 0.034 Uiso calc R 1 . .
    P P1B 0.378096(16) 0.63657(4) 0.23986(3) 0.02313(12) Uani d . 1 . .
    N N1B 0.35412(6) 0.52716(14) 0.27612(11) 0.0278(4) Uani d . 1 . .
    N N2B 0.38056(5) 0.49398(14) 0.36776(10) 0.0268(4) Uani d . 1 . .
    C C1B 0.36555(7) 0.41133(17) 0.41229(13) 0.0271(4) Uani d . 1 . .
    C C2B 0.31963(8) 0.34335(18) 0.37059(14) 0.0344(5) Uani d . 1 . .
    C C3B 0.32498(9) 0.2847(2) 0.27700(15) 0.0422(5) Uani d . 1 . .
    H H3D 0.3503 0.2304 0.2912 0.063 Uiso calc R 1 . .
    H H3E 0.3317 0.3415 0.2337 0.063 Uiso calc R 1 . .
    H H3F 0.2962 0.2460 0.2480 0.063 Uiso calc R 1 . .
    C C4B 0.30603(9) 0.2474(2) 0.43339(17) 0.0494(6) Uani d . 1 . .
    H H4D 0.2990 0.2804 0.4897 0.074 Uiso calc R 1 . .
    H H4E 0.3318 0.1947 0.4515 0.074 Uiso calc R 1 . .
    H H4F 0.2788 0.2074 0.3979 0.074 Uiso calc R 1 . .
    C C5B 0.27741(7) 0.4265(2) 0.35038(16) 0.0416(5) Uani d . 1 . .
    H H5D 0.2493 0.3855 0.3210 0.062 Uiso calc R 1 . .
    H H5E 0.2829 0.4860 0.3082 0.062 Uiso calc R 1 . .
    H H5F 0.2738 0.4597 0.4093 0.062 Uiso calc R 1 . .
    C C6B 0.39857(7) 0.38686(18) 0.51135(13) 0.0319(5) Uani d . 1 . .
    C C7B 0.42194(10) 0.2684(2) 0.51370(18) 0.0564(7) Uani d . 1 . .
    H H7D 0.4435 0.2576 0.5744 0.085 Uiso calc R 1 . .
    H H7E 0.4387 0.2638 0.4636 0.085 Uiso calc R 1 . .
    H H7F 0.3982 0.2100 0.5046 0.085 Uiso calc R 1 . .
    C C8B 0.37278(8) 0.3972(2) 0.59324(14) 0.0421(5) Uani d . 1 . .
    H H8D 0.3539 0.3302 0.5944 0.063 Uiso calc R 1 . .
    H H8E 0.3529 0.4637 0.5833 0.063 Uiso calc R 1 . .
    H H8F 0.3955 0.4041 0.6530 0.063 Uiso calc R 1 . .
    C C9B 0.43916(7) 0.4743(2) 0.53285(14) 0.0385(5) Uani d . 1 . .
    H H9D 0.4600 0.4562 0.5930 0.058 Uiso calc R 1 . .
    H H9E 0.4266 0.5497 0.5357 0.058 Uiso calc R 1 . .
    H H9F 0.4562 0.4714 0.4832 0.058 Uiso calc R 1 . .
    C C10B 0.33994(6) 0.67597(17) 0.12737(12) 0.0244(4) Uani d . 1 . .
    C C11B 0.29963(6) 0.61255(17) 0.08934(13) 0.0272(4) Uani d . 1 . .
    H H11B 0.2919 0.5497 0.1223 0.033 Uiso calc R 1 . .
    C C12B 0.27094(7) 0.64374(18) 0.00143(13) 0.0295(4) Uani d . 1 . .
    H H12B 0.2437 0.6022 -0.0238 0.035 Uiso calc R 1 . .
    C C13B 0.28284(7) 0.73639(17) -0.04838(13) 0.0277(4) Uani d . 1 . .
    H H13B 0.2638 0.7562 -0.1073 0.033 Uiso calc R 1 . .
    C C14B 0.32301(6) 0.79976(17) -0.01077(13) 0.0265(4) Uani d . 1 . .
    H H14B 0.3308 0.8623 -0.0441 0.032 Uiso calc R 1 . .
    C C15B 0.35146(6) 0.76939(17) 0.07655(13) 0.0262(4) Uani d . 1 . .
    H H15B 0.3785 0.8115 0.1016 0.031 Uiso calc R 1 . .
    C C16B 0.38592(6) 0.76161(16) 0.31634(12) 0.0238(4) Uani d . 1 . .
    C C17B 0.35309(7) 0.85021(17) 0.30093(14) 0.0283(4) Uani d . 1 . .
    H H17B 0.3285 0.8495 0.2468 0.034 Uiso calc R 1 . .
    C C18B 0.35692(7) 0.93974(18) 0.36592(14) 0.0318(4) Uani d . 1 . .
    H H18B 0.3348 0.9985 0.3555 0.038 Uiso calc R 1 . .
    C C19B 0.39361(7) 0.94128(18) 0.44607(13) 0.0316(4) Uani d . 1 . .
    H H19B 0.3961 1.0010 0.4897 0.038 Uiso calc R 1 . .
    C C20B 0.42681(7) 0.85385(17) 0.46162(13) 0.0302(4) Uani d . 1 . .
    H H20B 0.4517 0.8558 0.5152 0.036 Uiso calc R 1 . .
    C C21B 0.42292(6) 0.76391(17) 0.39751(12) 0.0260(4) Uani d . 1 . .
    H H21B 0.4450 0.7050 0.4085 0.031 Uiso calc R 1 . .
    C C22B 0.43638(6) 0.61407(17) 0.21741(12) 0.0262(4) Uani d . 1 . .
    C C23B 0.46780(7) 0.70383(19) 0.21720(13) 0.0294(4) Uani d . 1 . .
    H H23B 0.4595 0.7778 0.2308 0.035 Uiso calc R 1 . .
    C C24B 0.51144(7) 0.6836(2) 0.19675(13) 0.0362(5) Uani d . 1 . .
    H H24B 0.5326 0.7435 0.1980 0.043 Uiso calc R 1 . .
    C C25B 0.52328(7) 0.5733(2) 0.17451(14) 0.0400(5) Uani d . 1 . .
    H H25B 0.5524 0.5594 0.1607 0.048 Uiso calc R 1 . .
    C C26B 0.49195(7) 0.4842(2) 0.17275(14) 0.0374(5) Uani d . 1 . .
    H H26B 0.4998 0.4109 0.1565 0.045 Uiso calc R 1 . .
    C C27B 0.44870(7) 0.50368(18) 0.19527(13) 0.0319(4) Uani d . 1 . .
    H H27B 0.4280 0.4432 0.1956 0.038 Uiso calc R 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
    P1A N1A . 1.6025(16) yes
    P1A C10A . 1.8030(18) yes
    P1A C16A . 1.811(2) yes
    P1A C22A . 1.8214(19) yes
    N1A N2A . 1.421(2) yes
    C1A N2A . 1.292(2) yes
    C1A C2A . 1.552(3) yes
    C1A C6A . 1.548(3) yes
    C2A C4A . 1.538(3) ?
    C2A C3A . 1.544(3) ?
    C2A C5A . 1.547(3) ?
    C3A H3A . 0.9600 ?
    C3A H3B . 0.9600 ?
    C3A H3C . 0.9600 ?
    C4A H4A . 0.9600 ?
    C4A H4B . 0.9600 ?
    C4A H4C . 0.9600 ?
    C5A H5A . 0.9600 ?
    C5A H5B . 0.9600 ?
    C5A H5C . 0.9600 ?
    C6A C8A . 1.538(3) ?
    C6A C9A . 1.546(3) ?
    C6A C7A . 1.546(3) ?
    C7A H7A . 0.9600 ?
    C7A H7B . 0.9600 ?
    C7A H7C . 0.9600 ?
    C8A H8A . 0.9600 ?
    C8A H8B . 0.9600 ?
    C8A H8C . 0.9600 ?
    C9A H9A . 0.9600 ?
    C9A H9B . 0.9600 ?
    C9A H9C . 0.9600 ?
    C10A C11A . 1.394(3) ?
    C10A C15A . 1.399(3) ?
    C11A C12A . 1.389(3) ?
    C11A H11A . 0.9300 ?
    C12A C13A . 1.384(3) ?
    C12A H12A . 0.9300 ?
    C13A C14A . 1.389(3) ?
    C13A H13A . 0.9300 ?
    C14A C15A . 1.390(3) ?
    C14A H14A . 0.9300 ?
    C15A H15A . 0.9300 ?
    C16A C17A . 1.396(3) ?
    C16A C21A . 1.399(3) ?
    C17A C18A . 1.387(3) ?
    C17A H17A . 0.9300 ?
    C18A C19A . 1.383(3) ?
    C18A H18A . 0.9300 ?
    C19A C20A . 1.389(3) ?
    C19A H19A . 0.9300 ?
    C20A C21A . 1.382(3) ?
    C20A H20A . 0.9300 ?
    C21A H21A . 0.9300 ?
    C22A C23A . 1.389(3) ?
    C22A C27A . 1.395(3) ?
    C23A C24A . 1.391(3) ?
    C23A H23A . 0.9300 ?
    C24A C25A . 1.384(3) ?
    C24A H24A . 0.9300 ?
    C25A C26A . 1.382(3) ?
    C25A H25A . 0.9300 ?
    C26A C27A . 1.392(3) ?
    C26A H26A . 0.9300 ?
    C27A H27A . 0.9300 ?
    P1B N1B . 1.6008(16) yes
    P1B C10B . 1.8006(18) yes
    P1B C16B . 1.8114(19) yes
    P1B C22B . 1.8212(19) yes
    N1B N2B . 1.420(2) yes
    C1B N2B . 1.289(2) yes
    C1B C2B . 1.555(3) yes
    C1B C6B . 1.552(3) yes
    C2B C5B . 1.543(3) ?
    C2B C4B . 1.548(3) ?
    C2B C3B . 1.549(3) ?
    C3B H3D . 0.9600 ?
    C3B H3E . 0.9600 ?
    C3B H3F . 0.9600 ?
    C4B H4D . 0.9600 ?
    C4B H4E . 0.9600 ?
    C4B H4F . 0.9600 ?
    C5B H5D . 0.9600 ?
    C5B H5E . 0.9600 ?
    C5B H5F . 0.9600 ?
    C6B C7B . 1.540(3) ?
    C6B C8B . 1.540(3) ?
    C6B C9B . 1.541(3) ?
    C7B H7D . 0.9600 ?
    C7B H7E . 0.9600 ?
    C7B H7F . 0.9600 ?
    C8B H8D . 0.9600 ?
    C8B H8E . 0.9600 ?
    C8B H8F . 0.9600 ?
    C9B H9D . 0.9600 ?
    C9B H9E . 0.9600 ?
    C9B H9F . 0.9600 ?
    C10B C11B . 1.392(3) ?
    C10B C15B . 1.397(3) ?
    C11B C12B . 1.395(3) ?
    C11B H11B . 0.9300 ?
    C12B C13B . 1.385(3) ?
    C12B H12B . 0.9300 ?
    C13B C14B . 1.387(3) ?
    C13B H13B . 0.9300 ?
    C14B C15B . 1.383(3) ?
    C14B H14B . 0.9300 ?
    C15B H15B . 0.9300 ?
    C16B C17B . 1.393(3) ?
    C16B C21B . 1.397(3) ?
    C17B C18B . 1.390(3) ?
    C17B H17B . 0.9300 ?
    C18B C19B . 1.382(3) ?
    C18B H18B . 0.9300 ?
    C19B C20B . 1.390(3) ?
    C19B H19B . 0.9300 ?
    C20B C21B . 1.385(3) ?
    C20B H20B . 0.9300 ?
    C21B H21B . 0.9300 ?
    C22B C23B . 1.393(3) ?
    C22B C27B . 1.395(3) ?
    C23B C24B . 1.391(3) ?
    C23B H23B . 0.9300 ?
    C24B C25B . 1.390(3) ?
    C24B H24B . 0.9300 ?
    C25B C26B . 1.382(3) ?
    C25B H25B . 0.9300 ?
    C26B C27B . 1.391(3) ?
    C26B H26B . 0.9300 ?
    C27B H27B . 0.9300 ?
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
    P1A N1A N2A . . 109.19(12) yes
    N1A N2A C1A . . 119.47(16) yes
    N2A C1A C2A . . 123.44(17) yes
    N2A C1A C6A . . 112.72(17) yes
    C2A C1A C6A . . 123.80(16) yes
    N1A P1A C10A . . 105.33(8) ?
    N1A P1A C16A . . 116.42(8) ?
    C10A P1A C16A . . 109.26(9) ?
    N1A P1A C22A . . 115.77(9) ?
    C10A P1A C22A . . 105.52(8) ?
    C16A P1A C22A . . 103.98(9) ?
    C4A C2A C3A . . 110.10(16) ?
    C4A C2A C5A . . 104.74(16) ?
    C3A C2A C5A . . 107.04(17) ?
    C4A C2A C1A . . 109.86(16) ?
    C3A C2A C1A . . 107.79(16) ?
    C5A C2A C1A . . 117.17(16) ?
    C2A C3A H3A . . 109.5 ?
    C2A C3A H3B . . 109.5 ?
    H3A C3A H3B . . 109.5 ?
    C2A C3A H3C . . 109.5 ?
    H3A C3A H3C . . 109.5 ?
    H3B C3A H3C . . 109.5 ?
    C2A C4A H4A . . 109.5 ?
    C2A C4A H4B . . 109.5 ?
    H4A C4A H4B . . 109.5 ?
    C2A C4A H4C . . 109.5 ?
    H4A C4A H4C . . 109.5 ?
    H4B C4A H4C . . 109.5 ?
    C2A C5A H5A . . 109.5 ?
    C2A C5A H5B . . 109.5 ?
    H5A C5A H5B . . 109.5 ?
    C2A C5A H5C . . 109.5 ?
    H5A C5A H5C . . 109.5 ?
    H5B C5A H5C . . 109.5 ?
    C8A C6A C9A . . 106.27(17) ?
    C8A C6A C7A . . 106.41(17) ?
    C9A C6A C7A . . 110.38(17) ?
    C8A C6A C1A . . 110.48(16) ?
    C9A C6A C1A . . 112.26(16) ?
    C7A C6A C1A . . 110.78(16) ?
    C6A C7A H7A . . 109.5 ?
    C6A C7A H7B . . 109.5 ?
    H7A C7A H7B . . 109.5 ?
    C6A C7A H7C . . 109.5 ?
    H7A C7A H7C . . 109.5 ?
    H7B C7A H7C . . 109.5 ?
    C6A C8A H8A . . 109.5 ?
    C6A C8A H8B . . 109.5 ?
    H8A C8A H8B . . 109.5 ?
    C6A C8A H8C . . 109.5 ?
    H8A C8A H8C . . 109.5 ?
    H8B C8A H8C . . 109.5 ?
    C6A C9A H9A . . 109.5 ?
    C6A C9A H9B . . 109.5 ?
    H9A C9A H9B . . 109.5 ?
    C6A C9A H9C . . 109.5 ?
    H9A C9A H9C . . 109.5 ?
    H9B C9A H9C . . 109.5 ?
    C11A C10A C15A . . 119.64(17) ?
    C11A C10A P1A . . 119.75(15) ?
    C15A C10A P1A . . 120.58(15) ?
    C12A C11A C10A . . 119.63(19) ?
    C12A C11A H11A . . 120.2 ?
    C10A C11A H11A . . 120.2 ?
    C13A C12A C11A . . 120.45(19) ?
    C13A C12A H12A . . 119.8 ?
    C11A C12A H12A . . 119.8 ?
    C12A C13A C14A . . 120.45(18) ?
    C12A C13A H13A . . 119.8 ?
    C14A C13A H13A . . 119.8 ?
    C15A C14A C13A . . 119.39(19) ?
    C15A C14A H14A . . 120.3 ?
    C13A C14A H14A . . 120.3 ?
    C14A C15A C10A . . 120.40(19) ?
    C14A C15A H15A . . 119.8 ?
    C10A C15A H15A . . 119.8 ?
    C17A C16A C21A . . 119.07(18) ?
    C17A C16A P1A . . 123.20(14) ?
    C21A C16A P1A . . 117.53(15) ?
    C18A C17A C16A . . 120.11(18) ?
    C18A C17A H17A . . 119.9 ?
    C16A C17A H17A . . 119.9 ?
    C19A C18A C17A . . 120.38(19) ?
    C19A C18A H18A . . 119.8 ?
    C17A C18A H18A . . 119.8 ?
    C18A C19A C20A . . 119.93(19) ?
    C18A C19A H19A . . 120.0 ?
    C20A C19A H19A . . 120.0 ?
    C21A C20A C19A . . 120.06(19) ?
    C21A C20A H20A . . 120.0 ?
    C19A C20A H20A . . 120.0 ?
    C20A C21A C16A . . 120.44(19) ?
    C20A C21A H21A . . 119.8 ?
    C16A C21A H21A . . 119.8 ?
    C23A C22A C27A . . 119.31(18) ?
    C23A C22A P1A . . 118.16(15) ?
    C27A C22A P1A . . 122.43(15) ?
    C22A C23A C24A . . 120.2(2) ?
    C22A C23A H23A . . 119.9 ?
    C24A C23A H23A . . 119.9 ?
    C25A C24A C23A . . 120.0(2) ?
    C25A C24A H24A . . 120.0 ?
    C23A C24A H24A . . 120.0 ?
    C26A C25A C24A . . 120.45(19) ?
    C26A C25A H25A . . 119.8 ?
    C24A C25A H25A . . 119.8 ?
    C25A C26A C27A . . 119.6(2) ?
    C25A C26A H26A . . 120.2 ?
    C27A C26A H26A . . 120.2 ?
    C26A C27A C22A . . 120.44(19) ?
    C26A C27A H27A . . 119.8 ?
    C22A C27A H27A . . 119.8 ?
    N1B P1B C10B . . 105.68(9) ?
    N1B P1B C16B . . 116.75(8) ?
    C10B P1B C16B . . 107.76(9) ?
    N1B P1B C22B . . 115.97(9) ?
    C10B P1B C22B . . 106.74(8) ?
    C16B P1B C22B . . 103.36(9) ?
    P1B N1B N2B . . 109.58(12) yes
    N1B N2B C1B . . 119.41(16) yes
    N2B C1B C2B . . 123.49(17) yes
    N2B C1B C6B . . 112.55(17) yes
    C2B C1B C6B . . 123.95(16) yes
    C5B C2B C4B . . 105.42(18) ?
    C5B C2B C3B . . 110.48(18) ?
    C4B C2B C3B . . 106.06(18) ?
    C5B C2B C1B . . 109.33(17) ?
    C4B C2B C1B . . 117.31(17) ?
    C3B C2B C1B . . 108.14(16) ?
    C2B C3B H3D . . 109.5 ?
    C2B C3B H3E . . 109.5 ?
    H3D C3B H3E . . 109.5 ?
    C2B C3B H3F . . 109.5 ?
    H3D C3B H3F . . 109.5 ?
    H3E C3B H3F . . 109.5 ?
    C2B C4B H4D . . 109.5 ?
    C2B C4B H4E . . 109.5 ?
    H4D C4B H4E . . 109.5 ?
    C2B C4B H4F . . 109.5 ?
    H4D C4B H4F . . 109.5 ?
    H4E C4B H4F . . 109.5 ?
    C2B C5B H5D . . 109.5 ?
    C2B C5B H5E . . 109.5 ?
    H5D C5B H5E . . 109.5 ?
    C2B C5B H5F . . 109.5 ?
    H5D C5B H5F . . 109.5 ?
    H5E C5B H5F . . 109.5 ?
    C7B C6B C8B . . 110.18(19) ?
    C7B C6B C9B . . 105.97(19) ?
    C8B C6B C9B . . 106.40(17) ?
    C7B C6B C1B . . 111.37(17) ?
    C8B C6B C1B . . 112.19(17) ?
    C9B C6B C1B . . 110.42(16) ?
    C6B C7B H7D . . 109.5 ?
    C6B C7B H7E . . 109.5 ?
    H7D C7B H7E . . 109.5 ?
    C6B C7B H7F . . 109.5 ?
    H7D C7B H7F . . 109.5 ?
    H7E C7B H7F . . 109.5 ?
    C6B C8B H8D . . 109.5 ?
    C6B C8B H8E . . 109.5 ?
    H8D C8B H8E . . 109.5 ?
    C6B C8B H8F . . 109.5 ?
    H8D C8B H8F . . 109.5 ?
    H8E C8B H8F . . 109.5 ?
    C6B C9B H9D . . 109.5 ?
    C6B C9B H9E . . 109.5 ?
    H9D C9B H9E . . 109.5 ?
    C6B C9B H9F . . 109.5 ?
    H9D C9B H9F . . 109.5 ?
    H9E C9B H9F . . 109.5 ?
    C11B C10B C15B . . 119.59(17) ?
    C11B C10B P1B . . 120.64(14) ?
    C15B C10B P1B . . 119.75(14) ?
    C10B C11B C12B . . 119.64(18) ?
    C10B C11B H11B . . 120.2 ?
    C12B C11B H11B . . 120.2 ?
    C13B C12B C11B . . 120.20(18) ?
    C13B C12B H12B . . 119.9 ?
    C11B C12B H12B . . 119.9 ?
    C12B C13B C14B . . 120.33(17) ?
    C12B C13B H13B . . 119.8 ?
    C14B C13B H13B . . 119.8 ?
    C15B C14B C13B . . 119.65(18) ?
    C15B C14B H14B . . 120.2 ?
    C13B C14B H14B . . 120.2 ?
    C14B C15B C10B . . 120.59(18) ?
    C14B C15B H15B . . 119.7 ?
    C10B C15B H15B . . 119.7 ?
    C17B C16B C21B . . 119.36(17) ?
    C17B C16B P1B . . 121.09(14) ?
    C21B C16B P1B . . 119.24(15) ?
    C18B C17B C16B . . 120.39(18) ?
    C18B C17B H17B . . 119.8 ?
    C16B C17B H17B . . 119.8 ?
    C19B C18B C17B . . 119.87(19) ?
    C19B C18B H18B . . 120.1 ?
    C17B C18B H18B . . 120.1 ?
    C18B C19B C20B . . 120.18(18) ?
    C18B C19B H19B . . 119.9 ?
    C20B C19B H19B . . 119.9 ?
    C21B C20B C19B . . 120.17(18) ?
    C21B C20B H20B . . 119.9 ?
    C19B C20B H20B . . 119.9 ?
    C20B C21B C16B . . 120.02(18) ?
    C20B C21B H21B . . 120.0 ?
    C16B C21B H21B . . 120.0 ?
    C23B C22B C27B . . 119.43(18) ?
    C23B C22B P1B . . 122.23(15) ?
    C27B C22B P1B . . 118.27(15) ?
    C24B C23B C22B . . 120.5(2) ?
    C24B C23B H23B . . 119.8 ?
    C22B C23B H23B . . 119.8 ?
    C25B C24B C23B . . 119.6(2) ?
    C25B C24B H24B . . 120.2 ?
    C23B C24B H24B . . 120.2 ?
    C26B C25B C24B . . 120.31(19) ?
    C26B C25B H25B . . 119.8 ?
    C24B C25B H25B . . 119.8 ?
    C25B C26B C27B . . 120.2(2) ?
    C25B C26B H26B . . 119.9 ?
    C27B C26B H26B . . 119.9 ?
    C26B C27B C22B . . 119.9(2) ?
    C26B C27B H27B . . 120.0 ?
    C22B C27B H27B . . 120.0 ?
data_global
_journal_date_recd_electronic     2006-02-10
_journal_date_accepted     2006-03-08
_journal_name_full     'Acta Crystallographica, Section C'
_journal_year     2006
_journal_volume     62
_journal_issue      4
_journal_page_first     o234
_journal_page_last     o236
_journal_paper_category     FO
_journal_coeditor_code     HJ3003
_publ_contact_author_name     'Pierre Thuery'
_publ_contact_author_address
;
CEA/Saclay
DSM/DRECAM/SCM (CNRS URA 331)
Batiment 125
91191 Gif-sur-Yvette
France
;
_publ_contact_author_email     pierre.thuery@cea.fr
_publ_contact_author_fax     '33 1 69 08 66 40'
_publ_contact_author_phone     '33 1 69 08 63 29'
_publ_section_title
;
Di-tert-butyl ketone hydrazone and di-tert-butyl ketone
triphenylphosphoranylidenehydrazone
;
loop_
    _publ_author_name
    _publ_author_address
    'Villiers, Claude'
;
CEA/Saclay
DSM/DRECAM/SCM (CNRS URA 331)
Bâtiment 125
91191 Gif-sur-Yvette
France
;
    'Thuéry, Pierre'
;
CEA/Saclay
DSM/DRECAM/SCM (CNRS URA 331)
Bâtiment 125
91191 Gif-sur-Yvette
France
;
    'Ephritikhine, Michel'
;
CEA/Saclay
DSM/DRECAM/SCM (CNRS URA 331)
Bâtiment 125
91191 Gif-sur-Yvette
France
;
