#------------------------------------------------------------------------------
#$Date: 2016-02-20 22:30:07 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176789 $
#$URL: svn://www.crystallography.net/cod/cif/2/22/94/2229404.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2229404
loop_
_publ_author_name
'Mohamed, Shaaban Kamel'
'El-Remaily, Mahmoud A. A.'
'Gurbanov, Atash V.'
'Khalilov, Ali N.'
'Ng, Seik Weng'
_publ_section_title
;
 N-(4,6-Dimethylpyrimidin-2-yl)-1H-benzimidazol-2-amine
;
_journal_coeditor_code           HG5003
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              o719
_journal_paper_doi               10.1107/S1600536811006507
_journal_volume                  67
_journal_year                    2011
_chemical_formula_iupac          'C13 H13 N5'
_chemical_formula_moiety         'C13 H13 N5'
_chemical_formula_sum            'C13 H13 N5'
_chemical_formula_weight         239.28
_chemical_name_systematic
;
N-(4,6-Dimethylpyrimidin-2-yl)-1H-benzimidazol-2-amine
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                92.1210(10)
_cell_angle_beta                 96.1000(10)
_cell_angle_gamma                112.5970(10)
_cell_formula_units_Z            4
_cell_length_a                   8.2836(4)
_cell_length_b                   9.6135(5)
_cell_length_c                   16.5694(8)
_cell_measurement_reflns_used    4428
_cell_measurement_temperature    295(2)
_cell_measurement_theta_max      27.4
_cell_measurement_theta_min      2.3
_cell_volume                     1206.94(10)
_computing_cell_refinement       'SAINT (Bruker, 2005)'
_computing_data_collection       'APEX2 (Bruker, 2005)'
_computing_data_reduction        'SAINT (Bruker, 2005)'
_computing_molecular_graphics    'X-SEED (Barbour, 2001)'
_computing_publication_material  'publCIF (Westrip, 2010)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      295(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker APEXII'
_diffrn_measurement_method       'φ and ω'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0185
_diffrn_reflns_av_sigmaI/netI    0.0224
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            13373
_diffrn_reflns_theta_full        27.50
_diffrn_reflns_theta_max         27.50
_diffrn_reflns_theta_min         1.24
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.085
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            Colorless
_exptl_crystal_density_diffrn    1.317
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Prism
_exptl_crystal_F_000             504
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_refine_diff_density_max         0.250
_refine_diff_density_min         -0.181
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.005
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     345
_refine_ls_number_reflns         5550
_refine_ls_number_restraints     4
_refine_ls_restrained_S_all      1.005
_refine_ls_R_factor_all          0.0610
_refine_ls_R_factor_gt           0.0436
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0736P)²+0.1933P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1215
_refine_ls_wR_factor_ref         0.1361
_reflns_number_gt                4124
_reflns_number_total             5550
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            hg5003.cif
_cod_data_source_block           I
_cod_database_code               2229404
_cod_database_fobs_code          2229404
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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 0.66435(17) 0.61916(15) 0.45010(8) 0.0480(3) Uani d D 1 . .
N N2 0.80016(16) 0.45944(14) 0.43969(8) 0.0470(3) Uani d . 1 . .
N N3 0.94151(17) 0.67635(15) 0.53228(8) 0.0498(3) Uani d D 1 . .
N N4 1.11489(17) 0.88346(14) 0.61816(8) 0.0491(3) Uani d . 1 . .
N N5 0.83527(16) 0.86534(14) 0.55242(8) 0.0477(3) Uani d . 1 . .
N N6 0.98905(15) 1.11808(14) 0.92502(8) 0.0453(3) Uani d . 1 . .
N N7 0.72463(16) 1.09201(14) 0.86230(8) 0.0452(3) Uani d D 1 . .
N N8 0.74067(16) 0.92463(15) 0.96388(8) 0.0485(3) Uani d D 1 . .
N N9 0.52809(16) 0.73369(14) 1.01630(8) 0.0477(3) Uani d . 1 . .
N N10 0.44770(16) 0.87329(14) 0.91397(8) 0.0464(3) Uani d . 1 . .
C C1 0.5574(2) 0.50529(17) 0.39234(9) 0.0453(3) Uani d . 1 . .
C C2 0.3985(2) 0.48064(19) 0.34608(11) 0.0570(4) Uani d . 1 . .
H H2 0.3415 0.5464 0.3516 0.068 Uiso calc R 1 . .
C C3 0.3283(2) 0.3542(2) 0.29138(11) 0.0648(5) Uani d . 1 . .
H H3A 0.2219 0.3343 0.2590 0.078 Uiso calc R 1 . .
C C4 0.4132(2) 0.2562(2) 0.28378(11) 0.0646(5) Uani d . 1 . .
H H4 0.3630 0.1726 0.2458 0.077 Uiso calc R 1 . .
C C5 0.5706(2) 0.27942(19) 0.33104(10) 0.0566(4) Uani d . 1 . .
H H5 0.6258 0.2122 0.3261 0.068 Uiso calc R 1 . .
C C6 0.64326(19) 0.40638(17) 0.38613(9) 0.0446(3) Uani d . 1 . .
C C7 0.80551(19) 0.58625(16) 0.47531(9) 0.0433(3) Uani d . 1 . .
C C8 0.96246(19) 0.81387(17) 0.56914(9) 0.0444(3) Uani d . 1 . .
C C9 1.1398(2) 1.01836(18) 0.65380(10) 0.0502(4) Uani d . 1 . .
C C10 1.0141(2) 1.07950(19) 0.64206(10) 0.0541(4) Uani d . 1 . .
H H10 1.0317 1.1723 0.6684 0.065 Uiso calc R 1 . .
C C11 0.8619(2) 0.99939(18) 0.59025(10) 0.0492(4) Uani d . 1 . .
C C12 1.3142(2) 1.1021(2) 0.70528(13) 0.0679(5) Uani d . 1 . .
H H12A 1.3969 1.0598 0.6921 0.102 Uiso calc R 1 . .
H H12B 1.2994 1.0930 0.7618 0.102 Uiso calc R 1 . .
H H12C 1.3577 1.2069 0.6949 0.102 Uiso calc R 1 . .
C C13 0.7188(2) 1.0572(2) 0.57189(12) 0.0638(5) Uani d . 1 . .
H H13A 0.6895 1.0528 0.5140 0.096 Uiso calc R 1 . .
H H13B 0.7591 1.1600 0.5946 0.096 Uiso calc R 1 . .
H H13C 0.6163 0.9959 0.5953 0.096 Uiso calc R 1 . .
C C14 1.01079(19) 1.22562(16) 0.86868(9) 0.0423(3) Uani d . 1 . .
C C15 1.1636(2) 1.33597(18) 0.84877(10) 0.0510(4) Uani d . 1 . .
H H15 1.2738 1.3468 0.8743 0.061 Uiso calc R 1 . .
C C16 1.1476(2) 1.42941(19) 0.78990(10) 0.0563(4) Uani d . 1 . .
H H16 1.2488 1.5041 0.7758 0.068 Uiso calc R 1 . .
C C17 0.9839(2) 1.41438(19) 0.75126(10) 0.0569(4) Uani d . 1 . .
H H17 0.9777 1.4789 0.7117 0.068 Uiso calc R 1 . .
C C18 0.8299(2) 1.30521(19) 0.77048(10) 0.0525(4) Uani d . 1 . .
H H18 0.7199 1.2954 0.7451 0.063 Uiso calc R 1 . .
C C19 0.84684(19) 1.21133(16) 0.82922(9) 0.0433(3) Uani d . 1 . .
C C20 0.81693(18) 1.04241(16) 0.91841(9) 0.0417(3) Uani d . 1 . .
C C21 0.56341(18) 0.84116(16) 0.96416(9) 0.0433(3) Uani d . 1 . .
C C22 0.3584(2) 0.64850(18) 1.01769(10) 0.0489(4) Uani d . 1 . .
C C23 0.2285(2) 0.67368(19) 0.96860(11) 0.0554(4) Uani d . 1 . .
H H23 0.1101 0.6147 0.9705 0.066 Uiso calc R 1 . .
C C24 0.27647(19) 0.78683(18) 0.91699(10) 0.0494(4) Uani d . 1 . .
C C25 0.3156(2) 0.5228(2) 1.07291(12) 0.0647(5) Uani d . 1 . .
H H25A 0.4053 0.5504 1.1191 0.097 Uiso calc R 1 . .
H H25B 0.3105 0.4326 1.0439 0.097 Uiso calc R 1 . .
H H25C 0.2036 0.5048 1.0911 0.097 Uiso calc R 1 . .
C C26 0.1440(2) 0.8194(2) 0.86077(12) 0.0683(5) Uani d . 1 . .
H H26A 0.1696 0.9257 0.8660 0.102 Uiso calc R 1 . .
H H26B 0.0280 0.7643 0.8746 0.102 Uiso calc R 1 . .
H H26C 0.1495 0.7889 0.8056 0.102 Uiso calc R 1 . .
H H1 0.653(2) 0.6974(15) 0.4721(10) 0.062(5) Uiso d D 1 . .
H H3 1.0279(19) 0.647(2) 0.5423(11) 0.067(5) Uiso d D 1 . .
H H7 0.6096(12) 1.0539(19) 0.8546(11) 0.063(5) Uiso d D 1 . .
H H8 0.811(2) 0.902(2) 0.9979(9) 0.059(5) Uiso d D 1 . .
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'
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
C7 N1 C1 . . 106.87(13) ?
C7 N1 H1 . . 120.2(12) ?
C1 N1 H1 . . 132.8(12) ?
C7 N2 C6 . . 104.12(12) ?
C7 N3 C8 . . 126.91(13) ?
C7 N3 H3 . . 115.8(13) ?
C8 N3 H3 . . 117.0(13) ?
C9 N4 C8 . . 115.66(13) ?
C8 N5 C11 . . 116.23(13) ?
C20 N6 C14 . . 104.20(12) ?
C20 N7 C19 . . 106.69(12) ?
C20 N7 H7 . . 121.9(12) ?
C19 N7 H7 . . 131.3(12) ?
C20 N8 C21 . . 127.59(13) ?
C20 N8 H8 . . 116.5(13) ?
C21 N8 H8 . . 115.9(12) ?
C22 N9 C21 . . 116.15(13) ?
C21 N10 C24 . . 115.57(14) ?
N1 C1 C2 . . 132.25(15) ?
N1 C1 C6 . . 105.39(13) ?
C2 C1 C6 . . 122.37(15) ?
C3 C2 C1 . . 116.96(16) ?
C3 C2 H2 . . 121.5 ?
C1 C2 H2 . . 121.5 ?
C2 C3 C4 . . 121.27(16) ?
C2 C3 H3A . . 119.4 ?
C4 C3 H3A . . 119.4 ?
C5 C4 C3 . . 121.77(16) ?
C5 C4 H4 . . 119.1 ?
C3 C4 H4 . . 119.1 ?
C4 C5 C6 . . 117.67(16) ?
C4 C5 H5 . . 121.2 ?
C6 C5 H5 . . 121.2 ?
C5 C6 C1 . . 119.94(14) ?
C5 C6 N2 . . 130.14(14) ?
C1 C6 N2 . . 109.91(13) ?
N2 C7 N1 . . 113.70(13) ?
N2 C7 N3 . . 123.06(13) ?
N1 C7 N3 . . 123.24(14) ?
N5 C8 N4 . . 126.91(14) ?
N5 C8 N3 . . 118.65(13) ?
N4 C8 N3 . . 114.42(13) ?
N4 C9 C10 . . 121.78(15) ?
N4 C9 C12 . . 116.46(14) ?
C10 C9 C12 . . 121.74(15) ?
C11 C10 C9 . . 118.16(15) ?
C11 C10 H10 . . 120.9 ?
C9 C10 H10 . . 120.9 ?
N5 C11 C10 . . 121.22(14) ?
N5 C11 C13 . . 116.37(15) ?
C10 C11 C13 . . 122.40(15) ?
C9 C12 H12A . . 109.5 ?
C9 C12 H12B . . 109.5 ?
H12A C12 H12B . . 109.5 ?
C9 C12 H12C . . 109.5 ?
H12A C12 H12C . . 109.5 ?
H12B C12 H12C . . 109.5 ?
C11 C13 H13A . . 109.5 ?
C11 C13 H13B . . 109.5 ?
H13A C13 H13B . . 109.5 ?
C11 C13 H13C . . 109.5 ?
H13A C13 H13C . . 109.5 ?
H13B C13 H13C . . 109.5 ?
C15 C14 N6 . . 129.94(13) ?
C15 C14 C19 . . 119.88(14) ?
N6 C14 C19 . . 110.18(13) ?
C16 C15 C14 . . 118.09(15) ?
C16 C15 H15 . . 121.0 ?
C14 C15 H15 . . 121.0 ?
C15 C16 C17 . . 121.51(16) ?
C15 C16 H16 . . 119.2 ?
C17 C16 H16 . . 119.2 ?
C18 C17 C16 . . 121.25(15) ?
C18 C17 H17 . . 119.4 ?
C16 C17 H17 . . 119.4 ?
C17 C18 C19 . . 116.95(15) ?
C17 C18 H18 . . 121.5 ?
C19 C18 H18 . . 121.5 ?
N7 C19 C18 . . 132.51(14) ?
N7 C19 C14 . . 105.17(12) ?
C18 C19 C14 . . 122.32(15) ?
N6 C20 N7 . . 113.75(13) ?
N6 C20 N8 . . 122.52(13) ?
N7 C20 N8 . . 123.73(13) ?
N10 C21 N9 . . 127.34(13) ?
N10 C21 N8 . . 118.60(14) ?
N9 C21 N8 . . 114.06(12) ?
N9 C22 C23 . . 120.91(15) ?
N9 C22 C25 . . 117.17(14) ?
C23 C22 C25 . . 121.90(15) ?
C24 C23 C22 . . 119.11(14) ?
C24 C23 H23 . . 120.4 ?
C22 C23 H23 . . 120.4 ?
N10 C24 C23 . . 120.91(14) ?
N10 C24 C26 . . 116.69(15) ?
C23 C24 C26 . . 122.39(15) ?
C22 C25 H25A . . 109.5 ?
C22 C25 H25B . . 109.5 ?
H25A C25 H25B . . 109.5 ?
C22 C25 H25C . . 109.5 ?
H25A C25 H25C . . 109.5 ?
H25B C25 H25C . . 109.5 ?
C24 C26 H26A . . 109.5 ?
C24 C26 H26B . . 109.5 ?
H26A C26 H26B . . 109.5 ?
C24 C26 H26C . . 109.5 ?
H26A C26 H26C . . 109.5 ?
H26B C26 H26C . . 109.5 ?
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 C7 . 1.3535(18) ?
N1 C1 . 1.377(2) ?
N1 H1 . 0.860(10) ?
N2 C7 . 1.3176(19) ?
N2 C6 . 1.3960(19) ?
N3 C7 . 1.3689(19) ?
N3 C8 . 1.3756(19) ?
N3 H3 . 0.870(10) ?
N4 C9 . 1.336(2) ?
N4 C8 . 1.3396(19) ?
N5 C8 . 1.3343(18) ?
N5 C11 . 1.340(2) ?
N6 C20 . 1.3183(18) ?
N6 C14 . 1.3917(19) ?
N7 C20 . 1.3558(18) ?
N7 C19 . 1.383(2) ?
N7 H7 . 0.870(10) ?
N8 C20 . 1.3650(19) ?
N8 C21 . 1.3771(19) ?
N8 H8 . 0.870(10) ?
N9 C22 . 1.3310(19) ?
N9 C21 . 1.3367(19) ?
N10 C21 . 1.3352(18) ?
N10 C24 . 1.3481(19) ?
C1 C2 . 1.382(2) ?
C1 C6 . 1.396(2) ?
C2 C3 . 1.378(3) ?
C2 H2 . 0.9300 ?
C3 C4 . 1.384(3) ?
C3 H3A . 0.9300 ?
C4 C5 . 1.382(2) ?
C4 H4 . 0.9300 ?
C5 C6 . 1.386(2) ?
C5 H5 . 0.9300 ?
C9 C10 . 1.380(2) ?
C9 C12 . 1.502(2) ?
C10 C11 . 1.376(2) ?
C10 H10 . 0.9300 ?
C11 C13 . 1.499(2) ?
C12 H12A . 0.9600 ?
C12 H12B . 0.9600 ?
C12 H12C . 0.9600 ?
C13 H13A . 0.9600 ?
C13 H13B . 0.9600 ?
C13 H13C . 0.9600 ?
C14 C15 . 1.385(2) ?
C14 C19 . 1.397(2) ?
C15 C16 . 1.380(2) ?
C15 H15 . 0.9300 ?
C16 C17 . 1.388(2) ?
C16 H16 . 0.9300 ?
C17 C18 . 1.383(2) ?
C17 H17 . 0.9300 ?
C18 C19 . 1.384(2) ?
C18 H18 . 0.9300 ?
C22 C23 . 1.380(2) ?
C22 C25 . 1.498(2) ?
C23 C24 . 1.372(2) ?
C23 H23 . 0.9300 ?
C24 C26 . 1.496(2) ?
C25 H25A . 0.9600 ?
C25 H25B . 0.9600 ?
C25 H25C . 0.9600 ?
C26 H26A . 0.9600 ?
C26 H26B . 0.9600 ?
C26 H26C . 0.9600 ?
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
_geom_hbond_publ_flag
N1 H1 N5 . 0.860(10) 2.05(2) 2.664(2) 128(2) yes
N3 H3 N2 2_766 0.870(10) 2.050(10) 2.912(2) 170(2) yes
N7 H7 N10 . 0.870(10) 2.10(2) 2.695(2) 125(2) yes
N8 H8 N6 2_777 0.870(10) 2.050(10) 2.908(2) 170(2) yes
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
C7 N1 C1 C2 . . . . -179.49(17) ?
C7 N1 C1 C6 . . . . 0.26(16) ?
N1 C1 C2 C3 . . . . 178.38(17) ?
C6 C1 C2 C3 . . . . -1.3(2) ?
C1 C2 C3 C4 . . . . 0.4(3) ?
C2 C3 C4 C5 . . . . 0.7(3) ?
C3 C4 C5 C6 . . . . -0.9(3) ?
C4 C5 C6 C1 . . . . 0.0(2) ?
C4 C5 C6 N2 . . . . -178.51(16) ?
N1 C1 C6 C5 . . . . -178.65(14) ?
C2 C1 C6 C5 . . . . 1.1(2) ?
N1 C1 C6 N2 . . . . 0.17(17) ?
C2 C1 C6 N2 . . . . 179.95(14) ?
C7 N2 C6 C5 . . . . 178.13(16) ?
C7 N2 C6 C1 . . . . -0.53(16) ?
C6 N2 C7 N1 . . . . 0.72(17) ?
C6 N2 C7 N3 . . . . -179.09(14) ?
C1 N1 C7 N2 . . . . -0.64(18) ?
C1 N1 C7 N3 . . . . 179.17(14) ?
C8 N3 C7 N2 . . . . 176.24(14) ?
C8 N3 C7 N1 . . . . -3.6(3) ?
C11 N5 C8 N4 . . . . -1.6(2) ?
C11 N5 C8 N3 . . . . 179.66(14) ?
C9 N4 C8 N5 . . . . 0.2(2) ?
C9 N4 C8 N3 . . . . 179.02(13) ?
C7 N3 C8 N5 . . . . 3.8(2) ?
C7 N3 C8 N4 . . . . -175.12(15) ?
C8 N4 C9 C10 . . . . 1.5(2) ?
C8 N4 C9 C12 . . . . -176.69(15) ?
N4 C9 C10 C11 . . . . -1.8(3) ?
C12 C9 C10 C11 . . . . 176.30(16) ?
C8 N5 C11 C10 . . . . 1.2(2) ?
C8 N5 C11 C13 . . . . -179.73(14) ?
C9 C10 C11 N5 . . . . 0.4(3) ?
C9 C10 C11 C13 . . . . -178.64(16) ?
C20 N6 C14 C15 . . . . -179.64(15) ?
C20 N6 C14 C19 . . . . 0.28(16) ?
N6 C14 C15 C16 . . . . -179.89(15) ?
C19 C14 C15 C16 . . . . 0.2(2) ?
C14 C15 C16 C17 . . . . 0.0(2) ?
C15 C16 C17 C18 . . . . 0.2(3) ?
C16 C17 C18 C19 . . . . -0.6(2) ?
C20 N7 C19 C18 . . . . -179.50(16) ?
C20 N7 C19 C14 . . . . 0.38(16) ?
C17 C18 C19 N7 . . . . -179.37(15) ?
C17 C18 C19 C14 . . . . 0.8(2) ?
C15 C14 C19 N7 . . . . 179.52(13) ?
N6 C14 C19 N7 . . . . -0.42(16) ?
C15 C14 C19 C18 . . . . -0.6(2) ?
N6 C14 C19 C18 . . . . 179.48(14) ?
C14 N6 C20 N7 . . . . -0.03(17) ?
C14 N6 C20 N8 . . . . 179.56(13) ?
C19 N7 C20 N6 . . . . -0.23(17) ?
C19 N7 C20 N8 . . . . -179.82(14) ?
C21 N8 C20 N6 . . . . 177.63(14) ?
C21 N8 C20 N7 . . . . -2.8(3) ?
C24 N10 C21 N9 . . . . 0.1(2) ?
C24 N10 C21 N8 . . . . 179.65(13) ?
C22 N9 C21 N10 . . . . 0.6(2) ?
C22 N9 C21 N8 . . . . -178.95(13) ?
C20 N8 C21 N10 . . . . 1.4(2) ?
C20 N8 C21 N9 . . . . -179.03(14) ?
C21 N9 C22 C23 . . . . -1.1(2) ?
C21 N9 C22 C25 . . . . 177.35(14) ?
N9 C22 C23 C24 . . . . 1.0(2) ?
C25 C22 C23 C24 . . . . -177.42(16) ?
C21 N10 C24 C23 . . . . -0.3(2) ?
C21 N10 C24 C26 . . . . -179.39(14) ?
C22 C23 C24 N10 . . . . -0.2(2) ?
C22 C23 C24 C26 . . . . 178.81(16) ?
