#------------------------------------------------------------------------------
#$Date: 2016-03-25 12:38:46 +0100 (vie 25 de mar de 2016) $
#$Revision: 179855 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/51/7015179.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_7015179
loop_
_publ_author_name
'Coetzee, Jacorien'
'Cronje, Stephanie'
'Dobrzańska, Liliana'
'Raubenheimer, Helgard G.'
'Jooné, Gisela'
'Nell, Margo J.'
'Hoppe, Heinrich C.'
_publ_section_title
;
 Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis,
 characterisation and screening for antitumour and antimalarial
 activity.
;
_journal_issue                   7
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              1471
_journal_page_last               1483
_journal_paper_doi               10.1039/c0dt01312a
_journal_volume                  40
_journal_year                    2011
_chemical_formula_moiety         'C27 H26 Au N3 P, N O3'
_chemical_formula_sum            'C27 H26 Au N4 O3 P'
_chemical_formula_weight         682.45
_chemical_melting_point          '126-128 ^o^C'
_chemical_name_common            work
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 96.825(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.3222(16)
_cell_length_b                   15.499(3)
_cell_length_c                   17.446(3)
_cell_measurement_reflns_used    6944
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      26.376
_cell_measurement_theta_min      2.625
_cell_volume                     2502.8(8)
_computing_cell_refinement       'SAINT (Bruker, 2003)'
_computing_data_collection       'SMART (Bruker, 2003)'
_computing_data_reduction        SAINT
_computing_molecular_graphics    'X-Seed (Barbour, 2003)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.962
_diffrn_measurement_device_type  'Bruker APEX CCD area-detector'
_diffrn_measurement_method       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  0.0269
_diffrn_reflns_av_sigmaI/netI    0.0336
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            13604
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         26.40
_diffrn_reflns_theta_min         1.76
_exptl_absorpt_coefficient_mu    5.979
_exptl_absorpt_correction_T_max  0.7542
_exptl_absorpt_correction_T_min  0.4674
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1997)'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.811
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1336
_exptl_crystal_size_max          0.15
_exptl_crystal_size_mid          0.07
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.515
_refine_diff_density_min         -0.549
_refine_diff_density_rms         0.128
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.081
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     327
_refine_ls_number_reflns         4946
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.081
_refine_ls_R_factor_all          0.0332
_refine_ls_R_factor_gt           0.0254
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0298P)²+0.4369P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0568
_refine_ls_wR_factor_ref         0.0610
_reflns_number_gt                4219
_reflns_number_total             4946
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c0dt01312a.txt
_cod_data_source_block           4b
_cod_original_cell_volume        2502.7(8)
_cod_original_sg_symbol_H-M      P21/c
_cod_database_code               7015179
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'
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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Au1 Au 0.280305(14) 0.371680(8) 0.026725(7) 0.01627(6) Uani 1 1 d . . .
P1 P 0.32583(10) 0.24356(6) 0.08260(5) 0.01455(19) Uani 1 1 d . . .
O1 O 0.1872(3) 0.69901(18) 0.12406(15) 0.0313(7) Uani 1 1 d . . .
N1 N 0.2101(3) 0.56946(19) -0.14719(16) 0.0166(7) Uani 1 1 d . . .
O2 O 0.0586(3) 0.61523(17) 0.04363(16) 0.0279(7) Uani 1 1 d . . .
N2 N 0.3991(3) 0.48297(19) -0.12896(17) 0.0169(7) Uani 1 1 d . . .
O3 O 0.1715(3) 0.56285(18) 0.14927(16) 0.0291(7) Uani 1 1 d . . .
N3 N 0.2376(3) 0.4842(2) -0.03238(16) 0.0178(7) Uani 1 1 d . . .
H11 H 0.1827 0.5209 -0.0108 0.021 Uiso 1 1 calc R . .
N4 N 0.1390(3) 0.6259(2) 0.10572(19) 0.0206(7) Uani 1 1 d . . .
C111 C 0.2454(4) 0.1579(2) 0.02088(19) 0.0154(8) Uani 1 1 d . . .
C112 C 0.1066(4) 0.1704(2) -0.0156(2) 0.0186(8) Uani 1 1 d . . .
H112 H 0.0581 0.2234 -0.0095 0.022 Uiso 1 1 calc R . .
C113 C 0.0381(4) 0.1053(3) -0.0614(2) 0.0227(9) Uani 1 1 d . . .
H113 H -0.0573 0.1137 -0.0860 0.027 Uiso 1 1 calc R . .
C114 C 0.1087(4) 0.0290(3) -0.0707(2) 0.0241(9) Uani 1 1 d . . .
H114 H 0.0618 -0.0151 -0.1022 0.029 Uiso 1 1 calc R . .
C115 C 0.2478(4) 0.0157(3) -0.0348(2) 0.0254(9) Uani 1 1 d . . .
H115 H 0.2959 -0.0372 -0.0418 0.030 Uiso 1 1 calc R . .
C116 C 0.3167(4) 0.0800(2) 0.0116(2) 0.0207(8) Uani 1 1 d . . .
H116 H 0.4117 0.0710 0.0367 0.025 Uiso 1 1 calc R . .
C121 C 0.2569(4) 0.2265(2) 0.1743(2) 0.0158(8) Uani 1 1 d . . .
C122 C 0.2006(4) 0.1476(2) 0.1940(2) 0.0188(8) Uani 1 1 d . . .
H122 H 0.1986 0.1002 0.1594 0.023 Uiso 1 1 calc R . .
C123 C 0.1471(4) 0.1384(2) 0.2646(2) 0.0201(8) Uani 1 1 d . . .
H123 H 0.1057 0.0851 0.2776 0.024 Uiso 1 1 calc R . .
C124 C 0.1539(4) 0.2063(3) 0.3160(2) 0.0243(9) Uani 1 1 d . . .
H124 H 0.1179 0.1996 0.3644 0.029 Uiso 1 1 calc R . .
C125 C 0.2129(4) 0.2841(3) 0.2974(2) 0.0279(10) Uani 1 1 d . . .
H125 H 0.2196 0.3302 0.3335 0.034 Uiso 1 1 calc R . .
C126 C 0.2627(4) 0.2952(2) 0.2261(2) 0.0211(8) Uani 1 1 d . . .
H126 H 0.3004 0.3494 0.2127 0.025 Uiso 1 1 calc R . .
C131 C 0.5174(4) 0.2208(2) 0.0988(2) 0.0153(8) Uani 1 1 d . . .
C132 C 0.5853(4) 0.1909(2) 0.1689(2) 0.0187(8) Uani 1 1 d . . .
H132 H 0.5307 0.1801 0.2105 0.022 Uiso 1 1 calc R . .
C133 C 0.7340(4) 0.1767(2) 0.1780(2) 0.0202(8) Uani 1 1 d . . .
H133 H 0.7807 0.1563 0.2260 0.024 Uiso 1 1 calc R . .
C134 C 0.8139(4) 0.1920(2) 0.1177(2) 0.0204(8) Uani 1 1 d . . .
H134 H 0.9153 0.1825 0.1242 0.024 Uiso 1 1 calc R . .
C135 C 0.7457(4) 0.2213(2) 0.0474(2) 0.0200(8) Uani 1 1 d . . .
H135 H 0.8005 0.2314 0.0058 0.024 Uiso 1 1 calc R . .
C136 C 0.5986(4) 0.2358(2) 0.0379(2) 0.0175(8) Uani 1 1 d . . .
H136 H 0.5525 0.2560 -0.0103 0.021 Uiso 1 1 calc R . .
C211 C 0.2796(4) 0.5099(2) -0.0976(2) 0.0178(8) Uani 1 1 d . . .
C212 C 0.4051(4) 0.5240(2) -0.1995(2) 0.0178(8) Uani 1 1 d . . .
C213 C 0.5017(4) 0.5164(2) -0.2531(2) 0.0224(9) Uani 1 1 d . . .
H7 H 0.5830 0.4792 -0.2451 0.027 Uiso 1 1 calc R . .
C214 C 0.4737(4) 0.5660(2) -0.3194(2) 0.0236(9) Uani 1 1 d . . .
H8 H 0.5367 0.5620 -0.3582 0.028 Uiso 1 1 calc R . .
C215 C 0.3563(5) 0.6214(2) -0.3306(2) 0.0252(9) Uani 1 1 d . . .
H9 H 0.3419 0.6549 -0.3765 0.030 Uiso 1 1 calc R . .
C216 C 0.2590(4) 0.6292(2) -0.2765(2) 0.0223(9) Uani 1 1 d . . .
H10 H 0.1788 0.6674 -0.2840 0.027 Uiso 1 1 calc R . .
C217 C 0.2850(4) 0.5785(2) -0.2112(2) 0.0176(8) Uani 1 1 d . . .
C218 C 0.0654(4) 0.6020(2) -0.1404(2) 0.0215(8) Uani 1 1 d . . .
H1 H -0.0023 0.5535 -0.1414 0.032 Uiso 1 1 calc R . .
H3 H 0.0353 0.6409 -0.1836 0.032 Uiso 1 1 calc R . .
H2 H 0.0659 0.6334 -0.0916 0.032 Uiso 1 1 calc R . .
C219 C 0.4982(4) 0.4148(3) -0.0987(2) 0.0244(9) Uani 1 1 d . . .
H4 H 0.5295 0.4254 -0.0439 0.037 Uiso 1 1 calc R . .
H6 H 0.5826 0.4144 -0.1273 0.037 Uiso 1 1 calc R . .
H5 H 0.4490 0.3589 -0.1047 0.037 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 0.0033 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'
Au Au -2.0133 8.8022 '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'
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
N3 Au1 P1 175.60(8) . . ?
C131 P1 C121 106.30(16) . . ?
C131 P1 C111 106.30(16) . . ?
C121 P1 C111 104.62(16) . . ?
C131 P1 Au1 112.00(12) . . ?
C121 P1 Au1 116.51(12) . . ?
C111 P1 Au1 110.39(12) . . ?
C211 N1 C217 109.2(3) . . ?
C211 N1 C218 123.6(3) . . ?
C217 N1 C218 126.0(3) . . ?
C211 N2 C212 109.6(3) . . ?
C211 N2 C219 126.1(3) . . ?
C212 N2 C219 124.0(3) . . ?
C211 N3 Au1 129.7(3) . . ?
C211 N3 H11 115.1 . . ?
Au1 N3 H11 115.1 . . ?
O1 N4 O3 120.0(3) . . ?
O1 N4 O2 120.2(3) . . ?
O3 N4 O2 119.9(3) . . ?
C112 C111 C116 119.9(4) . . ?
C112 C111 P1 117.9(3) . . ?
C116 C111 P1 122.2(3) . . ?
C111 C112 C113 120.1(4) . . ?
C111 C112 H112 120.0 . . ?
C113 C112 H112 120.0 . . ?
C114 C113 C112 119.9(4) . . ?
C114 C113 H113 120.0 . . ?
C112 C113 H113 120.0 . . ?
C113 C114 C115 120.6(4) . . ?
C113 C114 H114 119.7 . . ?
C115 C114 H114 119.7 . . ?
C114 C115 C116 119.9(4) . . ?
C114 C115 H115 120.0 . . ?
C116 C115 H115 120.0 . . ?
C115 C116 C111 119.5(4) . . ?
C115 C116 H116 120.2 . . ?
C111 C116 H116 120.2 . . ?
C122 C121 C126 119.8(3) . . ?
C122 C121 P1 122.1(3) . . ?
C126 C121 P1 118.1(3) . . ?
C123 C122 C121 119.7(4) . . ?
C123 C122 H122 120.1 . . ?
C121 C122 H122 120.1 . . ?
C124 C123 C122 120.2(4) . . ?
C124 C123 H123 119.9 . . ?
C122 C123 H123 119.9 . . ?
C125 C124 C123 120.2(4) . . ?
C125 C124 H124 119.9 . . ?
C123 C124 H124 119.9 . . ?
C124 C125 C126 120.3(4) . . ?
C124 C125 H125 119.9 . . ?
C126 C125 H125 119.9 . . ?
C125 C126 C121 119.7(3) . . ?
C125 C126 H126 120.2 . . ?
C121 C126 H126 120.2 . . ?
C132 C131 C136 119.6(3) . . ?
C132 C131 P1 122.8(3) . . ?
C136 C131 P1 117.6(3) . . ?
C131 C132 C133 119.7(3) . . ?
C131 C132 H132 120.1 . . ?
C133 C132 H132 120.1 . . ?
C134 C133 C132 120.4(4) . . ?
C134 C133 H133 119.8 . . ?
C132 C133 H133 119.8 . . ?
C133 C134 C135 119.8(4) . . ?
C133 C134 H134 120.1 . . ?
C135 C134 H134 120.1 . . ?
C136 C135 C134 120.3(4) . . ?
C136 C135 H135 119.9 . . ?
C134 C135 H135 119.9 . . ?
C135 C136 C131 120.1(3) . . ?
C135 C136 H136 119.9 . . ?
C131 C136 H136 119.9 . . ?
N3 C211 N2 126.7(3) . . ?
N3 C211 N1 125.8(3) . . ?
N2 C211 N1 107.5(3) . . ?
C213 C212 N2 131.2(3) . . ?
C213 C212 C217 121.9(3) . . ?
N2 C212 C217 106.8(3) . . ?
C212 C213 C214 116.4(4) . . ?
C212 C213 H7 121.8 . . ?
C214 C213 H7 121.8 . . ?
C215 C214 C213 121.8(4) . . ?
C215 C214 H8 119.1 . . ?
C213 C214 H8 119.1 . . ?
C214 C215 C216 121.8(4) . . ?
C214 C215 H9 119.1 . . ?
C216 C215 H9 119.1 . . ?
C217 C216 C215 116.4(4) . . ?
C217 C216 H10 121.8 . . ?
C215 C216 H10 121.8 . . ?
C216 C217 N1 131.5(4) . . ?
C216 C217 C212 121.6(3) . . ?
N1 C217 C212 107.0(3) . . ?
N1 C218 H1 109.5 . . ?
N1 C218 H3 109.5 . . ?
H1 C218 H3 109.5 . . ?
N1 C218 H2 109.5 . . ?
H1 C218 H2 109.5 . . ?
H3 C218 H2 109.5 . . ?
N2 C219 H4 109.5 . . ?
N2 C219 H6 109.5 . . ?
H4 C219 H6 109.5 . . ?
N2 C219 H5 109.5 . . ?
H4 C219 H5 109.5 . . ?
H6 C219 H5 109.5 . . ?
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
Au1 N3 2.040(3) . ?
Au1 P1 2.2305(10) . ?
P1 C131 1.809(4) . ?
P1 C121 1.812(4) . ?
P1 C111 1.814(4) . ?
O1 N4 1.246(4) . ?
N1 C211 1.373(5) . ?
N1 C217 1.393(4) . ?
N1 C218 1.458(4) . ?
O2 N4 1.253(4) . ?
N2 C211 1.364(4) . ?
N2 C212 1.392(4) . ?
N2 C219 1.460(4) . ?
O3 N4 1.253(4) . ?
N3 C211 1.309(4) . ?
N3 H11 0.8800 . ?
C111 C112 1.387(5) . ?
C111 C116 1.396(6) . ?
C112 C113 1.393(5) . ?
C112 H112 0.9500 . ?
C113 C114 1.373(5) . ?
C113 H113 0.9500 . ?
C114 C115 1.387(5) . ?
C114 H114 0.9500 . ?
C115 C116 1.392(5) . ?
C115 H115 0.9500 . ?
C116 H116 0.9500 . ?
C121 C122 1.391(5) . ?
C121 C126 1.394(5) . ?
C122 C123 1.390(5) . ?
C122 H122 0.9500 . ?
C123 C124 1.380(5) . ?
C123 H123 0.9500 . ?
C124 C125 1.379(5) . ?
C124 H124 0.9500 . ?
C125 C126 1.389(5) . ?
C125 H125 0.9500 . ?
C126 H126 0.9500 . ?
C131 C132 1.389(5) . ?
C131 C136 1.395(5) . ?
C132 C133 1.394(5) . ?
C132 H132 0.9500 . ?
C133 C134 1.380(5) . ?
C133 H133 0.9500 . ?
C134 C135 1.388(5) . ?
C134 H134 0.9500 . ?
C135 C136 1.380(5) . ?
C135 H135 0.9500 . ?
C136 H136 0.9500 . ?
C212 C213 1.379(5) . ?
C212 C217 1.397(5) . ?
C213 C214 1.388(5) . ?
C213 H7 0.9500 . ?
C214 C215 1.386(6) . ?
C214 H8 0.9500 . ?
C215 C216 1.390(6) . ?
C215 H9 0.9500 . ?
C216 C217 1.382(5) . ?
C216 H10 0.9500 . ?
C218 H1 0.9800 . ?
C218 H3 0.9800 . ?
C218 H2 0.9800 . ?
C219 H4 0.9800 . ?
C219 H6 0.9800 . ?
C219 H5 0.9800 . ?
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
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C131 P1 C111 C112 -164.6(3) . . . . ?
C121 P1 C111 C112 83.2(3) . . . . ?
Au1 P1 C111 C112 -42.9(3) . . . . ?
C131 P1 C111 C116 17.6(3) . . . . ?
C121 P1 C111 C116 -94.6(3) . . . . ?
Au1 P1 C111 C116 139.3(3) . . . . ?
C116 C111 C112 C113 0.2(5) . . . . ?
P1 C111 C112 C113 -177.6(3) . . . . ?
C111 C112 C113 C114 -0.5(5) . . . . ?
C112 C113 C114 C115 0.3(6) . . . . ?
C113 C114 C115 C116 0.3(6) . . . . ?
C114 C115 C116 C111 -0.6(6) . . . . ?
C112 C111 C116 C115 0.4(5) . . . . ?
P1 C111 C116 C115 178.1(3) . . . . ?
C131 P1 C121 C122 -92.5(3) . . . . ?
C111 P1 C121 C122 19.7(3) . . . . ?
Au1 P1 C121 C122 141.9(3) . . . . ?
C131 P1 C121 C126 86.9(3) . . . . ?
C111 P1 C121 C126 -160.9(3) . . . . ?
Au1 P1 C121 C126 -38.7(3) . . . . ?
C126 C121 C122 C123 1.5(5) . . . . ?
P1 C121 C122 C123 -179.0(3) . . . . ?
C121 C122 C123 C124 -2.0(6) . . . . ?
C122 C123 C124 C125 0.5(6) . . . . ?
C123 C124 C125 C126 1.6(6) . . . . ?
C124 C125 C126 C121 -2.0(6) . . . . ?
C122 C121 C126 C125 0.5(6) . . . . ?
P1 C121 C126 C125 -179.0(3) . . . . ?
C121 P1 C131 C132 3.9(3) . . . . ?
C111 P1 C131 C132 -107.2(3) . . . . ?
Au1 P1 C131 C132 132.1(3) . . . . ?
C121 P1 C131 C136 -175.2(3) . . . . ?
C111 P1 C131 C136 73.8(3) . . . . ?
Au1 P1 C131 C136 -46.9(3) . . . . ?
C136 C131 C132 C133 0.5(5) . . . . ?
P1 C131 C132 C133 -178.4(3) . . . . ?
C131 C132 C133 C134 -0.2(5) . . . . ?
C132 C133 C134 C135 -0.3(6) . . . . ?
C133 C134 C135 C136 0.5(6) . . . . ?
C134 C135 C136 C131 -0.2(6) . . . . ?
C132 C131 C136 C135 -0.4(5) . . . . ?
P1 C131 C136 C135 178.7(3) . . . . ?
Au1 N3 C211 N2 -24.4(5) . . . . ?
Au1 N3 C211 N1 155.5(3) . . . . ?
C212 N2 C211 N3 178.8(3) . . . . ?
C219 N2 C211 N3 5.1(6) . . . . ?
C212 N2 C211 N1 -1.1(4) . . . . ?
C219 N2 C211 N1 -174.8(3) . . . . ?
C217 N1 C211 N3 -178.6(3) . . . . ?
C218 N1 C211 N3 -10.9(6) . . . . ?
C217 N1 C211 N2 1.4(4) . . . . ?
C218 N1 C211 N2 169.1(3) . . . . ?
C211 N2 C212 C213 -177.9(4) . . . . ?
C219 N2 C212 C213 -4.1(6) . . . . ?
C211 N2 C212 C217 0.4(4) . . . . ?
C219 N2 C212 C217 174.3(3) . . . . ?
N2 C212 C213 C214 178.4(4) . . . . ?
C217 C212 C213 C214 0.2(5) . . . . ?
C212 C213 C214 C215 1.0(6) . . . . ?
C213 C214 C215 C216 -1.0(6) . . . . ?
C214 C215 C216 C217 -0.4(6) . . . . ?
C215 C216 C217 N1 -179.1(4) . . . . ?
C215 C216 C217 C212 1.7(5) . . . . ?
C211 N1 C217 C216 179.6(4) . . . . ?
C218 N1 C217 C216 12.3(6) . . . . ?
C211 N1 C217 C212 -1.1(4) . . . . ?
C218 N1 C217 C212 -168.5(3) . . . . ?
C213 C212 C217 C216 -1.7(6) . . . . ?
N2 C212 C217 C216 179.8(3) . . . . ?
C213 C212 C217 N1 179.0(3) . . . . ?
N2 C212 C217 N1 0.4(4) . . . . ?
