#------------------------------------------------------------------------------
#$Date: 2019-11-24 09:27:40 +0200 (Sun, 24 Nov 2019) $
#$Revision: 237466 $
#$URL: file:///home/coder/svn-repositories/cod/cif/7/23/71/7237163.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_7237163
loop_
_publ_author_name
'Wang, Zheng'
'Zhang, Jian-Hua'
'Jiang, Ji-Jun'
'Wang, Hai-Ping'
'Wei, Zhang-Wen'
'Zhu, Xunjin'
'Pan, Mei'
'Su, Cheng-Yong'
_publ_section_title
;
 A stable metal cluster-metalloporphyrin MOF with high capacity for
 cationic dye removal
;
_journal_issue                   36
_journal_name_full               'Journal of Materials Chemistry A'
_journal_page_first              17698
_journal_paper_doi               10.1039/C8TA06249H
_journal_volume                  6
_journal_year                    2018
_chemical_formula_sum            'C96 H48 Cl2 Cu4.5 N40 O0.5'
_chemical_formula_weight         2126.57
_space_group_IT_number           10
_space_group_name_Hall           '-P 2y'
_space_group_name_H-M_alt        'P 1 2/m 1'
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 1 2/m 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_audit_update_record
;
2017-12-21 deposited with the CCDC.
2018-08-21 downloaded from the CCDC.
;
_cell_angle_alpha                90.00
_cell_angle_beta                 99.771(4)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   16.9552(10)
_cell_length_b                   19.4089(10)
_cell_length_c                   18.5986(9)
_cell_measurement_reflns_used    3201
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      52.1062
_cell_measurement_theta_min      2.2764
_cell_volume                     6031.7(6)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.983
_diffrn_measurement_device_type  bruker-CCD
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0000
_diffrn_reflns_av_sigmaI/netI    0.1014
_diffrn_reflns_limit_h_max       17
_diffrn_reflns_limit_h_min       -17
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       19
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            7180
_diffrn_reflns_theta_full        52.99
_diffrn_reflns_theta_max         52.99
_diffrn_reflns_theta_min         2.28
_exptl_absorpt_coefficient_mu    1.752
_exptl_absorpt_correction_T_max  0.8583
_exptl_absorpt_correction_T_min  0.8307
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   sadabs
_exptl_crystal_colour            purple
_exptl_crystal_density_diffrn    1.171
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       slice
_exptl_crystal_F_000             2145
_exptl_crystal_size_max          0.11
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.09
_platon_squeeze_details
;
;
_refine_diff_density_max         1.327
_refine_diff_density_min         -0.855
_refine_diff_density_rms         0.115
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.051
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     956
_refine_ls_number_reflns         7180
_refine_ls_number_restraints     1924
_refine_ls_restrained_S_all      1.118
_refine_ls_R_factor_all          0.1904
_refine_ls_R_factor_gt           0.1360
_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)+(0.0100P)²+70.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2756
_refine_ls_wR_factor_ref         0.2927
_reflns_number_gt                3520
_reflns_number_total             7180
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c8ta06249h2.cif
_cod_data_source_block           wwzz
_cod_original_sg_symbol_H-M      P2/m
_cod_original_formula_sum        'C96 H48 Cl2 Cu4.50 N40 O0.50'
_cod_database_code               7237163
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z'
'-x, -y, -z'
'x, -y, z'
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
O1W O -2.0000 0.5000 -1.5000 0.188(8) Uani 1 4 d SDU
H1WA H -1.9767 0.5404 -1.4814 0.282 Uiso 0.50 1 d PR
Cu1 Cu -2.5071(2) 1.0000 -1.80210(15) 0.0760(9) Uani 1 2 d SU
Cu2 Cu -2.0000 0.5000 -2.0000 0.0780(13) Uani 1 4 d SU
Cu3 Cu -2.0149(4) 0.5000 -1.6276(3) 0.177(2) Uani 1 2 d SDU
Cu4 Cu -2.0100(2) 0.5000 -1.81219(18) 0.0952(11) Uani 1 2 d SU
Cu5 Cu -2.3804(2) 0.5000 -1.47410(15) 0.0800(10) Uani 1 2 d SU
N1 N -2.6265(11) 1.0000 -1.8270(9) 0.081(4) Uani 1 2 d SU
N2 N -2.5056(7) 0.8971(5) -1.8026(6) 0.072(3) Uani 1 1 d U
N3 N -2.3891(11) 1.0000 -1.7778(9) 0.086(4) Uani 1 2 d SU
N4 N -2.9090(7) 0.6230(6) -1.8255(7) 0.084(3) Uani 1 1 d U
N5 N -2.9526(8) 0.5711(6) -1.8589(7) 0.084(3) Uani 1 1 d U
N6 N -2.9526(7) 0.5718(6) -1.9315(6) 0.073(3) Uani 1 1 d U
N7 N -2.9058(8) 0.6242(6) -1.9440(7) 0.085(3) Uani 1 1 d U
N8 N -2.1056(9) 0.6236(8) -1.7945(8) 0.113(4) Uani 1 1 d U
N9 N -2.0607(10) 0.5708(8) -1.7624(9) 0.124(4) Uani 1 1 d U
N10 N -2.0632(11) 0.5715(9) -1.6918(10) 0.142(4) Uani 1 1 d U
N11 N -2.1040(10) 0.6257(9) -1.6708(9) 0.134(4) Uani 1 1 d U
N12A N -2.3854(14) 0.5569(10) -1.5671(9) 0.083(5) Uani 0.50 1 d PDU
N12 N -2.3762(15) 0.4426(10) -1.3821(10) 0.084(5) Uani 0.50 1 d PDU
N13A N -2.3760(15) 0.5872(9) -1.4130(10) 0.083(5) Uani 0.50 1 d PDU
N13 N -2.3784(14) 0.4099(9) -1.5312(10) 0.084(5) Uani 0.50 1 d PDU
N14A N -2.4121(10) 1.0000 -1.5933(10) 0.107(5) Uani 1 2 d SDU
N14 N -2.2817(11) 0.0000 -1.3580(12) 0.137(6) Uani 1 2 d SDU
N15A N -2.3850(11) 1.0662(6) -1.5991(15) 0.118(7) Uani 0.50 1 d PDU
N15 N -2.3047(12) -0.0667(6) -1.3488(17) 0.144(7) Uani 0.50 1 d PDU
N16A N -2.3043(11) 1.0667(6) -1.5726(15) 0.121(7) Uani 0.50 1 d PDU
N16 N -2.3869(12) -0.0668(6) -1.3558(17) 0.141(7) Uani 0.50 1 d PDU
N17A N -2.2828(10) 1.0000 -1.5530(10) 0.120(5) Uani 1 2 d SDU
H17A H -2.2330 0.9855 -1.5346 0.144 Uiso 0.50 1 d PR
N17 N -2.4133(11) 0.0000 -1.3699(11) 0.132(6) Uani 1 2 d SDU
H17B H -2.4643 0.0147 -1.3752 0.158 Uiso 0.50 1 d PR
N18A N -2.4122(14) 0.6137(19) -0.9564(13) 0.160(8) Uani 0.50 1 d PDU
H18A H -2.4625 0.6219 -0.9790 0.192 Uiso 0.50 1 d PR
N18 N -2.4191(18) 0.393(2) -2.001(2) 0.194(9) Uani 0.50 1 d PDU
H18B H -2.4671 0.3797 -1.9915 0.232 Uiso 0.50 1 d PR
N19A N -2.3846(18) 0.6183(18) -0.8822(12) 0.156(9) Uani 0.50 1 d PDU
N19 N -2.394(3) 0.390(2) -2.0676(17) 0.215(10) Uani 0.50 1 d PDU
N20A N -2.3063(18) 0.5962(19) -0.8692(11) 0.167(9) Uani 0.50 1 d PDU
N20 N -2.319(3) 0.420(2) -2.059(2) 0.221(11) Uani 0.50 1 d PDU
N21A N -2.2826(13) 0.5851(18) -0.9362(13) 0.160(8) Uani 0.50 1 d PDU
N21 N -2.2962(19) 0.439(2) -1.986(2) 0.224(10) Uani 0.50 1 d PDU
Cl1 Cl -1.8968(7) 0.5000 -1.6980(7) 0.230(4) Uani 1 2 d SU
Cl2 Cl -2.1165(6) 0.5000 -1.9284(5) 0.171(3) Uani 1 2 d SU
C1 C -2.7586(10) 0.9642(7) -1.8498(8) 0.097(4) Uani 1 1 d U
H1 H -2.8042 0.9349 -1.8572 0.116 Uiso 1 1 calc R
C2 C -2.6775(10) 0.9437(8) -1.8367(9) 0.090(4) Uani 1 1 d U
C3 C -2.6514(10) 0.8750(7) -1.8324(8) 0.078(3) Uani 1 1 d U
C4 C -2.5745(10) 0.8557(7) -1.8190(7) 0.075(3) Uani 1 1 d U
C5 C -2.5473(10) 0.7822(7) -1.8179(8) 0.081(4) Uani 1 1 d U
H5 H -2.5804 0.7426 -1.8271 0.097 Uiso 1 1 calc R
C6 C -2.4685(10) 0.7832(7) -1.8015(8) 0.082(4) Uani 1 1 d U
H6 H -2.4351 0.7436 -1.7967 0.098 Uiso 1 1 calc R
C7 C -2.4396(10) 0.8558(7) -1.7918(7) 0.075(3) Uani 1 1 d U
C8 C -2.3644(11) 0.8770(8) -1.7767(8) 0.089(4) Uani 1 1 d U
C9 C -2.3391(11) 0.9447(9) -1.7709(9) 0.094(4) Uani 1 1 d U
C10 C -2.2612(11) 0.9653(7) -1.7612(9) 0.099(4) Uani 1 1 d U
H10 H -2.2155 0.9362 -1.7554 0.119 Uiso 1 1 calc R
C11 C -2.7162(9) 0.8206(8) -1.8445(9) 0.083(4) Uani 1 1 d U
C12 C -2.7363(11) 0.7923(9) -1.9103(9) 0.106(5) Uani 1 1 d U
H12A H -2.7081 0.8063 -1.9478 0.128 Uiso 1 1 calc R
C13 C -2.7961(11) 0.7435(9) -1.9269(10) 0.111(5) Uani 1 1 d U
H13A H -2.8143 0.7305 -1.9761 0.134 Uiso 1 1 calc R
C14 C -2.8284(10) 0.7144(8) -1.8725(9) 0.090(4) Uani 1 1 d U
C15 C -2.8047(10) 0.7413(9) -1.8008(9) 0.099(4) Uani 1 1 d U
H15A H -2.8274 0.7237 -1.7612 0.119 Uiso 1 1 calc R
C16 C -2.7474(10) 0.7942(8) -1.7894(9) 0.100(4) Uani 1 1 d U
H16A H -2.7306 0.8115 -1.7415 0.119 Uiso 1 1 calc R
C17 C -2.8858(9) 0.6540(8) -1.8821(8) 0.081(4) Uani 1 1 d U
C18 C -2.3002(11) 0.8217(9) -1.7656(10) 0.098(4) Uani 1 1 d U
C19 C -2.2737(12) 0.7944(10) -1.8246(11) 0.133(5) Uani 1 1 d U
H19A H -2.2923 0.8135 -1.8714 0.159 Uiso 1 1 calc R
C20 C -2.2162(12) 0.7355(11) -1.8180(11) 0.134(5) Uani 1 1 d U
H20A H -2.1990 0.7146 -1.8589 0.161 Uiso 1 1 calc R
C21 C -2.1914(12) 0.7147(10) -1.7492(11) 0.114(5) Uani 1 1 d U
C22 C -2.2149(11) 0.7446(10) -1.6889(10) 0.118(5) Uani 1 1 d U
H22A H -2.1947 0.7294 -1.6408 0.142 Uiso 1 1 calc R
C23 C -2.2699(12) 0.7980(10) -1.7025(11) 0.119(5) Uani 1 1 d U
H23A H -2.2865 0.8210 -1.6619 0.143 Uiso 1 1 d R
C24 C -2.1372(12) 0.6549(10) -1.7416(11) 0.114(5) Uani 1 1 d U
C25A C -2.3867(15) 0.5306(9) -1.6369(12) 0.083(5) Uani 0.50 1 d PDU
C25 C -2.3700(18) 0.4685(8) -1.3120(12) 0.087(5) Uani 0.50 1 d PDU
C26A C -2.3879(16) 0.5857(12) -1.6842(9) 0.090(6) Uani 0.50 1 d PDU
H26A H -2.3906 0.5828 -1.7361 0.108 Uiso 0.50 1 d PR
C26 C -2.3679(17) 0.4132(12) -1.2647(9) 0.088(6) Uani 0.50 1 d PDU
H26B H -2.3671 0.4179 -1.2132 0.106 Uiso 0.50 1 d PR
C27A C -2.3901(19) 0.6457(10) -1.6447(12) 0.090(6) Uani 0.50 1 d PDU
H27A H -2.3944 0.6917 -1.6640 0.107 Uiso 0.50 1 d PR
C27 C -2.3758(19) 0.3537(9) -1.3047(12) 0.086(6) Uani 0.50 1 d PDU
H27B H -2.3805 0.3085 -1.2850 0.103 Uiso 0.50 1 d PR
C28A C -2.3860(18) 0.6275(9) -1.5723(10) 0.083(5) Uani 0.50 1 d PDU
C28 C -2.3789(18) 0.3723(9) -1.3771(10) 0.084(5) Uani 0.50 1 d PDU
C29A C -2.384(2) 0.6747(8) -1.5142(8) 0.092(5) Uani 0.50 1 d PDU
C29 C -2.382(2) 0.3231(9) -1.4332(9) 0.093(5) Uani 0.50 1 d PDU
C30A C -2.3723(15) 0.7485(8) -1.5246(13) 0.093(6) Uani 0.50 1 d PDU
C30 C -2.3680(17) 0.2503(9) -1.4174(13) 0.099(6) Uani 0.50 1 d PDU
C31A C -2.3047(13) 0.7857(11) -1.4985(11) 0.101(7) Uani 0.50 1 d PDU
H31A H -2.2598 0.7625 -1.4703 0.121 Uiso 0.50 1 d PR
C31 C -2.4327(14) 0.2158(13) -1.4009(12) 0.117(7) Uani 0.50 1 d PDU
H31B H -2.4820 0.2402 -1.4014 0.141 Uiso 0.50 1 d PR
C32A C -2.2990(13) 0.8546(11) -1.5121(11) 0.100(7) Uani 0.50 1 d PDU
H32A H -2.2519 0.8801 -1.4915 0.120 Uiso 0.50 1 d PR
C32 C -2.4293(15) 0.1468(13) -1.3861(11) 0.118(7) Uani 0.50 1 d PDU
H32B H -2.4752 0.1232 -1.3742 0.142 Uiso 0.50 1 d PR
C33A C -2.3609(16) 0.8872(7) -1.5564(15) 0.100(6) Uani 0.50 1 d PDU
C33 C -2.3599(19) 0.1114(8) -1.3889(18) 0.125(7) Uani 0.50 1 d PDU
C34A C -2.4300(14) 0.8514(11) -1.5803(13) 0.092(6) Uani 0.50 1 d PDU
H34A H -2.4761 0.8751 -1.6058 0.110 Uiso 0.50 1 d PR
C34 C -2.2965(16) 0.1445(13) -1.4105(17) 0.116(7) Uani 0.50 1 d PDU
H34B H -2.2473 0.1200 -1.4107 0.139 Uiso 0.50 1 d PR
C35A C -2.4334(14) 0.7816(11) -1.5689(14) 0.099(7) Uani 0.50 1 d PDU
H35A H -2.4796 0.7558 -1.5908 0.119 Uiso 0.50 1 d PR
C35 C -2.3017(15) 0.2133(13) -1.4269(16) 0.110(7) Uani 0.50 1 d PDU
H35B H -2.2575 0.2362 -1.4429 0.132 Uiso 0.50 1 d PR
C36A C -2.3734(14) 0.6539(11) -1.4381(9) 0.081(5) Uani 0.50 1 d PDU
C36 C -2.3773(15) 0.3425(11) -1.5072(9) 0.083(5) Uani 0.50 1 d PDU
C37A C -2.3588(17) 0.6974(9) -1.3780(12) 0.091(6) Uani 0.50 1 d PDU
H37A H -2.3546 0.7467 -1.3793 0.109 Uiso 0.50 1 d PR
C37 C -2.3703(17) 0.2987(9) -1.5646(12) 0.087(6) Uani 0.50 1 d PDU
H37B H -2.3676 0.2493 -1.5620 0.104 Uiso 0.50 1 d PR
C38 C -2.366(2) 0.3392(12) -1.6247(10) 0.092(6) Uani 0.50 1 d PDU
H38A H -2.3596 0.3223 -1.6719 0.110 Uiso 0.50 1 d PR
C38A C -2.3519(19) 0.6578(11) -1.3152(10) 0.088(6) Uani 0.50 1 d PDU
H38B H -2.3399 0.6740 -1.2658 0.105 Uiso 0.50 1 d PR
C39A C -2.3623(18) 0.5900(10) -1.3378(10) 0.086(5) Uani 0.50 1 d PDU
C39 C -2.3717(19) 0.4071(10) -1.6036(11) 0.090(5) Uani 0.50 1 d PDU
C40A C -2.364(3) 0.5368(8) -1.2912(10) 0.096(5) Uani 0.50 1 d PDU
C40 C -2.366(2) 0.4630(9) -1.6460(16) 0.095(5) Uani 0.50 1 d PDU
C41A C -2.3490(10) 0.9600(6) -1.5659(17) 0.109(7) Uani 0.50 1 d PDU
C41 C -2.3483(11) 0.0392(7) -1.3742(19) 0.131(7) Uani 0.50 1 d PDU
C42A C -2.3593(16) 0.5514(8) -1.2137(9) 0.108(6) Uani 0.50 1 d PDU
C43A C -2.2902(14) 0.5403(11) -1.1648(12) 0.120(7) Uani 0.50 1 d PDU
H43A H -2.2444 0.5215 -1.1818 0.144 Uiso 0.50 1 d PR
C44A C -2.2869(13) 0.5525(11) -1.0925(11) 0.128(7) Uani 0.50 1 d PDU
H44A H -2.2415 0.5366 -1.0585 0.154 Uiso 0.50 1 d PR
C45A C -2.3547(15) 0.5744(19) -1.0659(9) 0.151(8) Uani 0.50 1 d PDU
C46A C -2.4228(13) 0.5867(17) -1.1162(11) 0.135(8) Uani 0.50 1 d PDU
H46A H -2.4686 0.6057 -1.0992 0.162 Uiso 0.50 1 d PR
C47A C -2.4245(15) 0.5786(16) -1.1894(11) 0.124(7) Uani 0.50 1 d PDU
C48A C -2.3492(15) 0.5944(19) -0.9893(9) 0.154(8) Uani 0.50 1 d PDU
C42 C -2.3698(17) 0.4484(9) -1.7308(11) 0.106(6) Uani 0.50 1 d PDU
C43 C -2.4315(15) 0.4162(14) -1.7747(17) 0.130(8) Uani 0.50 1 d PDU
C47 C -2.3034(16) 0.4701(15) -1.7576(16) 0.136(8) Uani 0.50 1 d PDU
C44 C -2.4293(18) 0.4082(17) -1.8479(16) 0.136(8) Uani 0.50 1 d PDU
C45 C -2.361(2) 0.426(2) -1.8732(12) 0.156(8) Uani 0.50 1 d PDU
C46 C -2.3015(18) 0.4631(17) -1.8307(17) 0.146(8) Uani 0.50 1 d PDU
C48 C -2.358(3) 0.421(2) -1.9505(12) 0.192(9) Uani 0.50 1 d PDU
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.3639 0.7018 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu -1.9646 0.5888 '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
Cu3 O1W Cu3 180.000(2) . 3_162
Cu3 O1W H1WA 110.3 . .
Cu3 O1W H1WA 69.7 3_162 .
N3 Cu1 N2 89.3(4) . 4_575
N3 Cu1 N2 89.3(4) . .
N2 Cu1 N2 178.3(7) 4_575 .
N3 Cu1 N1 179.8(7) . .
N2 Cu1 N1 90.7(4) 4_575 .
N2 Cu1 N1 90.7(4) . .
N6 Cu2 N6 90.3(6) 3_061 2_051
N6 Cu2 N6 180.000(3) 3_061 1_655
N6 Cu2 N6 89.7(7) 2_051 1_655
N6 Cu2 N6 89.7(6) 3_061 4_665
N6 Cu2 N6 180.000(4) 2_051 4_665
N6 Cu2 N6 90.3(6) 1_655 4_665
N6 Cu2 Cl2 86.0(4) 3_061 3_161
N6 Cu2 Cl2 86.0(4) 2_051 3_161
N6 Cu2 Cl2 94.0(4) 1_655 3_161
N6 Cu2 Cl2 94.0(4) 4_665 3_161
N6 Cu2 Cl2 94.0(4) 3_061 .
N6 Cu2 Cl2 94.0(4) 2_051 .
N6 Cu2 Cl2 86.0(4) 1_655 .
N6 Cu2 Cl2 86.0(4) 4_665 .
Cl2 Cu2 Cl2 180.000(2) 3_161 .
N10 Cu3 N10 92.5(10) 4_565 .
N10 Cu3 O1W 126.2(6) 4_565 .
N10 Cu3 O1W 126.2(5) . .
N10 Cu3 Cl1 88.3(6) 4_565 .
N10 Cu3 Cl1 88.3(6) . .
O1W Cu3 Cl1 123.8(4) . .
N9 Cu4 N9 90.4(9) . 4_565
N9 Cu4 N5 90.3(6) . 1_655
N9 Cu4 N5 176.7(7) 4_565 1_655
N9 Cu4 N5 176.7(7) . 4_665
N9 Cu4 N5 90.3(5) 4_565 4_665
N5 Cu4 N5 88.8(7) 1_655 4_665
N9 Cu4 Cl2 95.6(6) . .
N9 Cu4 Cl2 95.6(6) 4_565 .
N5 Cu4 Cl2 87.6(4) 1_655 .
N5 Cu4 Cl2 87.6(4) 4_665 .
N9 Cu4 Cl1 86.3(6) . .
N9 Cu4 Cl1 86.3(6) 4_565 .
N5 Cu4 Cl1 90.5(4) 1_655 .
N5 Cu4 Cl1 90.5(4) 4_665 .
Cl2 Cu4 Cl1 177.3(4) . .
N13A Cu5 N13A 112.7(11) . 4_565
N13A Cu5 N12 89.6(8) . .
N13A Cu5 N12 23.1(7) 4_565 .
N13A Cu5 N12 23.1(7) . 4_565
N13A Cu5 N12 89.6(8) 4_565 4_565
N12 Cu5 N12 66.4(11) . 4_565
N13A Cu5 N12A 156.4(8) . 4_565
N13A Cu5 N12A 90.9(8) 4_565 4_565
N12 Cu5 N12A 114.0(8) . 4_565
N12 Cu5 N12A 179.4(10) 4_565 4_565
N13A Cu5 N12A 90.9(8) . .
N13A Cu5 N12A 156.4(8) 4_565 .
N12 Cu5 N12A 179.4(10) . .
N12 Cu5 N12A 114.0(8) 4_565 .
N12A Cu5 N12A 65.6(11) 4_565 .
N13A Cu5 N13 65.0(8) . 4_565
N13A Cu5 N13 176.3(9) 4_565 4_565
N12 Cu5 N13 154.5(8) . 4_565
N12 Cu5 N13 88.1(8) 4_565 4_565
N12A Cu5 N13 91.5(9) 4_565 4_565
N12A Cu5 N13 26.0(7) . 4_565
N13A Cu5 N13 176.3(9) . .
N13A Cu5 N13 65.0(8) 4_565 .
N12 Cu5 N13 88.1(8) . .
N12 Cu5 N13 154.5(8) 4_565 .
N12A Cu5 N13 26.0(7) 4_565 .
N12A Cu5 N13 91.5(9) . .
N13 Cu5 N13 117.2(11) 4_565 .
C2 N1 C2 104.2(19) 4_575 .
C2 N1 Cu1 127.9(9) 4_575 .
C2 N1 Cu1 127.9(9) . .
C7 N2 C4 109.0(12) . .
C7 N2 Cu1 126.8(10) . .
C4 N2 Cu1 124.1(10) . .
C9 N3 C9 104(2) 4_575 .
C9 N3 Cu1 127.8(10) 4_575 .
C9 N3 Cu1 127.8(10) . .
C17 N4 N5 100.8(12) . .
N4 N5 N6 111.2(12) . .
N4 N5 Cu4 126.7(10) . 1_455
N6 N5 Cu4 122.1(9) . 1_455
N7 N6 N5 106.4(11) . .
N7 N6 Cu2 128.2(9) . 1_455
N5 N6 Cu2 124.9(9) . 1_455
C17 N7 N6 105.2(12) . .
C24 N8 N9 106.5(16) . .
N10 N9 N8 108.7(16) . .
N10 N9 Cu4 125.0(14) . .
N8 N9 Cu4 126.0(13) . .
N9 N10 N11 113.6(18) . .
N9 N10 Cu3 121.9(15) . .
N11 N10 Cu3 124.5(14) . .
N10 N11 C24 100.4(15) . .
N13 N12A C39 89(2) 4_565 4_565
N13 N12A C28A 49.6(16) 4_565 .
C39 N12A C28A 43.6(13) 4_565 .
N13 N12A C25A 155.9(19) 4_565 .
C39 N12A C25A 66.5(14) 4_565 .
C28A N12A C25A 107.5(10) . .
N13 N12A C40 144(2) 4_565 4_565
C39 N12A C40 56.9(13) 4_565 4_565
C28A N12A C40 100.1(13) . 4_565
C25A N12A C40 14.6(16) . 4_565
N13 N12A Cu5 77.4(14) 4_565 .
C39 N12A Cu5 161(3) 4_565 .
C28A N12A Cu5 126.8(14) . .
C25A N12A Cu5 125.7(14) . .
C40 N12A Cu5 131.1(16) 4_565 .
N13A N12 C39A 96(2) 4_565 4_565
N13A N12 C28 49.0(17) 4_565 .
C39A N12 C28 48.9(13) 4_565 .
N13A N12 C25 156(2) 4_565 .
C39A N12 C25 60.0(13) 4_565 .
C28 N12 C25 107.3(10) . .
N13A N12 C40A 148(2) 4_565 4_565
C39A N12 C40A 52.0(11) 4_565 4_565
C28 N12 C40A 99.6(11) . 4_565
C25 N12 C40A 8.1(12) . 4_565
N13A N12 Cu5 78.4(16) 4_565 .
C39A N12 Cu5 168(3) 4_565 .
C28 N12 Cu5 127.3(14) . .
C25 N12 Cu5 125.5(14) . .
C40A N12 Cu5 133.1(14) 4_565 .
N12 N13A C28 95(2) 4_565 4_565
N12 N13A C39A 48.2(18) 4_565 .
C28 N13A C39A 48.5(13) 4_565 .
N12 N13A C36A 155(2) 4_565 .
C28 N13A C36A 60.9(13) 4_565 .
C39A N13A C36A 107.3(10) . .
N12 N13A C29 147(2) 4_565 4_565
C28 N13A C29 52.2(11) 4_565 4_565
C39A N13A C29 99.8(11) . 4_565
C36A N13A C29 10.0(12) . 4_565
N12 N13A Cu5 78.4(17) 4_565 .
C28 N13A Cu5 172(2) 4_565 .
C39A N13A Cu5 125.7(14) . .
C36A N13A Cu5 126.3(14) . .
C29 N13A Cu5 134.5(12) 4_565 .
N12A N13 C28A 88.3(18) 4_565 4_565
N12A N13 C39 48.5(16) 4_565 .
C28A N13 C39 43.6(13) 4_565 .
N12A N13 C36 152.8(19) 4_565 .
C28A N13 C36 64.7(12) 4_565 .
C39 N13 C36 106.3(10) . .
N12A N13 C29A 145(2) 4_565 4_565
C28A N13 C29A 56.9(11) 4_565 4_565
C39 N13 C29A 99.3(11) . 4_565
C36 N13 C29A 8.3(12) . 4_565
N12A N13 Cu5 76.6(15) 4_565 .
C28A N13 Cu5 164(2) 4_565 .
C39 N13 Cu5 123.6(14) . .
C36 N13 Cu5 129.9(14) . .
C29A N13 Cu5 137.1(13) 4_565 .
C41A N14A C41A 70.3(12) 4_575 .
C41A N14A N15A 108.3(10) 4_575 4_575
C41A N14A N15A 40.4(11) . 4_575
C41A N14A N15A 40.4(11) 4_575 .
C41A N14A N15A 108.3(10) . .
N15A N14A N15A 138(2) 4_575 .
C41 N14 C41 68.4(13) 4 .
C41 N14 N15 108.3(10) 4 4
C41 N14 N15 41.6(12) . 4
C41 N14 N15 41.6(12) 4 .
C41 N14 N15 108.3(10) . .
N15 N14 N15 141(2) 4 .
C41A N15A C33A 82(2) 4_575 4_575
C41A N15A N16A 43.2(15) 4_575 .
C33A N15A N16A 63.8(17) 4_575 .
C41A N15A N14A 68.4(9) 4_575 .
C33A N15A N14A 136(3) 4_575 .
N16A N15A N14A 107.7(10) . .
C41A N15A C34A 126(3) 4_575 4_575
C33A N15A C34A 48.5(11) 4_575 4_575
N16A N15A C34A 110.3(14) . 4_575
N14A N15A C34A 130.3(16) . 4_575
C41 N15 N14 68.1(9) 4 .
C41 N15 N16 43.8(17) 4 .
N14 N15 N16 107.1(10) . .
C41 N15 C33 72.2(18) 4 4
N14 N15 C33 134(2) . 4
N16 N15 C33 51.2(17) . 4
C41 N15 C34 106(3) 4 4
N14 N15 C34 128(2) . 4
N16 N15 C34 96.8(18) . 4
C33 N15 C34 45.6(11) 4 4
C41A N16A N15A 43.1(16) 4_575 .
C41A N16A N17A 68.3(9) 4_575 .
N15A N16A N17A 106.9(10) . .
C41A N16A C33A 74.0(17) 4_575 4_575
N15A N16A C33A 52.9(15) . 4_575
N17A N16A C33A 136(2) . 4_575
C41A N16A C32A 109(3) 4_575 4_575
N15A N16A C32A 99.4(16) . 4_575
N17A N16A C32A 128.2(19) . 4_575
C33A N16A C32A 46.6(10) 4_575 4_575
C41 N16 C33 83(2) 4 4
C41 N16 N15 44.6(17) 4 .
C33 N16 N15 65.2(19) 4 .
C41 N16 N17 68.0(9) 4 .
C33 N16 N17 136(3) 4 .
N15 N16 N17 107.9(10) . .
C41 N16 C32 130(3) 4 4
C33 N16 C32 50.9(12) 4 4
N15 N16 C32 112.5(15) . 4
N17 N16 C32 131.6(17) . 4
C41A N17A C41A 70.1(12) 4_575 .
C41A N17A N16A 40.4(11) 4_575 .
C41A N17A N16A 108.6(10) . .
C41A N17A N16A 108.6(10) 4_575 4_575
C41A N17A N16A 40.4(11) . 4_575
N16A N17A N16A 140.1(19) . 4_575
C41A N17A H17A 160.6 4_575 .
C41A N17A H17A 125.7 . .
N16A N17A H17A 125.7 . .
N16A N17A H17A 89.7 4_575 .
C41 N17 C41 68.4(13) . 4
C41 N17 N16 40.8(13) . 4
C41 N17 N16 107.3(10) 4 4
C41 N17 N16 107.3(10) . .
C41 N17 N16 40.8(13) 4 .
N16 N17 N16 139(2) 4 .
C41 N17 H17B 126.4 . .
C41 N17 H17B 161.6 4 .
N16 N17 H17B 89.9 4 .
N16 N17 H17B 126.4 . .
N18 N18A C48 88(3) 4_566 4_566
N18 N18A C48A 60(2) 4_566 .
C48 N18A C48A 36.6(19) 4_566 .
N18 N18A N19A 167(3) 4_566 .
C48 N18A N19A 79.1(18) 4_566 .
C48A N18A N19A 107.8(10) . .
N18 N18A C45 138(4) 4_566 4_566
C48 N18A C45 53.1(16) 4_566 4_566
C48A N18A C45 88.1(16) . 4_566
N19A N18A C45 31.2(18) . 4_566
N18 N18A H18A 66.3 4_566 .
C48 N18A H18A 147.4 4_566 .
C48A N18A H18A 126.1 . .
N19A N18A H18A 126.1 . .
C45 N18A H18A 138.9 4_566 .
N18A N18 C48A 84(3) 4_564 4_564
N18A N18 C48 55(4) 4_564 .
C48A N18 C48 36.1(18) 4_564 .
N18A N18 N19 151(5) 4_564 .
C48A N18 N19 73.5(16) 4_564 .
C48 N18 N19 108.1(11) . .
N18A N18 C45A 135(3) 4_564 4_564
C48A N18 C45A 51.4(14) 4_564 4_564
C48 N18 C45A 81.6(16) . 4_564
N19 N18 C45A 29.4(18) . 4_564
N18A N18 H18B 75.1 4_564 .
C48A N18 H18B 158.4 4_564 .
C48 N18 H18B 125.9 . .
N19 N18 H18B 125.9 . .
C45A N18 H18B 150.1 4_564 .
C45 N19A C44 79(3) 4_566 4_566
C45 N19A N20A 48(3) 4_566 .
C44 N19A N20A 117(3) 4_566 .
C45 N19A N18A 100(3) 4_566 .
C44 N19A N18A 112(3) 4_566 .
N20A N19A N18A 107.9(11) . .
C45 N19A C48 63(2) 4_566 4_566
C44 N19A C48 121(3) 4_566 4_566
N20A N19A C48 66.4(18) . 4_566
N18A N19A C48 43.5(17) . 4_566
C45A N19 C46A 87(4) 4_564 4_564
C45A N19 N20 22(4) 4_564 .
C46A N19 N20 102(5) 4_564 .
C45A N19 N18 105(3) 4_564 .
C46A N19 N18 125(5) 4_564 .
N20 N19 N18 107.5(11) . .
C45A N19 C48A 66.7(19) 4_564 4_564
C46A N19 C48A 144(4) 4_564 4_564
N20 N19 C48A 61.6(14) . 4_564
N18 N19 C48A 47.5(14) . 4_564
C45 N20A C46 69(2) 4_566 4_566
C45 N20A N19A 44(3) 4_566 .
C46 N20A N19A 109(3) 4_566 .
C45 N20A N21A 105(3) 4_566 .
C46 N20A N21A 110(3) 4_566 .
N19A N20A N21A 107.9(11) . .
C45 N20A C48 60.6(19) 4_566 4_566
C46 N20A C48 107(3) 4_566 4_566
N19A N20A C48 63.6(18) . 4_566
N21A N20A C48 48.3(17) . 4_566
C45A N20 C44A 114(6) 4_564 4_564
C45A N20 N19 35(5) 4_564 .
C44A N20 N19 136(5) 4_564 .
C45A N20 N21 105(4) 4_564 .
C44A N20 N21 111(5) 4_564 .
N19 N20 N21 108.4(11) . .
C45A N20 C48A 74(3) 4_564 4_564
C44A N20 C48A 155(5) 4_564 4_564
N19 N20 C48A 64.8(15) . 4_564
N21 N20 C48A 44.4(16) . 4_564
C45A N20 C46A 26(4) 4_564 4_564
C44A N20 C46A 104(3) 4_564 4_564
N19 N20 C46A 33(2) . 4_564
N21 N20 C46A 130(2) . 4_564
C48A N20 C46A 93(2) 4_564 4_564
N21 N21A C48 73(2) 4_566 4_566
N21 N21A C48A 52(2) 4_566 .
C48 N21A C48A 35.7(16) 4_566 .
N21 N21A N20A 146(4) 4_566 .
C48 N21A N20A 76.6(16) 4_566 .
C48A N21A N20A 107.2(10) . .
N21 N21A C45 115(3) 4_566 4_566
C48 N21A C45 48.8(13) 4_566 4_566
C48A N21A C45 83.4(15) . 4_566
N20A N21A C45 30.5(16) . 4_566
N21A N21 C48A 80(3) 4_564 4_564
N21A N21 C48 61(3) 4_564 .
C48A N21 C48 36.4(19) 4_564 .
N21A N21 N20 138(5) 4_564 .
C48A N21 N20 73.2(17) 4_564 .
C48 N21 N20 107.3(11) . .
N21A N21 C45A 138(4) 4_564 4_564
C48A N21 C45A 60.2(18) 4_564 4_564
C48 N21 C45A 90.1(17) . 4_564
N20 N21 C45A 21(2) . 4_564
Cu3 Cl1 Cu4 83.5(4) . .
Cu2 Cl2 Cu4 86.8(3) . .
C1 C1 C2 106.4(9) 4_575 .
C1 C1 H1 126.8 4_575 .
C2 C1 H1 126.8 . .
N1 C2 C3 124.0(16) . .
N1 C2 C1 111.5(15) . .
C3 C2 C1 124.5(15) . .
C4 C3 C2 124.3(15) . .
C4 C3 C11 119.5(14) . .
C2 C3 C11 116.1(15) . .
C3 C4 N2 128.8(14) . .
C3 C4 C5 123.8(15) . .
N2 C4 C5 107.4(14) . .
C6 C5 C4 106.6(14) . .
C6 C5 H5 126.7 . .
C4 C5 H5 126.7 . .
C5 C6 C7 109.9(14) . .
C5 C6 H6 125.0 . .
C7 C6 H6 125.0 . .
C8 C7 N2 125.9(15) . .
C8 C7 C6 127.1(16) . .
N2 C7 C6 107.0(14) . .
C7 C8 C9 125.9(17) . .
C7 C8 C18 116.9(15) . .
C9 C8 C18 117.2(16) . .
N3 C9 C10 110.8(16) . .
N3 C9 C8 124.3(17) . .
C10 C9 C8 124.8(17) . .
C10 C10 C9 107.1(10) 4_575 .
C10 C10 H10 126.5 4_575 .
C9 C10 H10 126.5 . .
C12 C11 C16 118.3(16) . .
C12 C11 C3 119.4(14) . .
C16 C11 C3 121.8(15) . .
C11 C12 C13 123.4(17) . .
C11 C12 H12A 118.3 . .
C13 C12 H12A 118.3 . .
C14 C13 C12 119.6(17) . .
C14 C13 H13A 120.2 . .
C12 C13 H13A 120.2 . .
C13 C14 C15 117.4(16) . .
C13 C14 C17 124.7(15) . .
C15 C14 C17 117.9(14) . .
C16 C15 C14 119.2(15) . .
C16 C15 H15A 120.4 . .
C14 C15 H15A 120.4 . .
C11 C16 C15 121.3(16) . .
C11 C16 H16A 119.3 . .
C15 C16 H16A 119.3 . .
N7 C17 N4 116.0(15) . .
N7 C17 C14 121.5(14) . .
N4 C17 C14 121.8(14) . .
C23 C18 C19 117.5(19) . .
C23 C18 C8 123.0(17) . .
C19 C18 C8 119.6(17) . .
C18 C19 C20 122(2) . .
C18 C19 H19A 118.9 . .
C20 C19 H19A 118.9 . .
C21 C20 C19 113.7(19) . .
C21 C20 H20A 123.1 . .
C19 C20 H20A 123.1 . .
C20 C21 C22 124(2) . .
C20 C21 C24 114.7(18) . .
C22 C21 C24 121.0(19) . .
C21 C22 C23 116.3(19) . .
C21 C22 H22A 121.8 . .
C23 C22 H22A 121.8 . .
C18 C23 C22 126(2) . .
C18 C23 H23A 115.3 . .
C22 C23 H23A 118.8 . .
N8 C24 N11 110.1(17) . .
N8 C24 C21 127.3(19) . .
N11 C24 C21 122.3(18) . .
C40 C25A C25A 106(4) 4_565 4_565
C40 C25A C39 80(4) 4_565 4_565
C25A C25A C39 152.5(14) 4_565 4_565
C40 C25A C40 89(5) 4_565 .
C25A C25A C40 17.7(18) 4_565 .
C39 C25A C40 150(3) 4_565 .
C40 C25A C26A 57(6) 4_565 .
C25A C25A C26A 140.7(10) 4_565 .
C39 C25A C26A 65.5(12) 4_565 .
C40 C25A C26A 129(2) . .
C40 C25A N12A 112(5) 4_565 .
C25A C25A N12A 111.5(10) 4_565 .
C39 C25A N12A 43.8(11) 4_565 .
C40 C25A N12A 120(2) . .
C26A C25A N12A 107.8(10) . .
C40 C25A C42 46(6) 4_565 4_565
C25A C25A C42 102.6(8) 4_565 4_565
C39 C25A C42 100.7(16) 4_565 4_565
C40 C25A C42 90.5(16) . 4_565
C26A C25A C42 38.9(13) . 4_565
N12A C25A C42 144.5(14) . 4_565
C40A C25 C25 105(4) 4_565 4_565
C40A C25 C39A 97(4) 4_565 4_565
C25 C25 C39A 155.4(14) 4_565 4_565
C40A C25 C40A 89(5) 4_565 .
C25 C25 C40A 16.1(13) 4_565 .
C39A C25 C40A 167(4) 4_565 .
C40A C25 C26 37(5) 4_565 .
C25 C25 C26 140.8(10) 4_565 .
C39A C25 C26 63.1(12) 4_565 .
C40A C25 C26 125.0(19) . .
C40A C25 N12 142(5) 4_565 .
C25 C25 N12 111.3(9) 4_565 .
C39A C25 N12 45.8(12) 4_565 .
C40A C25 N12 127.1(18) . .
C26 C25 N12 107.9(10) . .
C40A C25 C42A 9(8) 4_565 4_565
C25 C25 C42A 102.0(8) 4_565 4_565
C39A C25 C42A 101.1(16) 4_565 4_565
C40A C25 C42A 86.2(14) . 4_565
C26 C25 C42A 38.9(12) . 4_565
N12 C25 C42A 146.7(14) . 4_565
C42 C26A C40 84(2) 4_565 4_565
C42 C26A C27A 155(2) 4_565 .
C40 C26A C27A 112.4(17) 4_565 .
C42 C26A C25A 93(2) 4_565 .
C40 C26A C25A 18(2) 4_565 .
C27A C26A C25A 108.2(10) . .
C42 C26A C39 141(3) 4_565 4_565
C40 C26A C39 59.4(12) 4_565 4_565
C27A C26A C39 53.2(12) . 4_565
C25A C26A C39 56.6(11) . 4_565
C42 C26A C43 52.3(14) 4_565 4_565
C40 C26A C43 127(2) 4_565 4_565
C27A C26A C43 119.6(19) . 4_565
C25A C26A C43 124.3(19) . 4_565
C39 C26A C43 165(2) 4_565 4_565
C42 C26A C38 148(2) 4_565 4_565
C40 C26A C38 104.8(18) 4_565 4_565
C27A C26A C38 13.6(19) . 4_565
C25A C26A C38 104.5(11) . 4_565
C39 C26A C38 47.9(9) 4_565 4_565
C43 C26A C38 128.3(18) 4_565 4_565
C42 C26A H26A 36.7 4_565 .
C40 C26A H26A 120.3 4_565 .
C27A C26A H26A 125.7 . .
C25A C26A H26A 126.0 . .
C39 C26A H26A 171.8 4_565 .
C43 C26A H26A 22.5 4_565 .
C38 C26A H26A 128.6 4_565 .
C40A C26 C42A 80.5(19) 4_565 4_565
C40A C26 C27 120.7(16) 4_565 .
C42A C26 C27 159(2) 4_565 .
C40A C26 C39A 65.0(12) 4_565 4_565
C42A C26 C39A 144(2) 4_565 4_565
C27 C26 C39A 56.1(12) . 4_565
C40A C26 C25 12.6(17) 4_565 .
C42A C26 C25 93(2) 4_565 .
C27 C26 C25 108.6(10) . .
C39A C26 C25 53.6(12) 4_565 .
C40A C26 C38A 116.0(17) 4_565 4_565
C42A C26 C38A 156(2) 4_565 4_565
C27 C26 C38A 15(2) . 4_565
C39A C26 C38A 51.7(10) 4_565 4_565
C25 C26 C38A 105.3(12) . 4_565
C40A C26 C47A 110(3) 4_565 4_565
C42A C26 C47A 48.2(13) 4_565 4_565
C27 C26 C47A 118(2) . 4_565
C39A C26 C47A 153(3) 4_565 4_565
C25 C26 C47A 117.3(19) . 4_565
C38A C26 C47A 130(2) 4_565 4_565
C40A C26 H26B 112.0 4_565 .
C42A C26 H26B 31.9 4_565 .
C27 C26 H26B 127.2 . .
C39A C26 H26B 174.5 4_565 .
C25 C26 H26B 123.8 . .
C38A C26 H26B 130.1 4_565 .
C47A C26 H26B 31.9 4_565 .
C38 C27A C39 87(3) 4_565 4_565
C38 C27A C26A 133(5) 4_565 .
C39 C27A C26A 67.6(12) 4_565 .
C38 C27A C28A 66(3) 4_565 .
C39 C27A C28A 41.4(11) 4_565 .
C26A C27A C28A 107.6(10) . .
C38 C27A C37 34(4) 4_565 4_565
C39 C27A C37 89.6(15) 4_565 4_565
C26A C27A C37 156.3(17) . 4_565
C28A C27A C37 51.9(12) . 4_565
C38 C27A H27A 76.9 4_565 .
C39 C27A H27A 163.6 4_565 .
C26A C27A H27A 126.3 . .
C28A C27A H27A 126.1 . .
C37 C27A H27A 75.4 4_565 .
C38A C27 C39A 88(4) 4_565 4_565
C38A C27 C26 123(6) 4_565 .
C39A C27 C26 62.3(11) 4_565 .
C38A C27 C28 70(3) 4_565 .
C39A C27 C28 45.5(10) 4_565 .
C26 C27 C28 107.0(10) . .
C38A C27 C37A 40(4) 4_565 4_565
C39A C27 C37A 92.5(15) 4_565 4_565
C26 C27 C37A 152.8(19) . 4_565
C28 C27 C37A 51.3(13) . 4_565
C38A C27 H27B 82.8 4_565 .
C39A C27 H27B 171.0 4_565 .
C26 C27 H27B 124.8 . .
C28 C27 H27B 128.1 . .
C37A C27 H27B 79.3 4_565 .
C39 C28A N13 87(2) 4_565 4_565
C39 C28A C38 75.9(17) 4_565 4_565
N13 C28A C38 154(3) 4_565 4_565
C39 C28A C36 151(3) 4_565 4_565
N13 C28A C36 69.9(13) 4_565 4_565
C38 C28A C36 118.4(19) 4_565 4_565
C39 C28A N12A 48.4(16) 4_565 .
N13 C28A N12A 42.1(14) 4_565 .
C38 C28A N12A 124.4(17) 4_565 .
C36 C28A N12A 112.0(18) 4_565 .
C39 C28A C27A 63.7(17) 4_565 .
N13 C28A C27A 150.3(18) 4_565 .
C38 C28A C27A 25.1(19) 4_565 .
C36 C28A C27A 139.1(19) 4_565 .
N12A C28A C27A 108.7(10) . .
C39 C28A C29A 163(4) 4_565 .
N13 C28A C29A 84.7(18) 4_565 .
C38 C28A C29A 106.4(19) 4_565 .
C36 C28A C29A 15.1(14) 4_565 .
N12A C28A C29A 126.5(18) . .
C27A C28A C29A 124.8(18) . .
C39 C28A C37 134(3) 4_565 4_565
N13 C28A C37 128(2) 4_565 4_565
C38 C28A C37 60.3(12) 4_565 4_565
C36 C28A C37 59.5(10) 4_565 4_565
N12A C28A C37 167(3) . 4_565
C27A C28A C37 79.8(17) . 4_565
C29A C28A C37 46.2(13) . 4_565
N13A C28 C39A 83.1(18) 4_565 4_565
N13A C28 C36A 73.1(14) 4_565 4_565
C39A C28 C36A 150(3) 4_565 4_565
N13A C28 C38A 149(3) 4_565 4_565
C39A C28 C38A 71.4(16) 4_565 4_565
C36A C28 C38A 123(2) 4_565 4_565
N13A C28 N12 36.4(14) 4_565 .
C39A C28 N12 48.4(14) 4_565 .
C36A C28 N12 109.5(19) 4_565 .
C38A C28 N12 119.6(17) 4_565 .
N13A C28 C27 145.4(17) 4_565 .
C39A C28 C27 62.5(16) 4_565 .
C36A C28 C27 141(2) 4_565 .
C38A C28 C27 22(2) 4_565 .
N12 C28 C27 109.1(10) . .
N13A C28 C37A 134(2) 4_565 4_565
C39A C28 C37A 131(3) 4_565 4_565
C36A C28 C37A 62.8(11) 4_565 4_565
C38A C28 C37A 61.7(12) 4_565 4_565
N12 C28 C37A 163(3) . 4_565
C27 C28 C37A 77.9(18) . 4_565
N13A C28 C29 92.2(18) 4_565 .
C39A C28 C29 166(4) 4_565 .
C36A C28 C29 19.9(14) 4_565 .
C38A C28 C29 108.4(19) 4_565 .
N12 C28 C29 128.6(18) . .
C27 C28 C29 122.2(18) . .
C37A C28 C29 46.7(14) 4_565 .
C36 C29A C37 128(7) 4_565 4_565
C36 C29A C28A 70(3) 4_565 .
C37 C29A C28A 69.1(15) 4_565 .
C36 C29A C36A 55(3) 4_565 .
C37 C29A C36A 158(3) 4_565 .
C28A C29A C36A 123.2(18) . .
C36 C29A C30A 153(9) 4_565 .
C37 C29A C30A 52.5(15) 4_565 .
C28A C29A C30A 121.4(17) . .
C36A C29A C30A 113.8(16) . .
C36 C29A C29 74(3) 4_565 4_565
C37 C29A C29 148(2) 4_565 4_565
C28A C29A C29 141.1(17) . 4_565
C36A C29A C29 18.7(12) . 4_565
C30A C29A C29 97.1(14) . 4_565
C36 C29A N13 33(4) 4_565 4_565
C37 C29A N13 105.5(17) 4_565 4_565
C28A C29A N13 38.4(11) . 4_565
C36A C29A N13 84.8(14) . 4_565
C30A C29A N13 157(2) . 4_565
C29 C29A N13 102.9(13) 4_565 4_565
C36A C29 C37A 116(5) 4_565 4_565
C36A C29 C28 63(3) 4_565 .
C37A C29 C28 66.1(15) 4_565 .
C36A C29 C36 61(3) 4_565 .
C37A C29 C36 155(3) 4_565 .
C28 C29 C36 121.9(18) . .
C36A C29 C30 152(7) 4_565 .
C37A C29 C30 56.2(15) 4_565 .
C28 C29 C30 121.6(18) . .
C36 C29 C30 114.3(17) . .
C36A C29 C29A 75(3) 4_565 4_565
C37A C29 C29A 152(3) 4_565 4_565
C28 C29 C29A 135.7(17) . 4_565
C36 C29 C29A 14.2(13) . 4_565
C30 C29 C29A 101.8(15) . 4_565
C36A C29 N13A 30(3) 4_565 4_565
C37A C29 N13A 99.0(16) 4_565 4_565
C28 C29 N13A 35.6(11) . 4_565
C36 C29 N13A 86.3(14) . 4_565
C30 C29 N13A 155(2) . 4_565
C29A C29 N13A 100.1(13) 4_565 4_565
C37 C30A C35A 95(2) 4_565 .
C37 C30A C31A 121(2) 4_565 .
C35A C30A C31A 117.9(12) . .
C37 C30A C29A 49.0(14) 4_565 .
C35A C30A C29A 116(2) . .
C31A C30A C29A 126(2) . .
C37 C30A C36 50.3(11) 4_565 4_565
C35A C30A C36 121.0(18) . 4_565
C31A C30A C36 120.9(18) . 4_565
C29A C30A C36 5.3(19) . 4_565
C37 C30A C30 129.8(16) 4_565 4_565
C35A C30A C30 119.6(19) . 4_565
C31A C30A C30 75.6(14) . 4_565
C29A C30A C30 82.1(12) . 4_565
C36 C30A C30 79.9(10) 4_565 4_565
C37A C30 C31 107(2) 4_565 .
C37A C30 C35 119(3) 4_565 .
C31 C30 C35 118.7(12) . .
C37A C30 C29 47.8(14) 4_565 .
C31 C30 C29 114(2) . .
C35 C30 C29 126(2) . .
C37A C30 C36A 47.0(10) 4_565 4_565
C31 C30 C36A 121(2) . 4_565
C35 C30 C36A 120(2) . 4_565
C29 C30 C36A 6.8(19) . 4_565
C37A C30 C30A 124.2(16) 4_565 4_565
C31 C30 C30A 109.8(15) . 4_565
C35 C30 C30A 76.5(18) . 4_565
C29 C30 C30A 79.0(12) . 4_565
C36A C30 C30A 78.0(9) 4_565 4_565
C35 C31A C32A 100.3(18) 4_565 .
C35 C31A C30A 105(2) 4_565 .
C32A C31A C30A 122.0(13) . .
C35 C31A H31A 64.4 4_565 .
C32A C31A H31A 119.0 . .
C30A C31A H31A 119.0 . .
C30 C31 C32 121.3(13) . .
C30 C31 H31B 119.1 . .
C32 C31 H31B 119.6 . .
C31A C32A C33A 119.4(13) . .
C31A C32A C34 79.3(13) . 4_565
C33A C32A C34 119(2) . 4_565
C31A C32A N16A 154.5(12) . 4_575
C33A C32A N16A 46.8(13) . 4_575
C34 C32A N16A 125.5(15) 4_565 4_575
C31A C32A H32A 120.6 . .
C33A C32A H32A 120.0 . .
C34 C32A H32A 73.8 4_565 .
N16A C32A H32A 76.9 4_575 .
C31 C32 C33 119.4(13) . .
C31 C32 N16 158.2(16) . 4
C33 C32 N16 42.6(16) . 4
C31 C32 H32B 120.4 . .
C33 C32 H32B 120.2 . .
N16 C32 H32B 79.0 4 .
N15A C33A C34A 89(2) 4_575 .
N15A C33A C32A 150(2) 4_575 .
C34A C33A C32A 118.9(11) . .
N15A C33A N16A 63.3(11) 4_575 4_575
C34A C33A N16A 148(3) . 4_575
C32A C33A N16A 87(2) . 4_575
N15A C33A C41A 40.3(12) 4_575 .
C34A C33A C41A 126(2) . .
C32A C33A C41A 115(2) . .
N16A C33A C41A 39.0(11) 4_575 .
N16 C33 C34 151(3) 4 .
N16 C33 C32 86(2) 4 .
C34 C33 C32 119.8(12) . .
N16 C33 N15 63.7(13) 4 4
C34 C33 N15 88(2) . 4
C32 C33 N15 142(3) . 4
N16 C33 C41 41.2(13) 4 .
C34 C33 C41 115(2) . .
C32 C33 C41 125(2) . .
N15 C33 C41 40.0(12) 4 .
C33A C34A C35A 120.4(13) . .
C33A C34A N15A 42.0(13) . 4_575
C35A C34A N15A 157(2) . 4_575
C33A C34A H34A 119.7 . .
C35A C34A H34A 119.9 . .
N15A C34A H34A 79.5 4_575 .
C35 C34 C33 119.9(13) . .
C35 C34 C32A 77(2) . 4_565
C33 C34 C32A 114(3) . 4_565
C35 C34 N15 153(2) . 4
C33 C34 N15 46.7(16) . 4
C32A C34 N15 128.1(18) 4_565 4
C35 C34 H34B 120.3 . .
C33 C34 H34B 119.6 . .
C32A C34 H34B 82.6 4_565 .
N15 C34 H34B 76.4 4 .
C30A C35A C34A 120.6(13) . .
C30A C35A C37 38.8(13) . 4_565
C34A C35A C37 142(2) . 4_565
C30A C35A H35A 119.3 . .
C34A C35A H35A 120.1 . .
C37 C35A H35A 90.1 4_565 .
C31A C35 C34 103(3) 4_565 .
C31A C35 C30 103(2) 4_565 .
C34 C35 C30 120.4(13) . .
C31A C35 H35B 65.2 4_565 .
C34 C35 H35B 119.7 . .
C30 C35 H35B 119.8 . .
C29 C36A C28 97(3) 4_565 4_565
C29 C36A C36 100(3) 4_565 4_565
C28 C36A C36 158(3) 4_565 4_565
C29 C36A N13A 140(4) 4_565 .
C28 C36A N13A 46.0(12) 4_565 .
C36 C36A N13A 113(2) 4_565 .
C29 C36A C37A 46(4) 4_565 .
C28 C36A C37A 63.3(13) 4_565 .
C36 C36A C37A 138(2) 4_565 .
N13A C36A C37A 108.0(10) . .
C29 C36A C29A 86(3) 4_565 .
C28 C36A C29A 167(2) 4_565 .
C36 C36A C29A 13.7(14) 4_565 .
N13A C36A C29A 125.8(18) . .
C37A C36A C29A 126.2(18) . .
C29 C36A C30 21(5) 4_565 4_565
C28 C36A C30 102.7(17) 4_565 4_565
C36 C36A C30 98.3(16) 4_565 4_565
N13A C36A C30 148.6(14) . 4_565
C37A C36A C30 41.0(12) . 4_565
C29A C36A C30 85.4(13) . 4_565
C29A C36 C36A 112(4) 4_565 4_565
C29A C36 C28A 95(4) 4_565 4_565
C36A C36 C28A 151(2) 4_565 4_565
C29A C36 N13 139(5) 4_565 .
C36A C36 N13 105.7(19) 4_565 .
C28A C36 N13 45.4(11) 4_565 .
C29A C36 C37 40(5) 4_565 .
C36A C36 C37 144(2) 4_565 .
C28A C36 C37 65.0(12) 4_565 .
N13 C36 C37 109.3(10) . .
C29A C36 C29 92(4) 4_565 .
C36A C36 C29 19.3(13) 4_565 .
C28A C36 C29 165(2) 4_565 .
N13 C36 C29 123.8(18) . .
C37 C36 C29 127.0(18) . .
C29A C36 C30A 21(7) 4_565 4_565
C36A C36 C30A 103.7(16) 4_565 4_565
C28A C36 C30A 105.5(16) 4_565 4_565
N13 C36 C30A 150.4(14) . 4_565
C37 C36 C30A 41.1(12) . 4_565
C29 C36 C30A 85.8(13) . 4_565
C29 C37A C30 76.1(17) 4_565 4_565
C29 C37A C38A 123.0(17) 4_565 .
C30 C37A C38A 159(2) 4_565 .
C29 C37A C36A 18.3(17) 4_565 .
C30 C37A C36A 92.0(18) 4_565 .
C38A C37A C36A 108.6(10) . .
C29 C37A C28 67.2(13) 4_565 4_565
C30 C37A C28 142(2) 4_565 4_565
C38A C37A C28 55.8(12) . 4_565
C36A C37A C28 53.8(10) . 4_565
C29 C37A C27 116(2) 4_565 4_565
C30 C37A C27 154(2) 4_565 4_565
C38A C37A C27 14.2(19) . 4_565
C36A C37A C27 104.6(12) . 4_565
C28 C37A C27 50.8(10) 4_565 4_565
C29 C37A H37A 110.6 4_565 .
C30 C37A H37A 34.5 4_565 .
C38A C37A H37A 125.3 . .
C36A C37A H37A 126.1 . .
C28 C37A H37A 170.3 4_565 .
C27 C37A H37A 127.4 4_565 .
C29A C37 C30A 78.5(17) 4_565 4_565
C29A C37 C38 117.4(15) 4_565 .
C30A C37 C38 164(2) 4_565 .
C29A C37 C36 12.1(19) 4_565 .
C30A C37 C36 88.6(19) 4_565 .
C38 C37 C36 107.4(10) . .
C29A C37 C28A 64.7(12) 4_565 4_565
C30A C37 C28A 143(2) 4_565 4_565
C38 C37 C28A 52.9(11) . 4_565
C36 C37 C28A 55.6(10) . 4_565
C29A C37 C27A 111.9(17) 4_565 4_565
C30A C37 C27A 162(2) 4_565 4_565
C38 C37 C27A 13.8(19) . 4_565
C36 C37 C27A 103.8(11) . 4_565
C28A C37 C27A 48.3(9) 4_565 4_565
C29A C37 C35A 103(2) 4_565 4_565
C30A C37 C35A 46.3(13) 4_565 4_565
C38 C37 C35A 123(2) . 4_565
C36 C37 C35A 114.7(17) . 4_565
C28A C37 C35A 136(2) 4_565 4_565
C27A C37 C35A 115.5(17) 4_565 4_565
C29A C37 H37B 115.4 4_565 .
C30A C37 H37B 37.1 4_565 .
C38 C37 H37B 127.0 . .
C36 C37 H37B 125.6 . .
C28A C37 H37B 172.2 4_565 .
C27A C37 H37B 129.2 4_565 .
C35A C37 H37B 36.7 4_565 .
C27A C38 C28A 89(3) 4_565 4_565
C27A C38 C37 132(5) 4_565 .
C28A C38 C37 66.8(12) 4_565 .
C27A C38 C39 68(3) 4_565 .
C28A C38 C39 41.6(11) 4_565 .
C37 C38 C39 107.3(10) . .
C27A C38 C26A 33(4) 4_565 4_565
C28A C38 C26A 90.2(16) 4_565 4_565
C37 C38 C26A 155.4(18) . 4_565
C39 C38 C26A 52.8(12) . 4_565
C27A C38 H38A 76.2 4_565 .
C28A C38 H38A 164.9 4_565 .
C37 C38 H38A 125.3 . .
C39 C38 H38A 127.4 . .
C26A C38 H38A 76.1 4_565 .
C27 C38A C28 88(4) 4_565 4_565
C27 C38A C39A 69(3) 4_565 .
C28 C38A C39A 45.4(11) 4_565 .
C27 C38A C37A 126(6) 4_565 .
C28 C38A C37A 62.4(12) 4_565 .
C39A C38A C37A 106.5(10) . .
C27 C38A C26 42(4) 4_565 4_565
C28 C38A C26 93.4(16) 4_565 4_565
C39A C38A C26 51.5(12) . 4_565
C37A C38A C26 155.3(17) . 4_565
C27 C38A H38B 80.5 4_565 .
C28 C38A H38B 168.1 4_565 .
C39A C38A H38B 126.7 . .
C37A C38A H38B 126.7 . .
C26 C38A H38B 76.5 4_565 .
N12 C39A C28 82.7(17) 4_565 4_565
N12 C39A C25 74.1(16) 4_565 4_565
C28 C39A C25 152(3) 4_565 4_565
N12 C39A C27 150(3) 4_565 4_565
C28 C39A C27 72.0(16) 4_565 4_565
C25 C39A C27 123(2) 4_565 4_565
N12 C39A C40A 91.0(19) 4_565 .
C28 C39A C40A 163(4) 4_565 .
C25 C39A C40A 16.9(14) 4_565 .
C27 C39A C40A 108(2) 4_565 .
N12 C39A N13A 36.1(14) 4_565 .
C28 C39A N13A 48.3(14) 4_565 .
C25 C39A N13A 110.2(19) 4_565 .
C27 C39A N13A 120.1(17) 4_565 .
C40A C39A N13A 127.0(19) . .
N12 C39A C26 136(2) 4_565 4_565
C28 C39A C26 132(3) 4_565 4_565
C25 C39A C26 63.3(11) 4_565 4_565
C27 C39A C26 61.5(11) 4_565 4_565
C40A C39A C26 47.3(15) . 4_565
N13A C39A C26 166(3) . 4_565
N12 C39A C38A 145.5(18) 4_565 .
C28 C39A C38A 63.2(17) 4_565 .
C25 C39A C38A 139.9(19) 4_565 .
C27 C39A C38A 22(2) 4_565 .
C40A C39A C38A 123.2(18) . .
N13A C39A C38A 109.6(10) . .
C26 C39A C38A 76.7(18) 4_565 .
C28A C39 N12A 88(2) 4_565 4_565
C28A C39 C27A 74.9(18) 4_565 4_565
N12A C39 C27A 151(4) 4_565 4_565
C28A C39 C40 168(4) 4_565 .
N12A C39 C40 84(2) 4_565 .
C27A C39 C40 109(2) 4_565 .
C28A C39 C25A 150(4) 4_565 4_565
N12A C39 C25A 69.7(15) 4_565 4_565
C27A C39 C25A 115.5(19) 4_565 4_565
C40 C39 C25A 18.5(17) . 4_565
C28A C39 N13 49.6(15) 4_565 .
N12A C39 N13 42.1(14) 4_565 .
C27A C39 N13 124.3(18) 4_565 .
C40 C39 N13 125(2) . .
C25A C39 N13 111.8(18) 4_565 .
C28A C39 C38 62.4(17) 4_565 .
N12A C39 C38 150(2) 4_565 .
C27A C39 C38 25.1(18) 4_565 .
C40 C39 C38 126(2) . .
C25A C39 C38 137.2(19) 4_565 .
N13 C39 C38 109.7(10) . .
C28A C39 C26A 132(3) 4_565 4_565
N12A C39 C26A 125(2) 4_565 4_565
C27A C39 C26A 59.3(11) 4_565 4_565
C40 C39 C26A 50.0(19) . 4_565
C25A C39 C26A 57.9(10) 4_565 4_565
N13 C39 C26A 163(3) . 4_565
C38 C39 C26A 79.3(17) . 4_565
C25 C40A C26 130(6) 4_565 4_565
C25 C40A C39A 66(4) 4_565 .
C26 C40A C39A 67.8(16) 4_565 .
C25 C40A C25 59(4) 4_565 .
C26 C40A C25 166(4) 4_565 .
C39A C40A C25 124.3(19) . .
C25 C40A C40A 75(4) 4_565 4_565
C26 C40A C40A 152.3(13) 4_565 4_565
C39A C40A C40A 139.8(12) . 4_565
C25 C40A C40A 16.1(13) . 4_565
C25 C40A C42A 168(10) 4_565 .
C26 C40A C42A 51.7(13) 4_565 .
C39A C40A C42A 118.8(14) . .
C25 C40A C42A 116.9(14) . .
C40A C40A C42A 101.2(7) 4_565 .
C25 C40A N12 30(4) 4_565 4_565
C26 C40A N12 103.3(17) 4_565 4_565
C39A C40A N12 37.0(12) . 4_565
C25 C40A N12 87.6(15) . 4_565
C40A C40A N12 103.5(9) 4_565 4_565
C42A C40A N12 155.0(16) . 4_565
C25A C40 C26A 105(8) 4_565 4_565
C25A C40 C39 82(4) 4_565 .
C26A C40 C39 70.6(17) 4_565 .
C25A C40 C25A 56(4) 4_565 .
C26A C40 C25A 139(4) 4_565 .
C39 C40 C25A 130(3) . .
C25A C40 C40 74(4) 4_565 4_565
C26A C40 C40 141.7(16) 4_565 4_565
C39 C40 C40 143.2(15) . 4_565
C25A C40 C40 17.7(18) . 4_565
C25A C40 C42 122(7) 4_565 .
C26A C40 C42 47.1(16) 4_565 .
C39 C40 C42 116(2) . .
C25A C40 C42 108.8(17) . .
C40 C40 C42 100.2(7) 4_565 .
C25A C40 N12A 54(4) 4_565 4_565
C26A C40 N12A 105(2) 4_565 4_565
C39 C40 N12A 39.5(13) . 4_565
C25A C40 N12A 91.1(19) . 4_565
C40 C40 N12A 103.9(10) 4_565 4_565
C42 C40 N12A 152(2) . 4_565
N15A C41A N16A 94(3) 4_575 4_575
N15A C41A N14A 71.2(10) 4_575 .
N16A C41A N14A 150(4) 4_575 .
N15A C41A N17A 149(4) 4_575 .
N16A C41A N17A 71.3(10) 4_575 .
N14A C41A N17A 108.5(10) . .
N15A C41A C33A 57.5(17) 4_575 .
N16A C41A C33A 67.0(17) 4_575 .
N14A C41A C33A 119.4(14) . .
N17A C41A C33A 132.1(14) . .
N15A C41A C41A 122.7(12) 4_575 4_575
N16A C41A C41A 123.3(12) 4_575 4_575
N14A C41A C41A 54.9(6) . 4_575
N17A C41A C41A 54.9(6) . 4_575
C33A C41A C41A 168.4(17) . 4_575
N16 C41 N15 92(3) 4 4
N16 C41 N17 71.3(10) 4 .
N15 C41 N17 148(4) 4 .
N16 C41 N14 147(4) 4 .
N15 C41 N14 70.2(10) 4 .
N17 C41 N14 109.2(10) . .
N16 C41 C33 55.9(19) 4 .
N15 C41 C33 67.8(19) 4 .
N17 C41 C33 118.3(16) . .
N14 C41 C33 132.3(17) . .
N16 C41 C41 124.2(13) 4 4
N15 C41 C41 123.5(12) 4 4
N17 C41 C41 55.8(7) . 4
N14 C41 C41 55.8(7) . 4
C33 C41 C41 167.6(19) . 4
C26 C42A C47A 93(2) 4_565 .
C26 C42A C43A 128(2) 4_565 .
C47A C42A C43A 119.1(12) . .
C26 C42A C40A 47.8(16) 4_565 .
C47A C42A C40A 119(2) . .
C43A C42A C40A 122(2) . .
C26 C42A C25 48.5(11) 4_565 4_565
C47A C42A C25 117.3(18) . 4_565
C43A C42A C25 123.6(18) . 4_565
C40A C42A C25 3(2) . 4_565
C26 C42A C42A 126.3(14) 4_565 4_565
C47A C42A C42A 112.7(14) . 4_565
C43A C42A C42A 81.0(8) . 4_565
C40A C42A C42A 78.8(7) . 4_565
C25 C42A C42A 78.0(8) 4_565 4_565
C44A C43A C42A 121.1(13) . .
C44A C43A C43A 100.0(5) . 4_565
C42A C43A C43A 99.0(8) . 4_565
C44A C43A H43A 119.6 . .
C42A C43A H43A 119.2 . .
C43A C43A H43A 67.6 4_565 .
N20 C44A C43A 138(3) 4_566 .
N20 C44A C45A 23(3) 4_566 .
C43A C44A C45A 120.5(13) . .
N20 C44A C44A 121(3) 4_566 4_565
C43A C44A C44A 80.0(5) . 4_565
C45A C44A C44A 107.8(17) . 4_565
N20 C44A H44A 102.5 4_566 .
C43A C44A H44A 119.3 . .
C45A C44A H44A 118.9 . .
C44A C44A H44A 71.2 4_565 .
N20 C45A N19 123(8) 4_566 4_566
N20 C45A C46A 143(6) 4_566 .
N19 C45A C46A 50(2) 4_566 .
N20 C45A C44A 43(4) 4_566 .
N19 C45A C44A 145(4) 4_566 .
C46A C45A C44A 117.3(11) . .
N20 C45A C48A 82(3) 4_566 .
N19 C45A C48A 77(2) 4_566 .
C46A C45A C48A 121.6(11) . .
C44A C45A C48A 120.4(11) . .
N20 C45A N21 55(3) 4_566 4_566
N19 C45A N21 117(2) 4_566 4_566
C46A C45A N21 160(2) . 4_566
C44A C45A N21 82.1(18) . 4_566
C48A C45A N21 40.8(16) . 4_566
N20 C45A N18 119(4) 4_566 4_566
N19 C45A N18 45.7(16) 4_566 4_566
C46A C45A N18 82.5(16) . 4_566
C44A C45A N18 160.0(18) . 4_566
C48A C45A N18 39.6(14) . 4_566
N21 C45A N18 78.5(11) 4_566 4_566
N19 C46A C47A 146(4) 4_566 .
N19 C46A C45A 43(3) 4_566 .
C47A C46A C45A 122.0(13) . .
N19 C46A N20 45(3) 4_566 4_566
C47A C46A N20 114.0(15) . 4_566
C45A C46A N20 11(2) . 4_566
N19 C46A H46A 80.9 4_566 .
C47A C46A H46A 119.4 . .
C45A C46A H46A 118.2 . .
N20 C46A H46A 124.7 4_566 .
C46A C47A C42A 119.5(13) . .
C46A C47A C26 146(2) . 4_565
C42A C47A C26 39.2(12) . 4_565
C48 C48A N21 91(4) 4_566 4_566
C48 C48A N18 85(3) 4_566 4_566
N21 C48A N18 155(5) 4_566 4_566
C48 C48A N18A 56(4) 4_566 .
N21 C48A N18A 146(4) 4_566 .
N18 C48A N18A 37(2) 4_566 .
C48 C48A N21A 65(3) 4_566 .
N21 C48A N21A 48(3) 4_566 .
N18 C48A N21A 145(2) 4_566 .
N18A C48A N21A 108.7(10) . .
C48 C48A C45A 140(5) 4_566 .
N21 C48A C45A 79(3) 4_566 .
N18 C48A C45A 89(2) 4_566 .
N18A C48A C45A 125.5(14) . .
N21A C48A C45A 124.9(14) . .
C48 C48A N20 146(5) 4_566 4_566
N21 C48A N20 62.4(15) 4_566 4_566
N18 C48A N20 111(2) 4_566 4_566
N18A C48A N20 148(2) . 4_566
N21A C48A N20 104(2) . 4_566
C45A C48A N20 23(2) . 4_566
C48 C48A N19 140(4) 4_566 4_566
N21 C48A N19 115(2) 4_566 4_566
N18 C48A N19 59.0(14) 4_566 4_566
N18A C48A N19 94(2) . 4_566
N21A C48A N19 155(3) . 4_566
C45A C48A N19 37(2) . 4_566
N20 C48A N19 53.6(10) 4_566 4_566
C26A C42 C43 85(3) 4_565 .
C26A C42 C47 141(3) 4_565 .
C43 C42 C47 121.0(13) . .
C26A C42 C40 48.8(17) 4_565 .
C43 C42 C40 125(3) . .
C47 C42 C40 114(3) . .
C26A C42 C25A 47.9(12) 4_565 4_565
C43 C42 C25A 116(2) . 4_565
C47 C42 C25A 123(2) . 4_565
C40 C42 C25A 11.5(17) . 4_565
C26A C42 C42 124.4(15) 4_565 4_565
C43 C42 C42 117.3(11) . 4_565
C47 C42 C42 72.1(14) . 4_565
C40 C42 C42 79.8(7) . 4_565
C25A C42 C42 77.4(8) 4_565 4_565
C42 C43 C44 119.8(14) . .
C42 C43 C26A 42.8(15) . 4_565
C44 C43 C26A 152(2) . 4_565
C47 C47 C42 107.9(14) 4_565 .
C47 C47 C46 95.7(19) 4_565 .
C42 C47 C46 119.2(13) . .
C47 C47 C46 46.5(10) 4_565 4_565
C42 C47 C46 126(2) . 4_565
C46 C47 C46 49(2) . 4_565
N19A C44 C45 43(2) 4_564 .
N19A C44 C43 135(3) 4_564 .
C45 C44 C43 118.5(13) . .
N19A C45 N20A 89(4) 4_564 4_564
N19A C45 C44 58(3) 4_564 .
N20A C45 C44 133(4) 4_564 .
N19A C45 C46 145(4) 4_564 .
N20A C45 C46 67(3) 4_564 .
C44 C45 C46 121.1(14) . .
N19A C45 C48 81(3) 4_564 .
N20A C45 C48 82(3) 4_564 .
C44 C45 C48 120(3) . .
C46 C45 C48 117(3) . .
N19A C45 N18A 48.6(18) 4_564 4_564
N20A C45 N18A 100(2) 4_564 4_564
C44 C45 N18A 83(2) . 4_564
C46 C45 N18A 156(2) . 4_564
C48 C45 N18A 39(2) . 4_564
N19A C45 N21A 96(3) 4_564 4_564
N20A C45 N21A 44.0(16) 4_564 4_564
C44 C45 N21A 153(3) . 4_564
C46 C45 N21A 84(2) . 4_564
C48 C45 N21A 41(2) . 4_564
N18A C45 N21A 73.3(11) 4_564 4_564
N20A C46 C47 127(3) 4_564 .
N20A C46 C45 44(2) 4_564 .
C47 C46 C45 118.9(13) . .
N20A C46 C46 148.4(17) 4_564 4_565
C47 C46 C46 84.3(19) . 4_565
C45 C46 C46 121(2) . 4_565
N20A C46 C47 164(2) 4_564 4_565
C47 C46 C47 38(2) . 4_565
C45 C46 C47 132(2) . 4_565
C46 C46 C47 46.5(10) 4_565 4_565
C48A C48 N18A 88(4) 4_564 4_564
C48A C48 N21A 80(4) 4_564 4_564
N18A C48 N21A 138(5) 4_564 4_564
C48A C48 N21 53(3) 4_564 .
N18A C48 N21 141(3) 4_564 .
N21A C48 N21 46(3) 4_564 .
C48A C48 N18 59(3) 4_564 .
N18A C48 N18 37(2) 4_564 .
N21A C48 N18 136(3) 4_564 .
N21 C48 N18 108.5(11) . .
C48A C48 C45 160(6) 4_564 .
N18A C48 C45 88(3) 4_564 .
N21A C48 C45 90(3) 4_564 .
N21 C48 C45 128(4) . .
N18 C48 C45 123(4) . .
C48A C48 N19A 130(6) 4_564 4_564
N18A C48 N19A 57.4(18) 4_564 4_564
N21A C48 N19A 101(3) 4_564 4_564
N21 C48 N19A 147(4) . 4_564
N18 C48 N19A 94(3) . 4_564
C45 C48 N19A 35.9(19) . 4_564
C48A C48 N20A 126(5) 4_564 4_564
N18A C48 N20A 105(3) 4_564 4_564
N21A C48 N20A 55.0(16) 4_564 4_564
N21 C48 N20A 100(3) . 4_564
N18 C48 N20A 140(4) . 4_564
C45 C48 N20A 37.6(19) . 4_564
N19A C48 N20A 49.9(11) 4_564 4_564
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
O1W Cu3 2.343(5) .
O1W Cu3 2.343(5) 3_162
O1W H1WA 0.9187 .
Cu1 N3 1.975(19) .
Cu1 N2 1.997(11) 4_575
Cu1 N2 1.997(11) .
Cu1 N1 1.999(18) .
Cu2 N6 1.965(12) 3_061
Cu2 N6 1.965(11) 2_051
Cu2 N6 1.965(11) 1_655
Cu2 N6 1.965(11) 4_665
Cu2 Cl2 2.562(9) 3_161
Cu2 Cl2 2.562(9) .
Cu3 N10 1.922(18) 4_565
Cu3 N10 1.922(18) .
Cu3 Cl1 2.571(14) .
Cu4 N9 1.938(16) .
Cu4 N9 1.938(16) 4_565
Cu4 N5 1.974(13) 1_655
Cu4 N5 1.974(13) 4_665
Cu4 Cl2 2.571(11) .
Cu4 Cl1 2.610(13) .
Cu5 N13A 2.034(17) .
Cu5 N13A 2.034(17) 4_565
Cu5 N12 2.034(16) .
Cu5 N12 2.034(16) 4_565
Cu5 N12A 2.042(16) 4_565
Cu5 N12A 2.042(16) .
Cu5 N13 2.049(17) 4_565
Cu5 N13 2.049(17) .
N1 C2 1.386(18) 4_575
N1 C2 1.386(18) .
N2 C7 1.363(17) .
N2 C4 1.408(17) .
N3 C9 1.360(18) 4_575
N3 C9 1.360(18) .
N4 C17 1.328(17) .
N4 N5 1.338(15) .
N5 N6 1.351(14) .
N5 Cu4 1.974(13) 1_455
N6 N7 1.334(14) .
N6 Cu2 1.965(11) 1_455
N7 C17 1.281(16) .
N8 C24 1.34(2) .
N8 N9 1.353(18) .
N9 N10 1.321(19) .
N10 N11 1.35(2) .
N11 C24 1.46(2) .
N12A N13 0.92(3) 4_565
N12A C39 1.03(3) 4_565
N12A C28A 1.373(10) .
N12A C25A 1.393(10) .
N12A C40 1.61(3) 4_565
N12 N13A 0.82(3) 4_565
N12 C39A 1.03(3) 4_565
N12 C28 1.370(10) .
N12 C25 1.384(10) .
N12 C40A 1.71(3) 4_565
N13A N12 0.82(3) 4_565
N13A C28 1.04(3) 4_565
N13A C39A 1.379(10) .
N13A C36A 1.380(10) .
N13A C29 1.78(2) 4_565
N13 N12A 0.92(3) 4_565
N13 C28A 1.05(3) 4_565
N13 C39 1.373(10) .
N13 C36 1.381(10) .
N13 C29A 1.68(3) 4_565
N14A C41A 1.350(8) 4_575
N14A C41A 1.350(8) .
N14A N15A 1.375(10) 4_575
N14A N15A 1.375(10) .
N14 C41 1.353(8) 4
N14 C41 1.353(8) .
N14 N15 1.371(10) 4
N14 N15 1.371(10) .
N15A C41A 0.94(2) 4_575
N15A C33A 1.23(3) 4_575
N15A N16A 1.374(10) .
N15A C34A 1.83(3) 4_575
N15 C41 0.97(3) 4
N15 N16 1.377(10) .
N15 C33 1.39(3) 4
N15 C34 1.92(4) 4
N16A C41A 0.94(2) 4_575
N16A N17A 1.378(10) .
N16A C33A 1.38(3) 4_575
N16A C32A 1.89(3) 4_575
N16 C41 0.95(3) 4
N16 C33 1.20(3) 4
N16 N17 1.382(10) .
N16 C32 1.76(3) 4
N17A C41A 1.352(8) 4_575
N17A C41A 1.352(8) .
N17A N16A 1.378(10) 4_575
N17A H17A 0.8999 .
N17 C41 1.352(8) .
N17 C41 1.352(8) 4
N17 N16 1.382(10) 4
N17 H17B 0.9001 .
N18A N18 0.82(5) 4_566
N18A C48 1.13(5) 4_566
N18A C48A 1.370(10) .
N18A N19A 1.383(10) .
N18A C45 1.81(4) 4_566
N18A H18A 0.9000 .
N18 N18A 0.82(5) 4_564
N18 C48A 1.19(4) 4_564
N18 C48 1.380(11) .
N18 N19 1.387(11) .
N18 C45A 1.87(4) 4_564
N18 H18B 0.8999 .
N19A C45 0.96(5) 4_566
N19A C44 1.19(4) 4_566
N19A N20A 1.377(11) .
N19A C48 1.61(4) 4_566
N19 C45A 0.95(5) 4_564
N19 C46A 1.06(4) 4_564
N19 N20 1.380(11) .
N19 C48A 1.55(3) 4_564
N20A C45 1.02(5) 4_566
N20A C46 1.35(5) 4_566
N20A N21A 1.389(10) .
N20A C48 1.65(4) 4_566
N20 C45A 0.61(6) 4_564
N20 C44A 1.03(4) 4_564
N20 N21 1.396(11) .
N20 C48A 1.51(3) 4_564
N20 C46A 1.90(6) 4_564
N21A N21 1.04(5) 4_566
N21A C48 1.27(5) 4_566
N21A C48A 1.379(10) .
N21A C45 1.93(4) 4_566
N21 N21A 1.04(5) 4_564
N21 C48A 1.10(4) 4_564
N21 C48 1.379(11) .
N21 C45A 1.66(4) 4_564
C1 C1 1.39(3) 4_575
C1 C2 1.41(2) .
C1 H1 0.9500 .
C2 C3 1.402(19) .
C3 C4 1.339(18) .
C3 C11 1.51(2) .
C4 C5 1.498(19) .
C5 C6 1.319(18) .
C5 H5 0.9500 .
C6 C7 1.493(19) .
C6 H6 0.9500 .
C7 C8 1.324(19) .
C8 C9 1.38(2) .
C8 C18 1.52(2) .
C9 C10 1.36(2) .
C10 C10 1.35(3) 4_575
C10 H10 0.9500 .
C11 C12 1.333(19) .
C11 C16 1.333(19) .
C12 C13 1.38(2) .
C12 H12A 0.9500 .
C13 C14 1.35(2) .
C13 H13A 0.9500 .
C14 C15 1.43(2) .
C14 C17 1.51(2) .
C15 C16 1.40(2) .
C15 H15A 0.9500 .
C16 H16A 0.9500 .
C18 C23 1.28(2) .
C18 C19 1.36(2) .
C19 C20 1.49(2) .
C19 H19A 0.9500 .
C20 C21 1.34(2) .
C20 H20A 0.9500 .
C21 C22 1.38(2) .
C21 C24 1.47(2) .
C22 C23 1.39(2) .
C22 H22A 0.9500 .
C23 H23A 0.9604 .
C25A C40 0.44(4) 4_565
C25A C25A 1.19(3) 4_565
C25A C39 1.36(3) 4_565
C25A C40 1.378(11) .
C25A C26A 1.383(11) .
C25A C42 1.86(3) 4_565
C25 C40A 0.39(3) 4_565
C25 C25 1.22(3) 4_565
C25 C39A 1.25(2) 4_565
C25 C40A 1.379(10) .
C25 C26 1.383(10) .
C25 C42A 1.85(3) 4_565
C26A C42 1.17(3) 4_565
C26A C40 1.20(4) 4_565
C26A C27A 1.381(10) .
C26A C39 1.48(2) 4_565
C26A C43 1.72(4) 4_565
C26A C38 1.83(3) 4_565
C26A H26A 0.9601 .
C26 C40A 1.10(3) 4_565
C26 C42A 1.16(2) 4_565
C26 C27 1.370(10) .
C26 C39A 1.38(2) 4_565
C26 C38A 1.72(3) 4_565
C26 C47A 1.83(3) 4_565
C26 H26B 0.9598 .
C27A C38 0.59(4) 4_565
C27A C39 1.28(3) 4_565
C27A C28A 1.384(10) .
C27A C37 1.82(3) 4_565
C27A H27A 0.9598 .
C27 C38A 0.53(4) 4_565
C27 C39A 1.29(3) 4_565
C27 C28 1.387(10) .
C27 C37A 1.75(3) 4_565
C27 H27B 0.9600 .
C28A C39 0.95(2) 4_565
C28A N13 1.05(3) 4_565
C28A C38 1.26(3) 4_565
C28A C36 1.33(2) 4_565
C28A C29A 1.411(8) .
C28A C37 1.46(2) 4_565
C28 N13A 1.04(3) 4_565
C28 C39A 1.04(2) 4_565
C28 C36A 1.26(2) 4_565
C28 C38A 1.30(3) 4_565
C28 C37A 1.40(3) 4_565
C28 C29 1.407(8) .
C29A C36 0.37(3) 4_565
C29A C37 1.13(3) 4_565
C29A C36A 1.454(11) .
C29A C30A 1.463(11) .
C29A C29 1.50(2) 4_565
C29A N13 1.68(3) 4_565
C29 C36A 0.48(3) 4_565
C29 C37A 1.11(3) 4_565
C29 C36 1.443(11) .
C29 C30 1.456(11) .
C29 C29A 1.50(2) 4_565
C29 N13A 1.78(2) 4_565
C30A C37 1.19(3) 4_565
C30A C35A 1.369(10) .
C30A C31A 1.372(10) .
C30A C36 1.80(3) 4_565
C30A C30 1.98(3) 4_565
C30 C37A 1.25(3) 4_565
C30 C31 1.364(10) .
C30 C35 1.371(10) .
C30 C36A 1.90(3) 4_565
C30 C30A 1.98(3) 4_565
C31A C35 1.32(3) 4_565
C31A C32A 1.368(10) .
C31A H31A 0.9602 .
C31 C32 1.365(10) .
C31 H31B 0.9603 .
C32A C33A 1.374(10) .
C32A C34 1.88(4) 4_565
C32A N16A 1.89(3) 4_575
C32A H32A 0.9608 .
C32 C33 1.372(10) .
C32 N16 1.76(3) 4
C32 H32B 0.9598 .
C33A N15A 1.23(3) 4_575
C33A C34A 1.371(10) .
C33A N16A 1.38(3) 4_575
C33A C41A 1.441(10) .
C33 N16 1.20(3) 4
C33 C34 1.370(10) .
C33 N15 1.39(3) 4
C33 C41 1.435(10) .
C34A C35A 1.373(10) .
C34A N15A 1.83(3) 4_575
C34A H34A 0.9601 .
C34 C35 1.369(10) .
C34 C32A 1.88(4) 4_565
C34 N15 1.92(4) 4
C34 H34B 0.9600 .
C35A C37 1.89(3) 4_565
C35A H35A 0.9601 .
C35 C31A 1.32(3) 4_565
C35 H35B 0.9602 .
C36A C29 0.48(3) 4_565
C36A C28 1.26(2) 4_565
C36A C36 1.28(2) 4_565
C36A C37A 1.389(10) .
C36A C30 1.90(3) 4_565
C36 C29A 0.37(3) 4_565
C36 C36A 1.28(2) 4_565
C36 C28A 1.33(2) 4_565
C36 C37 1.386(10) .
C36 C30A 1.80(3) 4_565
C37A C29 1.11(3) 4_565
C37A C30 1.25(3) 4_565
C37A C38A 1.387(10) .
C37A C28 1.40(3) 4_565
C37A C27 1.75(3) 4_565
C37A H37A 0.9597 .
C37 C29A 1.13(3) 4_565
C37 C30A 1.19(3) 4_565
C37 C38 1.378(10) .
C37 C28A 1.46(2) 4_565
C37 C27A 1.82(3) 4_565
C37 C35A 1.89(3) 4_565
C37 H37B 0.9599 .
C38 C27A 0.59(4) 4_565
C38 C28A 1.26(3) 4_565
C38 C39 1.384(10) .
C38 C26A 1.83(3) 4_565
C38 H38A 0.9597 .
C38A C27 0.53(4) 4_565
C38A C28 1.30(3) 4_565
C38A C39A 1.384(10) .
C38A C26 1.72(3) 4_565
C38A H38B 0.9602 .
C39A N12 1.03(3) 4_565
C39A C28 1.04(2) 4_565
C39A C25 1.25(2) 4_565
C39A C27 1.29(3) 4_565
C39A C40A 1.351(11) .
C39A C26 1.38(2) 4_565
C39 C28A 0.95(2) 4_565
C39 N12A 1.03(3) 4_565
C39 C27A 1.28(3) 4_565
C39 C40 1.355(11) .
C39 C25A 1.36(2) 4_565
C39 C26A 1.48(2) 4_565
C40A C25 0.39(3) 4_565
C40A C26 1.10(3) 4_565
C40A C40A 1.43(3) 4_565
C40A C42A 1.457(11) .
C40A N12 1.71(3) 4_565
C40 C25A 0.44(4) 4_565
C40 C26A 1.20(4) 4_565
C40 C40 1.44(4) 4_565
C40 C42 1.59(3) .
C40 N12A 1.61(3) 4_565
C41A N15A 0.94(2) 4_575
C41A N16A 0.94(2) 4_575
C41A C41A 1.55(2) 4_575
C41 N16 0.95(3) 4
C41 N15 0.97(3) 4
C41 C41 1.52(3) 4
C42A C26 1.16(2) 4_565
C42A C47A 1.369(10) .
C42A C43A 1.373(10) .
C42A C25 1.85(3) 4_565
C42A C42A 1.99(3) 4_565
C43A C44A 1.358(10) .
C43A C43A 1.57(4) 4_565
C43A H43A 0.9597 .
C44A N20 1.03(4) 4_566
C44A C45A 1.392(10) .
C44A C44A 2.04(4) 4_565
C44A H44A 0.9603 .
C45A N20 0.61(6) 4_566
C45A N19 0.95(5) 4_566
C45A C46A 1.378(10) .
C45A C48A 1.464(7) .
C45A N21 1.66(4) 4_566
C45A N18 1.87(4) 4_566
C46A N19 1.06(4) 4_566
C46A C47A 1.365(10) .
C46A N20 1.90(6) 4_566
C46A H46A 0.9602 .
C47A C26 1.83(3) 4_565
C48A C48 0.82(4) 4_566
C48A N21 1.10(4) 4_566
C48A N18 1.19(4) 4_566
C48A N20 1.51(3) 4_566
C48A N19 1.55(3) 4_566
C42 C26A 1.17(3) 4_565
C42 C43 1.365(10) .
C42 C47 1.372(10) .
C42 C25A 1.86(3) 4_565
C42 C42 2.00(4) 4_565
C43 C44 1.376(10) .
C43 C26A 1.72(4) 4_565
C47 C47 1.16(6) 4_565
C47 C46 1.372(10) .
C47 C46 1.88(3) 4_565
C44 N19A 1.19(4) 4_564
C44 C45 1.369(10) .
C45 N19A 0.96(5) 4_564
C45 N20A 1.02(5) 4_564
C45 C46 1.373(11) .
C45 C48 1.451(11) .
C45 N18A 1.81(4) 4_564
C45 N21A 1.93(4) 4_564
C46 N20A 1.35(5) 4_564
C46 C46 1.43(7) 4_565
C46 C47 1.88(3) 4_565
C48 C48A 0.82(4) 4_564
C48 N18A 1.13(5) 4_564
C48 N21A 1.27(5) 4_564
C48 N19A 1.61(4) 4_564
C48 N20A 1.65(4) 4_564
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_4
Cu3 O1W Cu3 N10 116(86) 3_162 4_565
Cu3 O1W Cu3 N10 -116(86) 3_162 .
Cu3 O1W Cu3 Cl1 0(56) 3_162 .
N3 Cu1 N1 C2 -91(100) . 4_575
N2 Cu1 N1 C2 -1.4(15) 4_575 4_575
N2 Cu1 N1 C2 179.5(15) . 4_575
N3 Cu1 N1 C2 91(100) . .
N2 Cu1 N1 C2 -179.5(15) 4_575 .
N2 Cu1 N1 C2 1.4(15) . .
N3 Cu1 N2 C7 -2.3(12) . .
N2 Cu1 N2 C7 30(24) 4_575 .
N1 Cu1 N2 C7 177.5(12) . .
N3 Cu1 N2 C4 -178.3(11) . .
N2 Cu1 N2 C4 -146(23) 4_575 .
N1 Cu1 N2 C4 1.5(11) . .
N2 Cu1 N3 C9 -2.9(16) 4_575 4_575
N2 Cu1 N3 C9 176.2(16) . 4_575
N1 Cu1 N3 C9 87(100) . 4_575
N2 Cu1 N3 C9 -176.2(16) 4_575 .
N2 Cu1 N3 C9 2.9(16) . .
N1 Cu1 N3 C9 -87(100) . .
C17 N4 N5 N6 1.4(15) . .
C17 N4 N5 Cu4 -179.4(10) . 1_455
N4 N5 N6 N7 1.9(15) . .
Cu4 N5 N6 N7 -177.3(9) 1_455 .
N4 N5 N6 Cu2 173.7(9) . 1_455
Cu4 N5 N6 Cu2 -5.6(15) 1_455 1_455
N5 N6 N7 C17 -4.5(15) . .
Cu2 N6 N7 C17 -175.9(10) 1_455 .
C24 N8 N9 N10 -2(2) . .
C24 N8 N9 Cu4 172.3(12) . .
N9 Cu4 N9 N10 47(2) 4_565 .
N5 Cu4 N9 N10 -130.2(16) 1_655 .
N5 Cu4 N9 N10 -56(11) 4_665 .
Cl2 Cu4 N9 N10 142.2(16) . .
Cl1 Cu4 N9 N10 -39.7(16) . .
N9 Cu4 N9 N8 -126.6(13) 4_565 .
N5 Cu4 N9 N8 56.7(15) 1_655 .
N5 Cu4 N9 N8 131(10) 4_665 .
Cl2 Cu4 N9 N8 -31.0(15) . .
Cl1 Cu4 N9 N8 147.1(15) . .
N8 N9 N10 N11 -4(2) . .
Cu4 N9 N10 N11 -178.3(13) . .
N8 N9 N10 Cu3 174.4(12) . .
Cu4 N9 N10 Cu3 0(2) . .
N10 Cu3 N10 N9 -48(2) 4_565 .
O1W Cu3 N10 N9 172.0(13) . .
Cl1 Cu3 N10 N9 40.0(16) . .
N10 Cu3 N10 N11 130.2(14) 4_565 .
O1W Cu3 N10 N11 -10(2) . .
Cl1 Cu3 N10 N11 -141.6(17) . .
N9 N10 N11 C24 8(2) . .
Cu3 N10 N11 C24 -170.9(13) . .
N13A Cu5 N12A N13 5(2) . 4_565
N13A Cu5 N12A N13 -173(2) 4_565 4_565
N12 Cu5 N12A N13 145(99) . 4_565
N12 Cu5 N12A N13 6(3) 4_565 4_565
N12A Cu5 N12A N13 -175(2) 4_565 4_565
N13 Cu5 N12A N13 -172(3) . 4_565
N13A Cu5 N12A C39 52(7) . 4_565
N13A Cu5 N12A C39 -127(6) 4_565 4_565
N12 Cu5 N12A C39 -169(100) . 4_565
N12 Cu5 N12A C39 53(7) 4_565 4_565
N12A Cu5 N12A C39 -128(7) 4_565 4_565
N13 Cu5 N12A C39 47(6) 4_565 4_565
N13 Cu5 N12A C39 -125(7) . 4_565
N13A Cu5 N12A C28A -1(2) . .
N13A Cu5 N12A C28A -179(2) 4_565 .
N12 Cu5 N12A C28A 139(99) . .
N12 Cu5 N12A C28A 0(3) 4_565 .
N12A Cu5 N12A C28A 180(2) 4_565 .
N13 Cu5 N12A C28A -6(2) 4_565 .
N13 Cu5 N12A C28A -178(2) . .
N13A Cu5 N12A C25A 177.4(16) . .
N13A Cu5 N12A C25A -1(3) 4_565 .
N12 Cu5 N12A C25A -43(100) . .
N12 Cu5 N12A C25A 178.3(15) 4_565 .
N12A Cu5 N12A C25A -2.1(18) 4_565 .
N13 Cu5 N12A C25A 173(3) 4_565 .
N13 Cu5 N12A C25A 0.2(15) . .
N13A Cu5 N12A C40 160(3) . 4_565
N13A Cu5 N12A C40 -18(4) 4_565 4_565
N12 Cu5 N12A C40 -60(100) . 4_565
N12 Cu5 N12A C40 161(2) 4_565 4_565
N12A Cu5 N12A C40 -19(3) 4_565 4_565
N13 Cu5 N12A C40 155(4) 4_565 4_565
N13 Cu5 N12A C40 -17(3) . 4_565
N13A Cu5 N12 N13A -177(4) . 4_565
N12 Cu5 N12 N13A -178(3) 4_565 4_565
N12A Cu5 N12 N13A 2(3) 4_565 4_565
N12A Cu5 N12 N13A 43(100) . 4_565
N13 Cu5 N12 N13A -173(2) 4_565 4_565
N13 Cu5 N12 N13A 0(3) . 4_565
N13A Cu5 N12 C39A -115(10) . 4_565
N13A Cu5 N12 C39A 63(9) 4_565 4_565
N12 Cu5 N12 C39A -115(10) 4_565 4_565
N12A Cu5 N12 C39A 65(10) 4_565 4_565
N12A Cu5 N12 C39A 106(100) . 4_565
N13 Cu5 N12 C39A -111(10) 4_565 4_565
N13 Cu5 N12 C39A 62(10) . 4_565
N13A Cu5 N12 C28 178(3) . .
N13A Cu5 N12 C28 -4(3) 4_565 .
N12 Cu5 N12 C28 177(2) 4_565 .
N12A Cu5 N12 C28 -2(3) 4_565 .
N12A Cu5 N12 C28 38(100) . .
N13 Cu5 N12 C28 -178(2) 4_565 .
N13 Cu5 N12 C28 -5(2) . .
N13A Cu5 N12 C25 -1.9(15) . .
N13A Cu5 N12 C25 176(4) 4_565 .
N12 Cu5 N12 C25 -2.6(18) 4_565 .
N12A Cu5 N12 C25 177.8(15) 4_565 .
N12A Cu5 N12 C25 -142(100) . .
N13 Cu5 N12 C25 2(3) 4_565 .
N13 Cu5 N12 C25 175.3(17) . .
N13A Cu5 N12 C40A -5(3) . 4_565
N13A Cu5 N12 C40A 172(6) 4_565 4_565
N12 Cu5 N12 C40A -6(4) 4_565 4_565
N12A Cu5 N12 C40A 174(3) 4_565 4_565
N12A Cu5 N12 C40A -145(99) . 4_565
N13 Cu5 N12 C40A -1(5) 4_565 4_565
N13 Cu5 N12 C40A 172(3) . 4_565
N13A Cu5 N13A N12 -3(4) 4_565 4_565
N12 Cu5 N13A N12 -2(2) . 4_565
N12A Cu5 N13A N12 179(3) 4_565 4_565
N12A Cu5 N13A N12 178(3) . 4_565
N13 Cu5 N13A N12 -180(3) 4_565 4_565
N13 Cu5 N13A N12 -52(15) . 4_565
N13A Cu5 N13A C28 -37(19) 4_565 4_565
N12 Cu5 N13A C28 -36(18) . 4_565
N12 Cu5 N13A C28 -34(16) 4_565 4_565
N12A Cu5 N13A C28 145(17) 4_565 4_565
N12A Cu5 N13A C28 144(18) . 4_565
N13 Cu5 N13A C28 146(18) 4_565 4_565
N13 Cu5 N13A C28 -86(25) . 4_565
N13A Cu5 N13A C39A 7(3) 4_565 .
N12 Cu5 N13A C39A 8(2) . .
N12 Cu5 N13A C39A 10(3) 4_565 .
N12A Cu5 N13A C39A -171(2) 4_565 .
N12A Cu5 N13A C39A -172(2) . .
N13 Cu5 N13A C39A -170(3) 4_565 .
N13 Cu5 N13A C39A -42(15) . .
N13A Cu5 N13A C36A 176.1(12) 4_565 .
N12 Cu5 N13A C36A 177(2) . .
N12 Cu5 N13A C36A 179(4) 4_565 .
N12A Cu5 N13A C36A -2(4) 4_565 .
N12A Cu5 N13A C36A -3.1(19) . .
N13 Cu5 N13A C36A -0.8(18) 4_565 .
N13 Cu5 N13A C36A 126(13) . .
N13A Cu5 N13A C29 -176.4(19) 4_565 4_565
N12 Cu5 N13A C29 -175(3) . 4_565
N12 Cu5 N13A C29 -174(5) 4_565 4_565
N12A Cu5 N13A C29 5(5) 4_565 4_565
N12A Cu5 N13A C29 4(3) . 4_565
N13 Cu5 N13A C29 7(3) 4_565 4_565
N13 Cu5 N13A C29 134(13) . 4_565
N13A Cu5 N13 N12A -134(13) . 4_565
N13A Cu5 N13 N12A 175(3) 4_565 4_565
N12 Cu5 N13 N12A 175(2) . 4_565
N12 Cu5 N13 N12A 179(2) 4_565 4_565
N12A Cu5 N13 N12A -4.9(18) . 4_565
N13 Cu5 N13 N12A -9(3) 4_565 4_565
N13A Cu5 N13 C28A -156(12) . 4_565
N13A Cu5 N13 C28A 153(10) 4_565 4_565
N12 Cu5 N13 C28A 153(9) . 4_565
N12 Cu5 N13 C28A 158(8) 4_565 4_565
N12A Cu5 N13 C28A -22(8) 4_565 4_565
N12A Cu5 N13 C28A -27(9) . 4_565
N13 Cu5 N13 C28A -30(10) 4_565 4_565
N13A Cu5 N13 C39 -122(14) . .
N13A Cu5 N13 C39 -173(2) 4_565 .
N12 Cu5 N13 C39 -173(2) . .
N12 Cu5 N13 C39 -169(2) 4_565 .
N12A Cu5 N13 C39 12(2) 4_565 .
N12A Cu5 N13 C39 7(2) . .
N13 Cu5 N13 C39 4(3) 4_565 .
N13A Cu5 N13 C36 52(15) . .
N13A Cu5 N13 C36 1.5(19) 4_565 .
N12 Cu5 N13 C36 2(2) . .
N12 Cu5 N13 C36 6(3) 4_565 .
N12A Cu5 N13 C36 -173(4) 4_565 .
N12A Cu5 N13 C36 -178(2) . .
N13 Cu5 N13 C36 178.2(13) 4_565 .
N13A Cu5 N13 C29A 58(15) . 4_565
N13A Cu5 N13 C29A 7(3) 4_565 4_565
N12 Cu5 N13 C29A 7(3) . 4_565
N12 Cu5 N13 C29A 12(5) 4_565 4_565
N12A Cu5 N13 C29A -167(5) 4_565 4_565
N12A Cu5 N13 C29A -172(3) . 4_565
N13 Cu5 N13 C29A -176(2) 4_565 4_565
C41A N14A N15A C41A -20(2) . 4_575
N15A N14A N15A C41A -54(5) 4_575 4_575
C41A N14A N15A C33A -52(3) 4_575 4_575
C41A N14A N15A C33A -72(3) . 4_575
N15A N14A N15A C33A -106(5) 4_575 4_575
C41A N14A N15A N16A 18(2) 4_575 .
C41A N14A N15A N16A -2(3) . .
N15A N14A N15A N16A -35(5) 4_575 .
C41A N14A N15A C34A -120(4) 4_575 4_575
C41A N14A N15A C34A -140(2) . 4_575
N15A N14A N15A C34A -174(2) 4_575 4_575
C41 N14 N15 C41 17(2) . 4
N15 N14 N15 C41 49(6) 4 4
C41 N14 N15 N16 -20(3) 4 .
C41 N14 N15 N16 -3(4) . .
N15 N14 N15 N16 29(6) 4 .
C41 N14 N15 C33 32(3) 4 4
C41 N14 N15 C33 49(4) . 4
N15 N14 N15 C33 81(7) 4 4
C41 N14 N15 C34 93(4) 4 4
C41 N14 N15 C34 110(3) . 4
N15 N14 N15 C34 142(4) 4 4
C33A N15A N16A C41A 108(4) 4_575 4_575
N14A N15A N16A C41A -25(3) . 4_575
C34A N15A N16A C41A 122(4) 4_575 4_575
C41A N15A N16A N17A 27(3) 4_575 .
C33A N15A N16A N17A 135(3) 4_575 .
N14A N15A N16A N17A 2(3) . .
C34A N15A N16A N17A 149.1(19) 4_575 .
C41A N15A N16A C33A -108(4) 4_575 4_575
N14A N15A N16A C33A -133(3) . 4_575
C34A N15A N16A C33A 14.3(19) 4_575 4_575
C41A N15A N16A C32A -108(3) 4_575 4_575
C33A N15A N16A C32A 0.0(18) 4_575 4_575
N14A N15A N16A C32A -133.0(19) . 4_575
C34A N15A N16A C32A 14(2) 4_575 4_575
N14 N15 N16 C41 28(3) . 4
C33 N15 N16 C41 -106(4) 4 4
C34 N15 N16 C41 -106(4) 4 4
C41 N15 N16 C33 106(4) 4 4
N14 N15 N16 C33 134(3) . 4
C34 N15 N16 C33 0(2) 4 4
C41 N15 N16 N17 -27(3) 4 .
N14 N15 N16 N17 0(4) . .
C33 N15 N16 N17 -133(3) 4 .
C34 N15 N16 N17 -133(2) 4 .
C41 N15 N16 C32 125(4) 4 4
N14 N15 N16 C32 153(2) . 4
C33 N15 N16 C32 19(2) 4 4
C34 N15 N16 C32 20(2) 4 4
N15A N16A N17A C41A -20(2) . 4_575
C33A N16A N17A C41A 34(3) 4_575 4_575
C32A N16A N17A C41A 98(3) 4_575 4_575
C41A N16A N17A C41A 19(2) 4_575 .
N15A N16A N17A C41A -1(3) . .
C33A N16A N17A C41A 53(4) 4_575 .
C32A N16A N17A C41A 116(2) 4_575 .
C41A N16A N17A N16A 50(5) 4_575 4_575
N15A N16A N17A N16A 31(5) . 4_575
C33A N16A N17A N16A 84(6) 4_575 4_575
C32A N16A N17A N16A 148(3) 4_575 4_575
C41 N16 N17 C41 -18(2) 4 .
C33 N16 N17 C41 -70(4) 4 .
N15 N16 N17 C41 2(4) . .
C32 N16 N17 C41 -143(3) 4 .
C33 N16 N17 C41 -52(3) 4 4
N15 N16 N17 C41 20(3) . 4
C32 N16 N17 C41 -125(4) 4 4
C41 N16 N17 N16 -49(6) 4 4
C33 N16 N17 N16 -101(6) 4 4
N15 N16 N17 N16 -29(6) . 4
C32 N16 N17 N16 -174(2) 4 4
N18 N18A N19A C45 -41(29) 4_566 4_566
C48 N18A N19A C45 -30(4) 4_566 4_566
C48A N18A N19A C45 -53(4) . 4_566
N18 N18A N19A C44 -123(28) 4_566 4_566
C48 N18A N19A C44 -112(4) 4_566 4_566
C48A N18A N19A C44 -135(3) . 4_566
C45 N18A N19A C44 -82(4) 4_566 4_566
N18 N18A N19A N20A 7(29) 4_566 .
C48 N18A N19A N20A 18(4) 4_566 .
C48A N18A N19A N20A -5(4) . .
C45 N18A N19A N20A 48(3) 4_566 .
N18 N18A N19A C48 -11(27) 4_566 4_566
C48A N18A N19A C48 -23(3) . 4_566
C45 N18A N19A C48 30(4) 4_566 4_566
N18A N18 N19 C45A -75(12) 4_564 4_564
C48A N18 N19 C45A -37(4) 4_564 4_564
C48 N18 N19 C45A -26(6) . 4_564
N18A N18 N19 C46A -172(10) 4_564 4_564
C48A N18 N19 C46A -133(5) 4_564 4_564
C48 N18 N19 C46A -123(5) . 4_564
C45A N18 N19 C46A -97(7) 4_564 4_564
N18A N18 N19 N20 -53(12) 4_564 .
C48A N18 N19 N20 -15(4) 4_564 .
C48 N18 N19 N20 -4(5) . .
C45A N18 N19 N20 22(4) 4_564 .
N18A N18 N19 C48A -38(10) 4_564 4_564
C48 N18 N19 C48A 11(3) . 4_564
C45A N18 N19 C48A 37(4) 4_564 4_564
C44 N19A N20A C45 40(3) 4_566 4_566
N18A N19A N20A C45 -87(4) . 4_566
C48 N19A N20A C45 -74(3) 4_566 4_566
C45 N19A N20A C46 -26(3) 4_566 4_566
C44 N19A N20A C46 14(4) 4_566 4_566
N18A N19A N20A C46 -113(3) . 4_566
C48 N19A N20A C46 -100(3) 4_566 4_566
C45 N19A N20A N21A 94(4) 4_566 .
C44 N19A N20A N21A 134(3) 4_566 .
N18A N19A N20A N21A 7(4) . .
C48 N19A N20A N21A 20(3) 4_566 .
C45 N19A N20A C48 74(3) 4_566 4_566
C44 N19A N20A C48 114(4) 4_566 4_566
N18A N19A N20A C48 -13(3) . 4_566
C46A N19 N20 C45A 47(5) 4_564 4_564
N18 N19 N20 C45A -86(6) . 4_564
C48A N19 N20 C45A -98(6) 4_564 4_564
C45A N19 N20 C44A -63(7) 4_564 4_564
C46A N19 N20 C44A -16(8) 4_564 4_564
N18 N19 N20 C44A -149(6) . 4_564
C48A N19 N20 C44A -162(8) 4_564 4_564
C45A N19 N20 N21 89(6) 4_564 .
C46A N19 N20 N21 136(4) 4_564 .
N18 N19 N20 N21 3(5) . .
C48A N19 N20 N21 -9(3) 4_564 .
C45A N19 N20 C48A 98(6) 4_564 4_564
C46A N19 N20 C48A 145(5) 4_564 4_564
N18 N19 N20 C48A 12(4) . 4_564
C45A N19 N20 C46A -47(6) 4_564 4_564
N18 N19 N20 C46A -133(6) . 4_564
C48A N19 N20 C46A -145(5) 4_564 4_564
C45 N20A N21A N21 -6(8) 4_566 4_566
C46 N20A N21A N21 67(6) 4_566 4_566
N19A N20A N21A N21 -52(8) . 4_566
C48 N20A N21A N21 -28(6) 4_566 4_566
C45 N20A N21A C48 22(4) 4_566 4_566
C46 N20A N21A C48 95(3) 4_566 4_566
N19A N20A N21A C48 -24(4) . 4_566
C45 N20A N21A C48A 40(5) 4_566 .
C46 N20A N21A C48A 113(3) 4_566 .
N19A N20A N21A C48A -6(4) . .
C48 N20A N21A C48A 19(3) 4_566 .
C46 N20A N21A C45 73(3) 4_566 4_566
N19A N20A N21A C45 -46(3) . 4_566
C48 N20A N21A C45 -22(4) 4_566 4_566
C45A N20 N21 N21A 102(8) 4_564 4_564
C44A N20 N21 N21A -135(6) 4_564 4_564
N19 N20 N21 N21A 65(7) . 4_564
C48A N20 N21 N21A 53(5) 4_564 4_564
C46A N20 N21 N21A 94(7) 4_564 4_564
C45A N20 N21 C48A 48(6) 4_564 4_564
C44A N20 N21 C48A 172(5) 4_564 4_564
N19 N20 N21 C48A 12(4) . 4_564
C46A N20 N21 C48A 41(5) 4_564 4_564
C45A N20 N21 C48 35(8) 4_564 .
C44A N20 N21 C48 159(4) 4_564 .
N19 N20 N21 C48 -1(5) . .
C48A N20 N21 C48 -13(4) 4_564 .
C46A N20 N21 C48 28(6) 4_564 .
C44A N20 N21 C45A 123(9) 4_564 4_564
N19 N20 N21 C45A -36(5) . 4_564
C48A N20 N21 C45A -48(6) 4_564 4_564
C46A N20 N21 C45A -7(4) 4_564 4_564
N10 Cu3 Cl1 Cu4 46.3(5) 4_565 .
N10 Cu3 Cl1 Cu4 -46.3(5) . .
O1W Cu3 Cl1 Cu4 180.000(3) . .
N9 Cu4 Cl1 Cu3 45.3(4) . .
N9 Cu4 Cl1 Cu3 -45.3(4) 4_565 .
N5 Cu4 Cl1 Cu3 135.6(3) 1_655 .
N5 Cu4 Cl1 Cu3 -135.6(3) 4_665 .
Cl2 Cu4 Cl1 Cu3 180.00(6) . .
N6 Cu2 Cl2 Cu4 134.7(3) 3_061 .
N6 Cu2 Cl2 Cu4 -134.7(3) 2_051 .
N6 Cu2 Cl2 Cu4 -45.3(3) 1_655 .
N6 Cu2 Cl2 Cu4 45.3(3) 4_665 .
Cl2 Cu2 Cl2 Cu4 16(100) 3_161 .
N9 Cu4 Cl2 Cu2 134.5(4) . .
N9 Cu4 Cl2 Cu2 -134.5(4) 4_565 .
N5 Cu4 Cl2 Cu2 44.4(3) 1_655 .
N5 Cu4 Cl2 Cu2 -44.4(3) 4_665 .
Cl1 Cu4 Cl2 Cu2 0.00(5) . .
C2 N1 C2 C3 179.5(9) 4_575 .
Cu1 N1 C2 C3 -2(3) . .
C2 N1 C2 C1 -2(2) 4_575 .
Cu1 N1 C2 C1 176.6(11) . .
C1 C1 C2 N1 1.2(15) 4_575 .
C1 C1 C2 C3 179.9(13) 4_575 .
N1 C2 C3 C4 -1(3) . .
C1 C2 C3 C4 -179.1(15) . .
N1 C2 C3 C11 180.0(15) . .
C1 C2 C3 C11 1(2) . .
C2 C3 C4 N2 4(2) . .
C11 C3 C4 N2 -176.4(13) . .
C2 C3 C4 C5 -177.1(14) . .
C11 C3 C4 C5 2(2) . .
C7 N2 C4 C3 178.9(14) . .
Cu1 N2 C4 C3 -4(2) . .
C7 N2 C4 C5 0.0(15) . .
Cu1 N2 C4 C5 176.7(8) . .
C3 C4 C5 C6 -178.7(14) . .
N2 C4 C5 C6 0.3(16) . .
C4 C5 C6 C7 -0.4(16) . .
C4 N2 C7 C8 178.6(14) . .
Cu1 N2 C7 C8 2(2) . .
C4 N2 C7 C6 -0.3(15) . .
Cu1 N2 C7 C6 -176.8(9) . .
C5 C6 C7 C8 -178.4(15) . .
C5 C6 C7 N2 0.5(16) . .
N2 C7 C8 C9 -2(3) . .
C6 C7 C8 C9 177.1(15) . .
N2 C7 C8 C18 179.2(13) . .
C6 C7 C8 C18 -2(2) . .
C9 N3 C9 C10 -1(2) 4_575 .
Cu1 N3 C9 C10 173.7(12) . .
C9 N3 C9 C8 -177.9(10) 4_575 .
Cu1 N3 C9 C8 -3(3) . .
C7 C8 C9 N3 2(3) . .
C18 C8 C9 N3 -178.5(16) . .
C7 C8 C9 C10 -174.5(16) . .
C18 C8 C9 C10 5(3) . .
N3 C9 C10 C10 0.5(15) . 4_575
C8 C9 C10 C10 177.6(14) . 4_575
C4 C3 C11 C12 -83(2) . .
C2 C3 C11 C12 96.9(19) . .
C4 C3 C11 C16 89.4(19) . .
C2 C3 C11 C16 -91.2(19) . .
C16 C11 C12 C13 9(3) . .
C3 C11 C12 C13 -178.4(16) . .
C11 C12 C13 C14 -11(3) . .
C12 C13 C14 C15 7(3) . .
C12 C13 C14 C17 -171.4(16) . .
C13 C14 C15 C16 -2(3) . .
C17 C14 C15 C16 175.8(15) . .
C12 C11 C16 C15 -5(3) . .
C3 C11 C16 C15 -176.8(15) . .
C14 C15 C16 C11 1(3) . .
N6 N7 C17 N4 6.0(19) . .
N6 N7 C17 C14 176.6(13) . .
N5 N4 C17 N7 -4.6(18) . .
N5 N4 C17 C14 -175.2(13) . .
C13 C14 C17 N7 3(3) . .
C15 C14 C17 N7 -175.4(15) . .
C13 C14 C17 N4 172.7(17) . .
C15 C14 C17 N4 -5(2) . .
C7 C8 C18 C23 -94(2) . .
C9 C8 C18 C23 86(2) . .
C7 C8 C18 C19 84(2) . .
C9 C8 C18 C19 -95(2) . .
C23 C18 C19 C20 5(3) . .
C8 C18 C19 C20 -174.2(17) . .
C18 C19 C20 C21 -3(3) . .
C19 C20 C21 C22 -1(3) . .
C19 C20 C21 C24 177.7(17) . .
C20 C21 C22 C23 2(3) . .
C24 C21 C22 C23 -176.2(18) . .
C19 C18 C23 C22 -3(3) . .
C8 C18 C23 C22 175.6(18) . .
C21 C22 C23 C18 0(3) . .
N9 N8 C24 N11 7(2) . .
N9 N8 C24 C21 -179.2(18) . .
N10 N11 C24 N8 -9(2) . .
N10 N11 C24 C21 176.9(17) . .
C20 C21 C24 N8 6(3) . .
C22 C21 C24 N8 -175.5(19) . .
C20 C21 C24 N11 179.7(19) . .
C22 C21 C24 N11 -2(3) . .
N13 N12A C25A C40 45(9) 4_565 4_565
C39 N12A C25A C40 46(6) 4_565 4_565
C28A N12A C25A C40 61(7) . 4_565
Cu5 N12A C25A C40 -117(7) . 4_565
N13 N12A C25A C25A 164(7) 4_565 4_565
C39 N12A C25A C25A 165(2) 4_565 4_565
C28A N12A C25A C25A -179.6(16) . 4_565
C40 N12A C25A C25A 119(7) 4_565 4_565
Cu5 N12A C25A C25A 1.9(16) . 4_565
N13 N12A C25A C39 -1(6) 4_565 4_565
C28A N12A C25A C39 15(3) . 4_565
C40 N12A C25A C39 -46(6) 4_565 4_565
Cu5 N12A C25A C39 -163(3) . 4_565
N13 N12A C25A C40 146(7) 4_565 .
C39 N12A C25A C40 148(4) 4_565 .
C28A N12A C25A C40 163(3) . .
C40 N12A C25A C40 102(9) 4_565 .
Cu5 N12A C25A C40 -15(3) . .
N13 N12A C25A C26A -16(7) 4_565 .
C39 N12A C25A C26A -15(2) 4_565 .
C28A N12A C25A C26A 0.1(17) . .
C40 N12A C25A C26A -61(6) 4_565 .
Cu5 N12A C25A C26A -178(2) . .
N13 N12A C25A C42 1(8) 4_565 4_565
C39 N12A C25A C42 2(3) 4_565 4_565
C28A N12A C25A C42 17(3) . 4_565
C40 N12A C25A C42 -44(6) 4_565 4_565
Cu5 N12A C25A C42 -161(3) . 4_565
N13A N12 C25 C40A 8(18) 4_565 4_565
C39A N12 C25 C40A 6(16) 4_565 4_565
C28 N12 C25 C40A 19(16) . 4_565
Cu5 N12 C25 C40A -161(17) . 4_565
N13A N12 C25 C25 172(8) 4_565 4_565
C39A N12 C25 C25 169(3) 4_565 4_565
C28 N12 C25 C25 -177.7(17) . 4_565
C40A N12 C25 C25 164(17) 4_565 4_565
Cu5 N12 C25 C25 2.3(16) . 4_565
N13A N12 C25 C39A 2(7) 4_565 4_565
C28 N12 C25 C39A 13(3) . 4_565
C40A N12 C25 C39A -6(16) 4_565 4_565
Cu5 N12 C25 C39A -167(4) . 4_565
N13A N12 C25 C40A 168(9) 4_565 .
C39A N12 C25 C40A 166(6) 4_565 .
C28 N12 C25 C40A 179(5) . .
C40A N12 C25 C40A 160(21) 4_565 .
Cu5 N12 C25 C40A -1(4) . .
N13A N12 C25 C26 -10(8) 4_565 .
C39A N12 C25 C26 -12(2) 4_565 .
C28 N12 C25 C26 0.7(17) . .
C40A N12 C25 C26 -18(16) 4_565 .
Cu5 N12 C25 C26 -179(2) . .
N13A N12 C25 C42A -7(9) 4_565 4_565
C39A N12 C25 C42A -9(4) 4_565 4_565
C28 N12 C25 C42A 4(4) . 4_565
C40A N12 C25 C42A -15(14) 4_565 4_565
Cu5 N12 C25 C42A -176(3) . 4_565
C40 C25A C26A C42 59(5) 4_565 4_565
C25A C25A C26A C42 -16(3) 4_565 4_565
C39 C25A C26A C42 153(3) 4_565 4_565
C40 C25A C26A C42 3(4) . 4_565
N12A C25A C26A C42 164(2) . 4_565
C25A C25A C26A C40 -76(5) 4_565 4_565
C39 C25A C26A C40 93(5) 4_565 4_565
C40 C25A C26A C40 -56(4) . 4_565
N12A C25A C26A C40 105(5) . 4_565
C42 C25A C26A C40 -59(5) 4_565 4_565
C40 C25A C26A C27A -107(5) 4_565 .
C25A C25A C26A C27A 177.7(18) 4_565 .
C39 C25A C26A C27A -13(2) 4_565 .
C40 C25A C26A C27A -163(4) . .
N12A C25A C26A C27A -1.9(19) . .
C42 C25A C26A C27A -166(3) 4_565 .
C40 C25A C26A C39 -93(5) 4_565 4_565
C25A C25A C26A C39 -169(2) 4_565 4_565
C40 C25A C26A C39 -149(4) . 4_565
N12A C25A C26A C39 11.4(18) . 4_565
C42 C25A C26A C39 -153(3) 4_565 4_565
C40 C25A C26A C43 105(5) 4_565 4_565
C25A C25A C26A C43 29(3) 4_565 4_565
C39 C25A C26A C43 -162(3) 4_565 4_565
C40 C25A C26A C43 49(4) . 4_565
N12A C25A C26A C43 -151(2) . 4_565
C42 C25A C26A C43 45.2(16) 4_565 4_565
C40 C25A C26A C38 -93(5) 4_565 4_565
C25A C25A C26A C38 -168.7(14) 4_565 4_565
C39 C25A C26A C38 0(2) 4_565 4_565
C40 C25A C26A C38 -149(4) . 4_565
N12A C25A C26A C38 11.7(18) . 4_565
C42 C25A C26A C38 -153(3) 4_565 4_565
C25 C25 C26 C40A -20(14) 4_565 4_565
C39A C25 C26 C40A 152(16) 4_565 4_565
C40A C25 C26 C40A -16(11) . 4_565
N12 C25 C26 C40A 162(16) . 4_565
C42A C25 C26 C40A -15(14) 4_565 4_565
C40A C25 C26 C42A 15(14) 4_565 4_565
C25 C25 C26 C42A -5(3) 4_565 4_565
C39A C25 C26 C42A 167(4) 4_565 4_565
C40A C25 C26 C42A -1(4) . 4_565
N12 C25 C26 C42A 177(3) . 4_565
C40A C25 C26 C27 -164(16) 4_565 .
C25 C25 C26 C27 175(2) 4_565 .
C39A C25 C26 C27 -12(2) 4_565 .
C40A C25 C26 C27 180(5) . .
N12 C25 C26 C27 -2.2(19) . .
C42A C25 C26 C27 -179(3) 4_565 .
C40A C25 C26 C39A -152(16) 4_565 4_565
C25 C25 C26 C39A -172(3) 4_565 4_565
C40A C25 C26 C39A -168(5) . 4_565
N12 C25 C26 C39A 10(2) . 4_565
C42A C25 C26 C39A -167(4) 4_565 4_565
C40A C25 C26 C38A -149(15) 4_565 4_565
C25 C25 C26 C38A -169.3(16) 4_565 4_565
C39A C25 C26 C38A 3(2) 4_565 4_565
C40A C25 C26 C38A -165(4) . 4_565
N12 C25 C26 C38A 13.0(19) . 4_565
C42A C25 C26 C38A -164(3) 4_565 4_565
C40A C25 C26 C47A 59(15) 4_565 4_565
C25 C25 C26 C47A 38(3) 4_565 4_565
C39A C25 C26 C47A -149(3) 4_565 4_565
C40A C25 C26 C47A 42(4) . 4_565
N12 C25 C26 C47A -140(2) . 4_565
C42A C25 C26 C47A 43.4(15) 4_565 4_565
C42 C26A C27A C38 -70(7) 4_565 4_565
C40 C26A C27A C38 58(5) 4_565 4_565
C25A C26A C27A C38 76(5) . 4_565
C39 C26A C27A C38 62(4) 4_565 4_565
C43 C26A C27A C38 -133(4) 4_565 4_565
C42 C26A C27A C39 -132(7) 4_565 4_565
C40 C26A C27A C39 -5(3) 4_565 4_565
C25A C26A C27A C39 14(2) . 4_565
C43 C26A C27A C39 164(3) 4_565 4_565
C38 C26A C27A C39 -62(4) 4_565 4_565
C42 C26A C27A C28A -143(6) 4_565 .
C40 C26A C27A C28A -15(4) 4_565 .
C25A C26A C27A C28A 3(3) . .
C39 C26A C27A C28A -11(2) 4_565 .
C43 C26A C27A C28A 153(2) 4_565 .
C38 C26A C27A C28A -73(4) 4_565 .
C42 C26A C27A C37 -116(6) 4_565 4_565
C40 C26A C27A C37 12(7) 4_565 4_565
C25A C26A C27A C37 30(7) . 4_565
C39 C26A C27A C37 16(5) 4_565 4_565
C43 C26A C27A C37 -179(5) 4_565 4_565
C38 C26A C27A C37 -46(5) 4_565 4_565
C40A C26 C27 C38A 75(6) 4_565 4_565
C42A C26 C27 C38A -98(9) 4_565 4_565
C39A C26 C27 C38A 68(4) 4_565 4_565
C25 C26 C27 C38A 79(4) . 4_565
C47A C26 C27 C38A -144(4) 4_565 4_565
C40A C26 C27 C39A 8(4) 4_565 4_565
C42A C26 C27 C39A -166(9) 4_565 4_565
C25 C26 C27 C39A 12(2) . 4_565
C38A C26 C27 C39A -68(4) 4_565 4_565
C47A C26 C27 C39A 149(3) 4_565 4_565
C40A C26 C27 C28 -1(5) 4_565 .
C42A C26 C27 C28 -175(8) 4_565 .
C39A C26 C27 C28 -9(3) 4_565 .
C25 C26 C27 C28 3(3) . .
C38A C26 C27 C28 -77(4) 4_565 .
C47A C26 C27 C28 140(2) 4_565 .
C40A C26 C27 C37A 32(8) 4_565 4_565
C42A C26 C27 C37A -142(7) 4_565 4_565
C39A C26 C27 C37A 24(5) 4_565 4_565
C25 C26 C27 C37A 36(6) . 4_565
C38A C26 C27 C37A -43(4) 4_565 4_565
C47A C26 C27 C37A 173(4) 4_565 4_565
N13 N12A C28A C39 151(5) 4_565 4_565
C25A N12A C28A C39 -20(3) . 4_565
C40 N12A C28A C39 -7(3) 4_565 4_565
Cu5 N12A C28A C39 158(4) . 4_565
C39 N12A C28A N13 -151(5) 4_565 4_565
C25A N12A C28A N13 -171(3) . 4_565
C40 N12A C28A N13 -158(4) 4_565 4_565
Cu5 N12A C28A N13 7(3) . 4_565
N13 N12A C28A C38 151(5) 4_565 4_565
C39 N12A C28A C38 0(4) 4_565 4_565
C25A N12A C28A C38 -20(4) . 4_565
C40 N12A C28A C38 -7(4) 4_565 4_565
Cu5 N12A C28A C38 158(3) . 4_565
N13 N12A C28A C36 -3(3) 4_565 4_565
C39 N12A C28A C36 -154(5) 4_565 4_565
C25A N12A C28A C36 -174(2) . 4_565
C40 N12A C28A C36 -161(3) 4_565 4_565
Cu5 N12A C28A C36 4(4) . 4_565
N13 N12A C28A C27A 173(4) 4_565 .
C39 N12A C28A C27A 22(3) 4_565 .
C25A N12A C28A C27A 2(3) . .
C40 N12A C28A C27A 15(3) 4_565 .
Cu5 N12A C28A C27A -180(2) . .
N13 N12A C28A C29A -8(4) 4_565 .
C39 N12A C28A C29A -159(5) 4_565 .
C25A N12A C28A C29A -179(3) . .
C40 N12A C28A C29A -166(3) 4_565 .
Cu5 N12A C28A C29A -1(4) . .
N13 N12A C28A C37 44(9) 4_565 4_565
C39 N12A C28A C37 -107(11) 4_565 4_565
C25A N12A C28A C37 -127(9) . 4_565
C40 N12A C28A C37 -114(9) 4_565 4_565
Cu5 N12A C28A C37 52(11) . 4_565
C38 C27A C28A C39 -115(6) 4_565 4_565
C26A C27A C28A C39 15(3) . 4_565
C37 C27A C28A C39 -151(4) 4_565 4_565
C38 C27A C28A N13 -123(8) 4_565 4_565
C39 C27A C28A N13 -9(6) 4_565 4_565
C26A C27A C28A N13 6(8) . 4_565
C37 C27A C28A N13 -160(8) 4_565 4_565
C39 C27A C28A C38 115(6) 4_565 4_565
C26A C27A C28A C38 130(6) . 4_565
C37 C27A C28A C38 -37(4) 4_565 4_565
C38 C27A C28A C36 41(7) 4_565 4_565
C39 C27A C28A C36 156(6) 4_565 4_565
C26A C27A C28A C36 171(4) . 4_565
C37 C27A C28A C36 5(3) 4_565 4_565
C38 C27A C28A N12A -133(5) 4_565 .
C39 C27A C28A N12A -18(3) 4_565 .
C26A C27A C28A N12A -3(3) . .
C37 C27A C28A N12A -169(3) 4_565 .
C38 C27A C28A C29A 48(6) 4_565 .
C39 C27A C28A C29A 162(5) 4_565 .
C26A C27A C28A C29A 178(3) . .
C37 C27A C28A C29A 11(3) 4_565 .
C38 C27A C28A C37 37(4) 4_565 4_565
C39 C27A C28A C37 151(4) 4_565 4_565
C26A C27A C28A C37 167(3) . 4_565
C39A N12 C28 N13A -159(6) 4_565 4_565
C25 N12 C28 N13A -174(4) . 4_565
C40A N12 C28 N13A -172(5) 4_565 4_565
Cu5 N12 C28 N13A 6(3) . 4_565
N13A N12 C28 C39A 159(6) 4_565 4_565
C25 N12 C28 C39A -15(3) . 4_565
C40A N12 C28 C39A -12(3) 4_565 4_565
Cu5 N12 C28 C39A 165(4) . 4_565
N13A N12 C28 C36A 3(3) 4_565 4_565
C39A N12 C28 C36A -156(4) 4_565 4_565
C25 N12 C28 C36A -171(2) . 4_565
C40A N12 C28 C36A -168(3) 4_565 4_565
Cu5 N12 C28 C36A 9(4) . 4_565
N13A N12 C28 C38A 153(5) 4_565 4_565
C39A N12 C28 C38A -6(3) 4_565 4_565
C25 N12 C28 C38A -21(3) . 4_565
C40A N12 C28 C38A -18(4) 4_565 4_565
Cu5 N12 C28 C38A 159(2) . 4_565
N13A N12 C28 C27 175(5) 4_565 .
C39A N12 C28 C27 16(3) 4_565 .
C25 N12 C28 C27 1(3) . .
C40A N12 C28 C27 4(3) 4_565 .
Cu5 N12 C28 C27 -179(2) . .
N13A N12 C28 C37A 64(7) 4_565 4_565
C39A N12 C28 C37A -95(8) 4_565 4_565
C25 N12 C28 C37A -110(7) . 4_565
C40A N12 C28 C37A -108(7) 4_565 4_565
Cu5 N12 C28 C37A 70(8) . 4_565
N13A N12 C28 C29 -3(5) 4_565 .
C39A N12 C28 C29 -162(5) 4_565 .
C25 N12 C28 C29 -178(3) . .
C40A N12 C28 C29 -175(3) 4_565 .
Cu5 N12 C28 C29 2(5) . .
C38A C27 C28 N13A -117(7) 4_565 4_565
C39A C27 C28 N13A -8(5) 4_565 4_565
C26 C27 C28 N13A 3(7) . 4_565
C37A C27 C28 N13A -158(7) 4_565 4_565
C38A C27 C28 C39A -109(6) 4_565 4_565
C26 C27 C28 C39A 11(3) . 4_565
C37A C27 C28 C39A -150(4) 4_565 4_565
C38A C27 C28 C36A 46(7) 4_565 4_565
C39A C27 C28 C36A 155(6) 4_565 4_565
C26 C27 C28 C36A 166(4) . 4_565
C37A C27 C28 C36A 5(4) 4_565 4_565
C39A C27 C28 C38A 109(6) 4_565 4_565
C26 C27 C28 C38A 120(6) . 4_565
C37A C27 C28 C38A -41(4) 4_565 4_565
C38A C27 C28 N12 -122(5) 4_565 .
C39A C27 C28 N12 -14(3) 4_565 .
C26 C27 C28 N12 -2(3) . .
C37A C27 C28 N12 -163(3) 4_565 .
C38A C27 C28 C37A 41(4) 4_565 4_565
C39A C27 C28 C37A 150(4) 4_565 4_565
C26 C27 C28 C37A 161(3) . 4_565
C38A C27 C28 C29 56(6) 4_565 .
C39A C27 C28 C29 165(4) 4_565 .
C26 C27 C28 C29 176(3) . .
C37A C27 C28 C29 15(3) 4_565 .
C39 C28A C29A C36 -49(13) 4_565 4_565
N13 C28A C29A C36 12(8) 4_565 4_565
C38 C28A C29A C36 -144(8) 4_565 4_565
N12A C28A C29A C36 17(9) . 4_565
C27A C28A C29A C36 -163(8) . 4_565
C37 C28A C29A C36 -148(10) 4_565 4_565
C39 C28A C29A C37 99(9) 4_565 4_565
N13 C28A C29A C37 160(4) 4_565 4_565
C38 C28A C29A C37 4(3) 4_565 4_565
C36 C28A C29A C37 148(10) 4_565 4_565
N12A C28A C29A C37 165(4) . 4_565
C27A C28A C29A C37 -15(4) . 4_565
C39 C28A C29A C36A -61(10) 4_565 .
N13 C28A C29A C36A 0(3) 4_565 .
C38 C28A C29A C36A -156(3) 4_565 .
C36 C28A C29A C36A -12(7) 4_565 .
N12A C28A C29A C36A 6(5) . .
C27A C28A C29A C36A -175(3) . .
C37 C28A C29A C36A -160(4) 4_565 .
C39 C28A C29A C30A 104(9) 4_565 .
N13 C28A C29A C30A 165(4) 4_565 .
C38 C28A C29A C30A 9(4) 4_565 .
C36 C28A C29A C30A 153(11) 4_565 .
N12A C28A C29A C30A 170(3) . .
C27A C28A C29A C30A -10(5) . .
C37 C28A C29A C30A 5(2) 4_565 .
C39 C28A C29A C29 -68(12) 4_565 4_565
N13 C28A C29A C29 -7(6) 4_565 4_565
C38 C28A C29A C29 -164(5) 4_565 4_565
C36 C28A C29A C29 -19(5) 4_565 4_565
N12A C28A C29A C29 -2(7) . 4_565
C27A C28A C29A C29 177(5) . 4_565
C37 C28A C29A C29 -167(7) 4_565 4_565
C39 C28A C29A N13 -61(9) 4_565 4_565
C38 C28A C29A N13 -157(4) 4_565 4_565
C36 C28A C29A N13 -12(8) 4_565 4_565
N12A C28A C29A N13 5(3) . 4_565
C27A C28A C29A N13 -176(5) . 4_565
C37 C28A C29A N13 -160(4) 4_565 4_565
N13A C28 C29 C36A 16(6) 4_565 4_565
C39A C28 C29 C36A -54(13) 4_565 4_565
C38A C28 C29 C36A -140(7) 4_565 4_565
N12 C28 C29 C36A 18(7) . 4_565
C27 C28 C29 C36A -160(6) . 4_565
C37A C28 C29 C36A -139(8) 4_565 4_565
N13A C28 C29 C37A 156(4) 4_565 4_565
C39A C28 C29 C37A 86(11) 4_565 4_565
C36A C28 C29 C37A 139(8) 4_565 4_565
C38A C28 C29 C37A -1(3) 4_565 4_565
N12 C28 C29 C37A 158(4) . 4_565
C27 C28 C29 C37A -21(4) . 4_565
N13A C28 C29 C36 3(4) 4_565 .
C39A C28 C29 C36 -67(11) 4_565 .
C36A C28 C29 C36 -14(5) 4_565 .
C38A C28 C29 C36 -154(3) 4_565 .
N12 C28 C29 C36 5(5) . .
C27 C28 C29 C36 -174(3) . .
C37A C28 C29 C36 -153(4) 4_565 .
N13A C28 C29 C30 165(4) 4_565 .
C39A C28 C29 C30 95(10) 4_565 .
C36A C28 C29 C30 149(8) 4_565 .
C38A C28 C29 C30 8(4) 4_565 .
N12 C28 C29 C30 167(3) . .
C27 C28 C29 C30 -11(5) . .
C37A C28 C29 C30 9(3) 4_565 .
N13A C28 C29 C29A -2(5) 4_565 4_565
C39A C28 C29 C29A -72(12) 4_565 4_565
C36A C28 C29 C29A -18(4) 4_565 4_565
C38A C28 C29 C29A -158(4) 4_565 4_565
N12 C28 C29 C29A 0(7) . 4_565
C27 C28 C29 C29A -178(4) . 4_565
C37A C28 C29 C29A -157(6) 4_565 4_565
C39A C28 C29 N13A -70(10) 4_565 4_565
C36A C28 C29 N13A -16(6) 4_565 4_565
C38A C28 C29 N13A -157(4) 4_565 4_565
N12 C28 C29 N13A 2(3) . 4_565
C27 C28 C29 N13A -176(5) . 4_565
C37A C28 C29 N13A -156(4) 4_565 4_565
C36 C29A C30A C37 102(14) 4_565 4_565
C28A C29A C30A C37 -6(3) . 4_565
C36A C29A C30A C37 160(4) . 4_565
C29 C29A C30A C37 169(4) 4_565 4_565
N13 C29A C30A C37 18(6) 4_565 4_565
C36 C29A C30A C35A 175(12) 4_565 .
C37 C29A C30A C35A 73(3) 4_565 .
C28A C29A C30A C35A 67(4) . .
C36A C29A C30A C35A -127(2) . .
C29 C29A C30A C35A -118(3) 4_565 .
N13 C29A C30A C35A 91(8) 4_565 .
C36 C29A C30A C31A 0(13) 4_565 .
C37 C29A C30A C31A -102(3) 4_565 .
C28A C29A C30A C31A -108(3) . .
C36A C29A C30A C31A 58(3) . .
C29 C29A C30A C31A 67(3) 4_565 .
N13 C29A C30A C31A -84(7) 4_565 .
C37 C29A C30A C36 -102(14) 4_565 4_565
C28A C29A C30A C36 -108(14) . 4_565
C36A C29A C30A C36 58(11) . 4_565
C29 C29A C30A C36 67(11) 4_565 4_565
N13 C29A C30A C36 -84(17) 4_565 4_565
C36 C29A C30A C30 -66(12) 4_565 4_565
C37 C29A C30A C30 -168(3) 4_565 4_565
C28A C29A C30A C30 -174(3) . 4_565
C36A C29A C30A C30 -8(2) . 4_565
C29 C29A C30A C30 1(2) 4_565 4_565
N13 C29A C30A C30 -150(7) 4_565 4_565
C36A C29 C30 C37A 81(8) 4_565 4_565
C28 C29 C30 C37A -10(3) . 4_565
C36 C29 C30 C37A 153(4) . 4_565
C29A C29 C30 C37A 160(4) 4_565 4_565
N13A C29 C30 C37A 11(6) 4_565 4_565
C36A C29 C30 C31 172(7) 4_565 .
C37A C29 C30 C31 91(3) 4_565 .
C28 C29 C30 C31 81(3) . .
C36 C29 C30 C31 -115(2) . .
C29A C29 C30 C31 -108(3) 4_565 .
N13A C29 C30 C31 102(6) 4_565 .
C36A C29 C30 C35 -17(8) 4_565 .
C37A C29 C30 C35 -98(3) 4_565 .
C28 C29 C30 C35 -108(3) . .
C36 C29 C30 C35 56(4) . .
C29A C29 C30 C35 63(4) 4_565 .
N13A C29 C30 C35 -87(6) 4_565 .
C37A C29 C30 C36A -81(8) 4_565 4_565
C28 C29 C30 C36A -91(8) . 4_565
C36 C29 C30 C36A 73(7) . 4_565
C29A C29 C30 C36A 80(7) 4_565 4_565
N13A C29 C30 C36A -70(10) 4_565 4_565
C36A C29 C30 C30A -81(7) 4_565 4_565
C37A C29 C30 C30A -162(3) 4_565 4_565
C28 C29 C30 C30A -172(3) . 4_565
C36 C29 C30 C30A -8(2) . 4_565
C29A C29 C30 C30A -1(3) 4_565 4_565
N13A C29 C30 C30A -151(6) 4_565 4_565
C37 C30A C31A C35 -128(2) 4_565 4_565
C35A C30A C31A C35 116(2) . 4_565
C29A C30A C31A C35 -69(3) . 4_565
C36 C30A C31A C35 -69(2) 4_565 4_565
C30 C30A C31A C35 -0.1(16) 4_565 4_565
C37 C30A C31A C32A 119(2) 4_565 .
C35A C30A C31A C32A 4(2) . .
C29A C30A C31A C32A 178.8(19) . .
C36 C30A C31A C32A 178.8(14) 4_565 .
C30 C30A C31A C32A -112.5(11) 4_565 .
C37A C30 C31 C32 -130.5(18) 4_565 .
C35 C30 C31 C32 7(2) . .
C29 C30 C31 C32 178.8(16) . .
C36A C30 C31 C32 179.8(14) 4_565 .
C30A C30 C31 C32 92.2(13) 4_565 .
C35 C31A C32A C33A -118(2) 4_565 .
C30A C31A C32A C33A -3.6(16) . .
C35 C31A C32A C34 -0.9(16) 4_565 4_565
C30A C31A C32A C34 113.6(16) . 4_565
C35 C31A C32A N16A -168(3) 4_565 4_575
C30A C31A C32A N16A -54(3) . 4_575
C30 C31 C32 C33 -0.9(18) . .
C30 C31 C32 N16 29(4) . 4
C31A C32A C33A N15A -153(4) . 4_575
C34 C32A C33A N15A 113(5) 4_565 4_575
N16A C32A C33A N15A 0(4) 4_575 4_575
C31A C32A C33A C34A 6(3) . .
C34 C32A C33A C34A -88(3) 4_565 .
N16A C32A C33A C34A 159(4) 4_575 .
C31A C32A C33A N16A -153.1(11) . 4_575
C34 C32A C33A N16A 113.1(19) 4_565 4_575
C31A C32A C33A C41A 179.0(19) . .
C34 C32A C33A C41A 85(3) 4_565 .
N16A C32A C33A C41A -28(2) 4_575 .
C31 C32 C33 N16 164.1(16) . 4
C31 C32 C33 C34 -4(4) . .
N16 C32 C33 C34 -168(5) 4 .
C31 C32 C33 N15 128(3) . 4
N16 C32 C33 N15 -36(3) 4 4
C31 C32 C33 C41 180(3) . .
N16 C32 C33 C41 16(3) 4 .
N15A C33A C34A C35A 161(3) 4_575 .
C32A C33A C34A C35A -9(4) . .
N16A C33A C34A C35A 129(4) 4_575 .
C41A C33A C34A C35A 179(3) . .
C32A C33A C34A N15A -170(4) . 4_575
N16A C33A C34A N15A -31(3) 4_575 4_575
C41A C33A C34A N15A 18(2) . 4_575
N16 C33 C34 C35 -152(6) 4 .
C32 C33 C34 C35 2(5) . .
N15 C33 C34 C35 -151(3) 4 .
C41 C33 C34 C35 179(3) . .
N16 C33 C34 C32A 119(7) 4 4_565
C32 C33 C34 C32A -87(3) . 4_565
N15 C33 C34 C32A 120(2) 4 4_565
C41 C33 C34 C32A 90(3) . 4_565
N16 C33 C34 N15 -1(6) 4 4
C32 C33 C34 N15 153(4) . 4
C41 C33 C34 N15 -30(2) . 4
C37 C30A C35A C34A -136(3) 4_565 .
C31A C30A C35A C34A -7(4) . .
C29A C30A C35A C34A 178(2) . .
C36 C30A C35A C34A 178(2) 4_565 .
C30 C30A C35A C34A 82(3) 4_565 .
C31A C30A C35A C37 129(3) . 4_565
C29A C30A C35A C37 -46(2) . 4_565
C36 C30A C35A C37 -45.8(15) 4_565 4_565
C30 C30A C35A C37 -142(2) 4_565 4_565
C33A C34A C35A C30A 9(4) . .
N15A C34A C35A C30A 44(7) 4_575 .
C33A C34A C35A C37 -35(5) . 4_565
N15A C34A C35A C37 0(8) 4_575 4_565
C33 C34 C35 C31A -110(3) . 4_565
C32A C34 C35 C31A 0.9(16) 4_565 4_565
N15 C34 C35 C31A -162(5) 4 4_565
C33 C34 C35 C30 4(5) . .
C32A C34 C35 C30 115(3) 4_565 .
N15 C34 C35 C30 -48(7) 4 .
C37A C30 C35 C31A -122(2) 4_565 4_565
C31 C30 C35 C31A 106(2) . 4_565
C29 C30 C35 C31A -65(3) . 4_565
C36A C30 C35 C31A -67(2) 4_565 4_565
C30A C30 C35 C31A 0.1(15) 4_565 4_565
C37A C30 C35 C34 124(3) 4_565 .
C31 C30 C35 C34 -9(4) . .
C29 C30 C35 C34 -179(3) . .
C36A C30 C35 C34 178(2) 4_565 .
C30A C30 C35 C34 -114(3) 4_565 .
N12 N13A C36A C29 -35(13) 4_565 4_565
C28 N13A C36A C29 -27(9) 4_565 4_565
C39A N13A C36A C29 -42(9) . 4_565
Cu5 N13A C36A C29 147(9) . 4_565
N12 N13A C36A C28 -8(8) 4_565 4_565
C39A N13A C36A C28 -15(3) . 4_565
C29 N13A C36A C28 27(9) 4_565 4_565
Cu5 N13A C36A C28 175(3) . 4_565
N12 N13A C36A C36 -180(9) 4_565 4_565
C28 N13A C36A C36 -172(4) 4_565 4_565
C39A N13A C36A C36 173(3) . 4_565
C29 N13A C36A C36 -145(11) 4_565 4_565
Cu5 N13A C36A C36 3(3) . 4_565
N12 N13A C36A C37A 6(9) 4_565 .
C28 N13A C36A C37A 14(2) 4_565 .
C39A N13A C36A C37A -0.6(18) . .
C29 N13A C36A C37A 41(9) 4_565 .
Cu5 N13A C36A C37A -171(2) . .
N12 N13A C36A C29A -174(9) 4_565 .
C28 N13A C36A C29A -166(3) 4_565 .
C39A N13A C36A C29A 179(2) . .
C29 N13A C36A C29A -139(10) 4_565 .
Cu5 N13A C36A C29A 9(3) . .
N12 N13A C36A C30 -1(10) 4_565 4_565
C28 N13A C36A C30 6(4) 4_565 4_565
C39A N13A C36A C30 -8(4) . 4_565
C29 N13A C36A C30 34(8) 4_565 4_565
Cu5 N13A C36A C30 -179(3) . 4_565
C36 C29A C36A C29 -179(13) 4_565 4_565
C37 C29A C36A C29 75(8) 4_565 4_565
C28A C29A C36A C29 -165(7) . 4_565
C30A C29A C36A C29 29(6) . 4_565
N13 C29A C36A C29 -165(7) 4_565 4_565
C36 C29A C36A C28 -71(14) 4_565 4_565
C37 C29A C36A C28 -177(9) 4_565 4_565
C28A C29A C36A C28 -58(10) . 4_565
C30A C29A C36A C28 136(9) . 4_565
C29 C29A C36A C28 107(12) 4_565 4_565
N13 C29A C36A C28 -58(10) 4_565 4_565
C37 C29A C36A C36 -106(15) 4_565 4_565
C28A C29A C36A C36 13(8) . 4_565
C30A C29A C36A C36 -152(11) . 4_565
C29 C29A C36A C36 179(13) 4_565 4_565
N13 C29A C36A C36 14(8) 4_565 4_565
C36 C29A C36A N13A -24(10) 4_565 .
C37 C29A C36A N13A -129(7) 4_565 .
C28A C29A C36A N13A -10(4) . .
C30A C29A C36A N13A -176(2) . .
C29 C29A C36A N13A 155(7) 4_565 .
N13 C29A C36A N13A -10(3) 4_565 .
C36 C29A C36A C37A 156(9) 4_565 .
C37 C29A C36A C37A 50(8) 4_565 .
C28A C29A C36A C37A 170(3) . .
C30A C29A C36A C37A 4(3) . .
C29 C29A C36A C37A -25(6) 4_565 .
N13 C29A C36A C37A 170(2) 4_565 .
C36 C29A C36A C30 160(10) 4_565 4_565
C37 C29A C36A C30 55(7) 4_565 4_565
C28A C29A C36A C30 174(3) . 4_565
C30A C29A C36A C30 8(2) . 4_565
C29 C29A C36A C30 -21(5) 4_565 4_565
N13 C29A C36A C30 174(2) 4_565 4_565
N12A N13 C36 C29A -14(14) 4_565 4_565
C28A N13 C36 C29A -20(12) 4_565 4_565
C39 N13 C36 C29A -33(12) . 4_565
Cu5 N13 C36 C29A 152(12) . 4_565
N12A N13 C36 C36A -168(7) 4_565 4_565
C28A N13 C36 C36A -175(4) 4_565 4_565
C39 N13 C36 C36A 172(3) . 4_565
C29A N13 C36 C36A -155(14) 4_565 4_565
Cu5 N13 C36 C36A -3(3) . 4_565
N12A N13 C36 C28A 6(6) 4_565 4_565
C39 N13 C36 C28A -13(3) . 4_565
C29A N13 C36 C28A 20(12) 4_565 4_565
Cu5 N13 C36 C28A 172(3) . 4_565
N12A N13 C36 C37 19(6) 4_565 .
C28A N13 C36 C37 13(2) 4_565 .
C39 N13 C36 C37 -0.3(18) . .
C29A N13 C36 C37 33(12) 4_565 .
Cu5 N13 C36 C37 -176(2) . .
N12A N13 C36 C29 -161(6) 4_565 .
C28A N13 C36 C29 -167(3) 4_565 .
C39 N13 C36 C29 179(2) . .
C29A N13 C36 C29 -148(13) 4_565 .
Cu5 N13 C36 C29 4(3) . .
N12A N13 C36 C30A 18(8) 4_565 4_565
C28A N13 C36 C30A 12(4) 4_565 4_565
C39 N13 C36 C30A -1(4) . 4_565
C29A N13 C36 C30A 32(11) 4_565 4_565
Cu5 N13 C36 C30A -177(3) . 4_565
C36A C29 C36 C29A 179(13) 4_565 4_565
C37A C29 C36 C29A 91(9) 4_565 4_565
C28 C29 C36 C29A -167(9) . 4_565
C30 C29 C36 C29A 29(8) . 4_565
N13A C29 C36 C29A -166(9) 4_565 4_565
C37A C29 C36 C36A -88(10) 4_565 4_565
C28 C29 C36 C36A 14(5) . 4_565
C30 C29 C36 C36A -149(8) . 4_565
C29A C29 C36 C36A -179(13) 4_565 4_565
N13A C29 C36 C36A 16(5) 4_565 4_565
C36A C29 C36 C28A -60(11) 4_565 4_565
C37A C29 C36 C28A -148(8) 4_565 4_565
C28 C29 C36 C28A -46(10) . 4_565
C30 C29 C36 C28A 151(9) . 4_565
C29A C29 C36 C28A 121(14) 4_565 4_565
N13A C29 C36 C28A -44(9) 4_565 4_565
C36A C29 C36 N13 -22(7) 4_565 .
C37A C29 C36 N13 -110(5) 4_565 .
C28 C29 C36 N13 -8(4) . .
C30 C29 C36 N13 -171(3) . .
C29A C29 C36 N13 159(9) 4_565 .
N13A C29 C36 N13 -6(2) 4_565 .
C36A C29 C36 C37 158(6) 4_565 .
C37A C29 C36 C37 70(6) 4_565 .
C28 C29 C36 C37 172(3) . .
C30 C29 C36 C37 8(3) . .
C29A C29 C36 C37 -21(8) 4_565 .
N13A C29 C36 C37 173(2) 4_565 .
C36A C29 C36 C30A 158(7) 4_565 4_565
C37A C29 C36 C30A 71(5) 4_565 4_565
C28 C29 C36 C30A 172(3) . 4_565
C30 C29 C36 C30A 9(2) . 4_565
C29A C29 C36 C30A -20(8) 4_565 4_565
N13A C29 C36 C30A 174(2) 4_565 4_565
C28 C36A C37A C29 -133(8) 4_565 4_565
C36 C36A C37A C29 44(6) 4_565 4_565
N13A C36A C37A C29 -144(8) . 4_565
C29A C36A C37A C29 36(7) . 4_565
C30 C36A C37A C29 30(6) 4_565 4_565
C29 C36A C37A C30 -30(7) 4_565 4_565
C28 C36A C37A C30 -163(3) 4_565 4_565
C36 C36A C37A C30 15(4) 4_565 4_565
N13A C36A C37A C30 -174(3) . 4_565
C29A C36A C37A C30 6(3) . 4_565
C29 C36A C37A C38A 145(8) 4_565 .
C28 C36A C37A C38A 12(2) 4_565 .
C36 C36A C37A C38A -171(4) 4_565 .
N13A C36A C37A C38A 0.4(19) . .
C29A C36A C37A C38A -179(3) . .
C30 C36A C37A C38A 174(3) 4_565 .
C29 C36A C37A C28 133(8) 4_565 4_565
C36 C36A C37A C28 177(4) 4_565 4_565
N13A C36A C37A C28 -11(2) . 4_565
C29A C36A C37A C28 169(3) . 4_565
C30 C36A C37A C28 163(3) 4_565 4_565
C29 C36A C37A C27 130(8) 4_565 4_565
C28 C36A C37A C27 -3(2) 4_565 4_565
C36 C36A C37A C27 175(4) 4_565 4_565
N13A C36A C37A C27 -13.8(19) . 4_565
C29A C36A C37A C27 166(2) . 4_565
C30 C36A C37A C27 160(3) 4_565 4_565
C36A C36 C37 C29A 46(9) 4_565 4_565
C28A C36 C37 C29A -136(12) 4_565 4_565
N13 C36 C37 C29A -146(11) . 4_565
C29 C36 C37 C29A 34(10) . 4_565
C30A C36 C37 C29A 33(10) 4_565 4_565
C29A C36 C37 C30A -33(10) 4_565 4_565
C36A C36 C37 C30A 13(4) 4_565 4_565
C28A C36 C37 C30A -169(3) 4_565 4_565
N13 C36 C37 C30A -179(3) . 4_565
C29 C36 C37 C30A 1(3) . 4_565
C29A C36 C37 C38 147(11) 4_565 .
C36A C36 C37 C38 -166(4) 4_565 .
C28A C36 C37 C38 11(2) 4_565 .
N13 C36 C37 C38 1.0(19) . .
C29 C36 C37 C38 -179(3) . .
C30A C36 C37 C38 -180(3) 4_565 .
C29A C36 C37 C28A 136(12) 4_565 4_565
C36A C36 C37 C28A -177(5) 4_565 4_565
N13 C36 C37 C28A -10.1(19) . 4_565
C29 C36 C37 C28A 170(3) . 4_565
C30A C36 C37 C28A 169(3) 4_565 4_565
C29A C36 C37 C27A 133(11) 4_565 4_565
C36A C36 C37 C27A 180(4) 4_565 4_565
C28A C36 C37 C27A -3(2) 4_565 4_565
N13 C36 C37 C27A -12.8(19) . 4_565
C29 C36 C37 C27A 167(2) . 4_565
C30A C36 C37 C27A 166(3) 4_565 4_565
C29A C36 C37 C35A 7(10) 4_565 4_565
C36A C36 C37 C35A 53(4) 4_565 4_565
C28A C36 C37 C35A -130(3) 4_565 4_565
N13 C36 C37 C35A -140(2) . 4_565
C29 C36 C37 C35A 41(3) . 4_565
C30A C36 C37 C35A 39.5(14) 4_565 4_565
C29A C37 C38 C27A -70(6) 4_565 4_565
C30A C37 C38 C27A 104(11) 4_565 4_565
C36 C37 C38 C27A -77(4) . 4_565
C28A C37 C38 C27A -65(4) 4_565 4_565
C35A C37 C38 C27A 60(4) 4_565 4_565
C29A C37 C38 C28A -4(4) 4_565 4_565
C30A C37 C38 C28A 170(11) 4_565 4_565
C36 C37 C38 C28A -11(2) . 4_565
C27A C37 C38 C28A 65(4) 4_565 4_565
C35A C37 C38 C28A 125(3) 4_565 4_565
C29A C37 C38 C39 6(5) 4_565 .
C30A C37 C38 C39 180(100) 4_565 .
C36 C37 C38 C39 -1(3) . .
C28A C37 C38 C39 10(2) 4_565 .
C27A C37 C38 C39 76(4) 4_565 .
C35A C37 C38 C39 135(2) 4_565 .
C29A C37 C38 C26A -26(8) 4_565 4_565
C30A C37 C38 C26A 147(9) 4_565 4_565
C36 C37 C38 C26A -34(6) . 4_565
C28A C37 C38 C26A -22(5) 4_565 4_565
C27A C37 C38 C26A 43(5) 4_565 4_565
C35A C37 C38 C26A 103(5) 4_565 4_565
C29 C37A C38A C27 -63(6) 4_565 4_565
C30 C37A C38A C27 88(8) 4_565 4_565
C36A C37A C38A C27 -76(4) . 4_565
C28 C37A C38A C27 -65(4) 4_565 4_565
C29 C37A C38A C28 1(4) 4_565 4_565
C30 C37A C38A C28 152(8) 4_565 4_565
C36A C37A C38A C28 -11(2) . 4_565
C27 C37A C38A C28 65(4) 4_565 4_565
C29 C37A C38A C39A 13(5) 4_565 .
C30 C37A C38A C39A 164(7) 4_565 .
C36A C37A C38A C39A 0(3) . .
C28 C37A C38A C39A 11(2) 4_565 .
C27 C37A C38A C39A 76(4) 4_565 .
C29 C37A C38A C26 -12(8) 4_565 4_565
C30 C37A C38A C26 139(7) 4_565 4_565
C36A C37A C38A C26 -25(7) . 4_565
C28 C37A C38A C26 -13(6) 4_565 4_565
C27 C37A C38A C26 51(5) 4_565 4_565
C28 N13A C39A N12 159(6) 4_565 4_565
C36A N13A C39A N12 176(4) . 4_565
C29 N13A C39A N12 169(5) 4_565 4_565
Cu5 N13A C39A N12 -13(3) . 4_565
N12 N13A C39A C28 -159(6) 4_565 4_565
C36A N13A C39A C28 17(3) . 4_565
C29 N13A C39A C28 10(3) 4_565 4_565
Cu5 N13A C39A C28 -172(4) . 4_565
N12 N13A C39A C25 -1(3) 4_565 4_565
C28 N13A C39A C25 158(5) 4_565 4_565
C36A N13A C39A C25 175(3) . 4_565
C29 N13A C39A C25 168(3) 4_565 4_565
Cu5 N13A C39A C25 -14(4) . 4_565
N12 N13A C39A C27 -154(5) 4_565 4_565
C28 N13A C39A C27 5(3) 4_565 4_565
C36A N13A C39A C27 22(3) . 4_565
C29 N13A C39A C27 16(3) 4_565 4_565
Cu5 N13A C39A C27 -167(2) . 4_565
N12 N13A C39A C40A 0(5) 4_565 .
C28 N13A C39A C40A 159(5) 4_565 .
C36A N13A C39A C40A 176(3) . .
C29 N13A C39A C40A 169(4) 4_565 .
Cu5 N13A C39A C40A -13(5) . .
N12 N13A C39A C26 -61(9) 4_565 4_565
C28 N13A C39A C26 98(9) 4_565 4_565
C36A N13A C39A C26 115(8) . 4_565
C29 N13A C39A C26 108(8) 4_565 4_565
Cu5 N13A C39A C26 -74(9) . 4_565
N12 N13A C39A C38A -175(5) 4_565 .
C28 N13A C39A C38A -17(3) 4_565 .
C36A N13A C39A C38A 1(3) . .
C29 N13A C39A C38A -6(3) 4_565 .
Cu5 N13A C39A C38A 171(2) . .
C27 C38A C39A N12 118(7) 4_565 4_565
C28 C38A C39A N12 9(6) 4_565 4_565
C37A C38A C39A N12 -5(7) . 4_565
C26 C38A C39A N12 162(7) 4_565 4_565
C27 C38A C39A C28 108(6) 4_565 4_565
C37A C38A C39A C28 -14(3) . 4_565
C26 C38A C39A C28 153(4) 4_565 4_565
C27 C38A C39A C25 -50(7) 4_565 4_565
C28 C38A C39A C25 -158(6) 4_565 4_565
C37A C38A C39A C25 -172(4) . 4_565
C26 C38A C39A C25 -5(4) 4_565 4_565
C28 C38A C39A C27 -108(6) 4_565 4_565
C37A C38A C39A C27 -123(6) . 4_565
C26 C38A C39A C27 44(4) 4_565 4_565
C27 C38A C39A C40A -53(6) 4_565 .
C28 C38A C39A C40A -162(5) 4_565 .
C37A C38A C39A C40A -176(3) . .
C26 C38A C39A C40A -9(4) 4_565 .
C27 C38A C39A N13A 122(5) 4_565 .
C28 C38A C39A N13A 14(3) 4_565 .
C37A C38A C39A N13A 0(3) . .
C26 C38A C39A N13A 167(3) 4_565 .
C27 C38A C39A C26 -44(4) 4_565 4_565
C28 C38A C39A C26 -153(4) 4_565 4_565
C37A C38A C39A C26 -167(3) . 4_565
N12A N13 C39 C28A -151(5) 4_565 4_565
C36 N13 C39 C28A 17(3) . 4_565
C29A N13 C39 C28A 13(3) 4_565 4_565
Cu5 N13 C39 C28A -167(4) . 4_565
C28A N13 C39 N12A 151(5) 4_565 4_565
C36 N13 C39 N12A 168(4) . 4_565
C29A N13 C39 N12A 164(4) 4_565 4_565
Cu5 N13 C39 N12A -16(3) . 4_565
N12A N13 C39 C27A -146(5) 4_565 4_565
C28A N13 C39 C27A 5(3) 4_565 4_565
C36 N13 C39 C27A 22(4) . 4_565
C29A N13 C39 C27A 18(4) 4_565 4_565
Cu5 N13 C39 C27A -162(3) . 4_565
N12A N13 C39 C40 16(4) 4_565 .
C28A N13 C39 C40 167(5) 4_565 .
C36 N13 C39 C40 -176(3) . .
C29A N13 C39 C40 180(3) 4_565 .
Cu5 N13 C39 C40 0(4) . .
N12A N13 C39 C25A 1(3) 4_565 4_565
C28A N13 C39 C25A 152(5) 4_565 4_565
C36 N13 C39 C25A 169(3) . 4_565
C29A N13 C39 C25A 164(3) 4_565 4_565
Cu5 N13 C39 C25A -15(3) . 4_565
N12A N13 C39 C38 -169(4) 4_565 .
C28A N13 C39 C38 -18(3) 4_565 .
C36 N13 C39 C38 -1(3) . .
C29A N13 C39 C38 -5(3) 4_565 .
Cu5 N13 C39 C38 175(2) . .
N12A N13 C39 C26A -49(7) 4_565 4_565
C28A N13 C39 C26A 102(8) 4_565 4_565
C36 N13 C39 C26A 119(7) . 4_565
C29A N13 C39 C26A 115(7) 4_565 4_565
Cu5 N13 C39 C26A -65(8) . 4_565
C27A C38 C39 C28A 115(6) 4_565 4_565
C37 C38 C39 C28A -14(3) . 4_565
C26A C38 C39 C28A 150(4) 4_565 4_565
C27A C38 C39 N12A 115(8) 4_565 4_565
C28A C38 C39 N12A 0(6) 4_565 4_565
C37 C38 C39 N12A -14(8) . 4_565
C26A C38 C39 N12A 150(8) 4_565 4_565
C28A C38 C39 C27A -115(6) 4_565 4_565
C37 C38 C39 C27A -129(6) . 4_565
C26A C38 C39 C27A 35(4) 4_565 4_565
C27A C38 C39 C40 -55(6) 4_565 .
C28A C38 C39 C40 -170(5) 4_565 .
C37 C38 C39 C40 176(3) . .
C26A C38 C39 C40 -20(3) 4_565 .
C27A C38 C39 C25A -35(7) 4_565 4_565
C28A C38 C39 C25A -150(6) 4_565 4_565
C37 C38 C39 C25A -164(4) . 4_565
C26A C38 C39 C25A -1(3) 4_565 4_565
C27A C38 C39 N13 130(5) 4_565 .
C28A C38 C39 N13 15(3) 4_565 .
C37 C38 C39 N13 1(4) . .
C26A C38 C39 N13 165(3) 4_565 .
C27A C38 C39 C26A -35(4) 4_565 4_565
C28A C38 C39 C26A -150(4) 4_565 4_565
C37 C38 C39 C26A -164(3) . 4_565
N12 C39A C40A C25 -3(9) 4_565 4_565
C28 C39A C40A C25 64(14) 4_565 4_565
C27 C39A C40A C25 153(10) 4_565 4_565
N13A C39A C40A C25 -3(11) . 4_565
C26 C39A C40A C25 160(13) 4_565 4_565
C38A C39A C40A C25 172(10) . 4_565
N12 C39A C40A C26 -163(4) 4_565 4_565
C28 C39A C40A C26 -95(9) 4_565 4_565
C25 C39A C40A C26 -160(13) 4_565 4_565
C27 C39A C40A C26 -7(4) 4_565 4_565
N13A C39A C40A C26 -163(4) . 4_565
C38A C39A C40A C26 12(5) . 4_565
N12 C39A C40A C25 9(5) 4_565 .
C28 C39A C40A C25 76(11) 4_565 .
C25 C39A C40A C25 12(6) 4_565 .
C27 C39A C40A C25 165(4) 4_565 .
N13A C39A C40A C25 9(7) . .
C26 C39A C40A C25 172(7) 4_565 .
C38A C39A C40A C25 -176(4) . .
N12 C39A C40A C40A 14(4) 4_565 4_565
C28 C39A C40A C40A 82(10) 4_565 4_565
C25 C39A C40A C40A 18(8) 4_565 4_565
C27 C39A C40A C40A 171(2) 4_565 4_565
N13A C39A C40A C40A 14(5) . 4_565
C26 C39A C40A C40A 177(5) 4_565 4_565
C38A C39A C40A C40A -171(2) . 4_565
N12 C39A C40A C42A -171(4) 4_565 .
C28 C39A C40A C42A -104(8) 4_565 .
C25 C39A C40A C42A -168(13) 4_565 .
C27 C39A C40A C42A -15(5) 4_565 .
N13A C39A C40A C42A -171(3) . .
C26 C39A C40A C42A -8(2) 4_565 .
C38A C39A C40A C42A 4(6) . .
C28 C39A C40A N12 67(8) 4_565 4_565
C25 C39A C40A N12 3(9) 4_565 4_565
C27 C39A C40A N12 156(4) 4_565 4_565
N13A C39A C40A N12 0(3) . 4_565
C26 C39A C40A N12 163(4) 4_565 4_565
C38A C39A C40A N12 175(5) . 4_565
C40A C25 C40A C25 180.00(3) 4_565 4_565
C39A C25 C40A C25 64(23) 4_565 4_565
C26 C25 C40A C25 -170(7) . 4_565
N12 C25 C40A C25 12(13) . 4_565
C42A C25 C40A C25 -171(9) 4_565 4_565
C40A C25 C40A C26 -46(30) 4_565 4_565
C25 C25 C40A C26 134(30) 4_565 4_565
C39A C25 C40A C26 -162(13) 4_565 4_565
C26 C25 C40A C26 -36(23) . 4_565
N12 C25 C40A C26 146(19) . 4_565
C42A C25 C40A C26 -37(22) 4_565 4_565
C40A C25 C40A C39A 167(6) 4_565 .
C25 C25 C40A C39A -13(6) 4_565 .
C39A C25 C40A C39A 51(17) 4_565 .
C26 C25 C40A C39A 177(3) . .
N12 C25 C40A C39A -1(7) . .
C42A C25 C40A C39A 176(4) 4_565 .
C25 C25 C40A C40A 180.00(4) 4_565 4_565
C39A C25 C40A C40A -116(23) 4_565 4_565
C26 C25 C40A C40A 10(7) . 4_565
N12 C25 C40A C40A -168(13) . 4_565
C42A C25 C40A C40A 9(9) 4_565 4_565
C40A C25 C40A C42A -13(13) 4_565 .
C25 C25 C40A C42A 167(13) 4_565 .
C39A C25 C40A C42A -129(12) 4_565 .
C26 C25 C40A C42A -3(6) . .
N12 C25 C40A C42A 179.1(19) . .
C42A C25 C40A C42A -4(4) 4_565 .
C40A C25 C40A N12 172(8) 4_565 4_565
C25 C25 C40A N12 -8(8) 4_565 4_565
C39A C25 C40A N12 57(16) 4_565 4_565
C26 C25 C40A N12 -178.0(16) . 4_565
N12 C25 C40A N12 4(5) . 4_565
C42A C25 C40A N12 -178.7(16) 4_565 4_565
C28A C39 C40 C25A 6(20) 4_565 4_565
N12A C39 C40 C25A -40(6) 4_565 4_565
C27A C39 C40 C25A 113(7) 4_565 4_565
N13 C39 C40 C25A -51(8) . 4_565
C38 C39 C40 C25A 135(7) . 4_565
C26A C39 C40 C25A 109(8) 4_565 4_565
C28A C39 C40 C26A -103(17) 4_565 4_565
N12A C39 C40 C26A -149(3) 4_565 4_565
C27A C39 C40 C26A 4(3) 4_565 4_565
C25A C39 C40 C26A -109(8) 4_565 4_565
N13 C39 C40 C26A -160(3) . 4_565
C38 C39 C40 C26A 26(4) . 4_565
C28A C39 C40 C25A 36(19) 4_565 .
N12A C39 C40 C25A -10(5) 4_565 .
C27A C39 C40 C25A 143(4) 4_565 .
C25A C39 C40 C25A 30(4) 4_565 .
N13 C39 C40 C25A -21(6) . .
C38 C39 C40 C25A 165(4) . .
C26A C39 C40 C25A 139(6) 4_565 .
C28A C39 C40 C40 53(19) 4_565 4_565
N12A C39 C40 C40 8(4) 4_565 4_565
C27A C39 C40 C40 161(2) 4_565 4_565
C25A C39 C40 C40 48(6) 4_565 4_565
N13 C39 C40 C40 -3(5) . 4_565
C38 C39 C40 C40 -177(2) . 4_565
C26A C39 C40 C40 157(4) 4_565 4_565
C28A C39 C40 C42 -116(16) 4_565 .
N12A C39 C40 C42 -162(3) 4_565 .
C27A C39 C40 C42 -8(4) 4_565 .
C25A C39 C40 C42 -122(8) 4_565 .
N13 C39 C40 C42 -172(2) . .
C38 C39 C40 C42 13(5) . .
C26A C39 C40 C42 -13(2) 4_565 .
C28A C39 C40 N12A 46(16) 4_565 4_565
C27A C39 C40 N12A 153(4) 4_565 4_565
C25A C39 C40 N12A 40(6) 4_565 4_565
N13 C39 C40 N12A -11(3) . 4_565
C38 C39 C40 N12A 175(5) . 4_565
C26A C39 C40 N12A 149(3) 4_565 4_565
C40 C25A C40 C25A 179.999(19) 4_565 4_565
C39 C25A C40 C25A 113(8) 4_565 4_565
C26A C25A C40 C25A -136(5) . 4_565
N12A C25A C40 C25A 65(8) . 4_565
C42 C25A C40 C25A -134(6) 4_565 4_565
C40 C25A C40 C26A -108(8) 4_565 4_565
C25A C25A C40 C26A 72(8) 4_565 4_565
C39 C25A C40 C26A -175(3) 4_565 4_565
C26A C25A C40 C26A -64(6) . 4_565
N12A C25A C40 C26A 137(3) . 4_565
C42 C25A C40 C26A -62(5) 4_565 4_565
C40 C25A C40 C39 143(4) 4_565 .
C25A C25A C40 C39 -37(4) 4_565 .
C39 C25A C40 C39 77(7) 4_565 .
C26A C25A C40 C39 -172(3) . .
N12A C25A C40 C39 29(6) . .
C42 C25A C40 C39 -170(4) 4_565 .
C25A C25A C40 C40 180.00(2) 4_565 4_565
C39 C25A C40 C40 -67(8) 4_565 4_565
C26A C25A C40 C40 44(4) . 4_565
N12A C25A C40 C40 -115(8) . 4_565
C42 C25A C40 C40 46(6) 4_565 4_565
C40 C25A C40 C42 -63(8) 4_565 .
C25A C25A C40 C42 117(8) 4_565 .
C39 C25A C40 C42 -130(4) 4_565 .
C26A C25A C40 C42 -19(5) . .
N12A C25A C40 C42 -178.0(18) . .
C42 C25A C40 C42 -17(3) 4_565 .
C40 C25A C40 N12A 137(5) 4_565 4_565
C25A C25A C40 N12A -43(5) 4_565 4_565
C39 C25A C40 N12A 70(6) 4_565 4_565
C26A C25A C40 N12A -178.8(17) . 4_565
N12A C25A C40 N12A 22(3) . 4_565
C42 C25A C40 N12A -176.6(15) 4_565 4_565
C41A N14A C41A N15A -160(2) 4_575 4_575
N15A N14A C41A N15A -146(4) . 4_575
C41A N14A C41A N16A -97(3) 4_575 4_575
N15A N14A C41A N16A 62(4) 4_575 4_575
N15A N14A C41A N16A -83(3) . 4_575
C41A N14A C41A N17A -13(3) 4_575 .
N15A N14A C41A N17A 147(4) 4_575 .
N15A N14A C41A N17A 1(3) . .
C41A N14A C41A C33A 168.1(19) 4_575 .
N15A N14A C41A C33A -32(3) 4_575 .
N15A N14A C41A C33A -178(3) . .
N15A N14A C41A C41A 160(2) 4_575 4_575
N15A N14A C41A C41A 13.8(15) . 4_575
C41A N17A C41A N15A 97(3) 4_575 4_575
N16A N17A C41A N15A 84(3) . 4_575
N16A N17A C41A N15A -65(4) 4_575 4_575
C41A N17A C41A N16A 161(2) 4_575 4_575
N16A N17A C41A N16A 149(4) . 4_575
C41A N17A C41A N14A 13(3) 4_575 .
N16A N17A C41A N14A 0(3) . .
N16A N17A C41A N14A -149(4) 4_575 .
C41A N17A C41A C33A -168(3) 4_575 .
N16A N17A C41A C33A 179(3) . .
N16A N17A C41A C33A 31(3) 4_575 .
N16A N17A C41A C41A -12.7(15) . 4_575
N16A N17A C41A C41A -161(2) 4_575 4_575
C34A C33A C41A N15A -29(4) . 4_575
C32A C33A C41A N15A 159(3) . 4_575
N16A C33A C41A N15A 111(4) 4_575 4_575
N15A C33A C41A N16A -111(4) 4_575 4_575
C34A C33A C41A N16A -140(3) . 4_575
C32A C33A C41A N16A 48(3) . 4_575
N15A C33A C41A N14A 37(3) 4_575 .
C34A C33A C41A N14A 8(5) . .
C32A C33A C41A N14A -164(2) . .
N16A C33A C41A N14A 148(4) 4_575 .
N15A C33A C41A N17A -142(5) 4_575 .
C34A C33A C41A N17A -171(3) . .
C32A C33A C41A N17A 17(5) . .
N16A C33A C41A N17A -31(3) 4_575 .
N15A C33A C41A C41A 95(7) 4_575 4_575
C34A C33A C41A C41A 65(9) . 4_575
C32A C33A C41A C41A -107(7) . 4_575
N16A C33A C41A C41A -155(8) 4_575 4_575
C41 N17 C41 N16 -162(2) 4 4
N16 N17 C41 N16 -149(4) . 4
C41 N17 C41 N15 -100(3) 4 4
N16 N17 C41 N15 61(4) 4 4
N16 N17 C41 N15 -88(3) . 4
C41 N17 C41 N14 -17(4) 4 .
N16 N17 C41 N14 145(5) 4 .
N16 N17 C41 N14 -4(4) . .
C41 N17 C41 C33 167(2) 4 .
N16 N17 C41 C33 -31(3) 4 .
N16 N17 C41 C33 180(3) . .
N16 N17 C41 C41 162(2) 4 4
N16 N17 C41 C41 12.5(17) . 4
C41 N14 C41 N16 102(3) 4 4
N15 N14 C41 N16 -61(4) 4 4
N15 N14 C41 N16 90(3) . 4
C41 N14 C41 N15 162(2) 4 4
N15 N14 C41 N15 150(4) . 4
C41 N14 C41 N17 17(4) 4 .
N15 N14 C41 N17 -146(5) 4 .
N15 N14 C41 N17 5(4) . .
C41 N14 C41 C33 -168(3) 4 .
N15 N14 C41 C33 29(4) 4 .
N15 N14 C41 C33 180(4) . .
N15 N14 C41 C41 -162(2) 4 4
N15 N14 C41 C41 -12.2(18) . 4
C34 C33 C41 N16 159(4) . 4
C32 C33 C41 N16 -24(4) . 4
N15 C33 C41 N16 108(4) 4 4
N16 C33 C41 N15 -108(4) 4 4
C34 C33 C41 N15 51(4) . 4
C32 C33 C41 N15 -132(4) . 4
N16 C33 C41 N17 36(3) 4 .
C34 C33 C41 N17 -164(3) . .
C32 C33 C41 N17 12(5) . .
N15 C33 C41 N17 145(5) 4 .
N16 C33 C41 N14 -138(6) 4 .
C34 C33 C41 N14 21(6) . .
C32 C33 C41 N14 -162(3) . .
N15 C33 C41 N14 -30(3) 4 .
N16 C33 C41 C41 95(7) 4 4
C34 C33 C41 C41 -106(7) . 4
C32 C33 C41 C41 71(9) . 4
N15 C33 C41 C41 -157(9) 4 4
C25 C40A C42A C26 -103(33) 4_565 4_565
C39A C40A C42A C26 10(3) . 4_565
C25 C40A C42A C26 -170(7) . 4_565
C40A C40A C42A C26 -174(3) 4_565 4_565
N12 C40A C42A C26 -3(7) 4_565 4_565
C25 C40A C42A C47A -39(31) 4_565 .
C26 C40A C42A C47A 64(3) 4_565 .
C39A C40A C42A C47A 74(4) . .
C25 C40A C42A C47A -106(4) . .
C40A C40A C42A C47A -109.9(16) 4_565 .
N12 C40A C42A C47A 61(8) 4_565 .
C25 C40A C42A C43A 143(31) 4_565 .
C26 C40A C42A C43A -114(3) 4_565 .
C39A C40A C42A C43A -104(4) . .
C25 C40A C42A C43A 76(4) . .
C40A C40A C42A C43A 72.1(11) 4_565 .
N12 C40A C42A C43A -117(8) 4_565 .
C26 C40A C42A C25 103(33) 4_565 4_565
C39A C40A C42A C25 113(33) . 4_565
C25 C40A C42A C25 -67(28) . 4_565
C40A C40A C42A C25 -71(31) 4_565 4_565
N12 C40A C42A C25 101(37) 4_565 4_565
C25 C40A C42A C42A 71(31) 4_565 4_565
C26 C40A C42A C42A 174(3) 4_565 4_565
C39A C40A C42A C42A -176(4) . 4_565
C25 C40A C42A C42A 4(4) . 4_565
C40A C40A C42A C42A 0.000(10) 4_565 4_565
N12 C40A C42A C42A 171(9) 4_565 4_565
C26 C42A C43A C44A 123(2) 4_565 .
C47A C42A C43A C44A 3.6(17) . .
C40A C42A C43A C44A -178.4(8) . .
C25 C42A C43A C44A -176.5(12) 4_565 .
C42A C42A C43A C44A -107.5(7) 4_565 .
C26 C42A C43A C43A -129(2) 4_565 4_565
C47A C42A C43A C43A 111.1(16) . 4_565
C40A C42A C43A C43A -70.9(9) . 4_565
C25 C42A C43A C43A -69.0(13) 4_565 4_565
C42A C42A C43A C43A 0.000(3) 4_565 4_565
C42A C43A C44A N20 -18(4) . 4_566
C43A C43A C44A N20 -125(5) 4_565 4_566
C42A C43A C44A C45A 2.1(19) . .
C43A C43A C44A C45A -105(2) 4_565 .
C42A C43A C44A C44A 106.9(10) . 4_565
C43A C43A C44A C44A 0.000(6) 4_565 4_565
C43A C44A C45A N20 -144(8) . 4_566
C44A C44A C45A N20 128(8) 4_565 4_566
N20 C44A C45A N19 82(11) 4_566 4_566
C43A C44A C45A N19 -62(6) . 4_566
C44A C44A C45A N19 -150(5) 4_565 4_566
N20 C44A C45A C46A 140(10) 4_566 .
C43A C44A C45A C46A -4(4) . .
C44A C44A C45A C46A -92(3) 4_565 .
N20 C44A C45A C48A -30(7) 4_566 .
C43A C44A C45A C48A -174(2) . .
C44A C44A C45A C48A 98(3) 4_565 .
N20 C44A C45A N21 -45(7) 4_566 4_566
C43A C44A C45A N21 171.6(18) . 4_566
C44A C44A C45A N21 83(2) 4_565 4_566
N20 C44A C45A N18 -29(9) 4_566 4_566
C43A C44A C45A N18 -173(8) . 4_566
C44A C44A C45A N18 98(9) 4_565 4_566
N20 C45A C46A N19 -94(11) 4_566 4_566
C44A C45A C46A N19 -140(6) . 4_566
C48A C45A C46A N19 29(5) . 4_566
N21 C45A C46A N19 54(9) 4_566 4_566
N18 C45A C46A N19 36(4) 4_566 4_566
N20 C45A C46A C47A 45(11) 4_566 .
N19 C45A C46A C47A 140(5) 4_566 .
C44A C45A C46A C47A -1(5) . .
C48A C45A C46A C47A 169(3) . .
N21 C45A C46A C47A -166(8) 4_566 .
N18 C45A C46A C47A 176(3) 4_566 .
N19 C45A C46A N20 94(11) 4_566 4_566
C44A C45A C46A N20 -46(8) . 4_566
C48A C45A C46A N20 124(12) . 4_566
N21 C45A C46A N20 148(18) 4_566 4_566
N18 C45A C46A N20 130(11) 4_566 4_566
N19 C46A C47A C42A 59(7) 4_566 .
C45A C46A C47A C42A 6(5) . .
N20 C46A C47A C42A 15(4) 4_566 .
N19 C46A C47A C26 18(9) 4_566 4_565
C45A C46A C47A C26 -35(6) . 4_565
N20 C46A C47A C26 -26(6) 4_566 4_565
C26 C42A C47A C46A -144(3) 4_565 .
C43A C42A C47A C46A -8(4) . .
C40A C42A C47A C46A 174(2) . .
C25 C42A C47A C46A 172(2) 4_565 .
C42A C42A C47A C46A 85(3) 4_565 .
C43A C42A C47A C26 136(2) . 4_565
C40A C42A C47A C26 -41.8(19) . 4_565
C25 C42A C47A C26 -43.6(14) 4_565 4_565
C42A C42A C47A C26 -131.5(18) 4_565 4_565
N18 N18A C48A C48 -137(8) 4_566 4_566
N19A N18A C48A C48 40(5) . 4_566
C45 N18A C48A C48 15(5) 4_566 4_566
N18 N18A C48A N21 -136(9) 4_566 4_566
C48 N18A C48A N21 1(7) 4_566 4_566
N19A N18A C48A N21 41(8) . 4_566
C45 N18A C48A N21 17(7) 4_566 4_566
C48 N18A C48A N18 137(8) 4_566 4_566
N19A N18A C48A N18 177(7) . 4_566
C45 N18A C48A N18 152(6) 4_566 4_566
N18 N18A C48A N21A -175(6) 4_566 .
C48 N18A C48A N21A -38(5) 4_566 .
N19A N18A C48A N21A 2(4) . .
C45 N18A C48A N21A -23(3) 4_566 .
N18 N18A C48A C45A -6(6) 4_566 .
C48 N18A C48A C45A 131(6) 4_566 .
N19A N18A C48A C45A 171(3) . .
C45 N18A C48A C45A 146(4) 4_566 .
N18 N18A C48A N20 7(8) 4_566 4_566
C48 N18A C48A N20 143(10) 4_566 4_566
N19A N18A C48A N20 -177(6) . 4_566
C45 N18A C48A N20 159(7) 4_566 4_566
N18 N18A C48A N19 15(5) 4_566 4_566
C48 N18A C48A N19 152(6) 4_566 4_566
N19A N18A C48A N19 -168(3) . 4_566
C45 N18A C48A N19 167(3) 4_566 4_566
N21 N21A C48A C48 117(6) 4_566 4_566
N20A N21A C48A C48 -32(5) . 4_566
C45 N21A C48A C48 -13(4) 4_566 4_566
C48 N21A C48A N21 -117(6) 4_566 4_566
N20A N21A C48A N21 -149(5) . 4_566
C45 N21A C48A N21 -129(4) 4_566 4_566
N21 N21A C48A N18 146(9) 4_566 4_566
C48 N21A C48A N18 30(6) 4_566 4_566
N20A N21A C48A N18 -2(9) . 4_566
C45 N21A C48A N18 17(7) 4_566 4_566
N21 N21A C48A N18A 151(5) 4_566 .
C48 N21A C48A N18A 35(4) 4_566 .
N20A N21A C48A N18A 3(4) . .
C45 N21A C48A N18A 22(3) 4_566 .
N21 N21A C48A C45A -18(5) 4_566 .
C48 N21A C48A C45A -135(6) 4_566 .
N20A N21A C48A C45A -167(3) . .
C45 N21A C48A C45A -148(4) 4_566 .
N21 N21A C48A N20 -30(4) 4_566 4_566
C48 N21A C48A N20 -146(6) 4_566 4_566
N20A N21A C48A N20 -179(3) . 4_566
C45 N21A C48A N20 -159(3) 4_566 4_566
N21 N21A C48A N19 -53(8) 4_566 4_566
C48 N21A C48A N19 -170(10) 4_566 4_566
N20A N21A C48A N19 158(7) . 4_566
C45 N21A C48A N19 177(8) 4_566 4_566
N20 C45A C48A C48 -120(8) 4_566 4_566
N19 C45A C48A C48 113(6) 4_566 4_566
C46A C45A C48A C48 90(7) . 4_566
C44A C45A C48A C48 -100(6) . 4_566
N21 C45A C48A C48 -77(6) 4_566 4_566
N18 C45A C48A C48 80(5) 4_566 4_566
N20 C45A C48A N21 -43(6) 4_566 4_566
N19 C45A C48A N21 -170(5) 4_566 4_566
C46A C45A C48A N21 168(4) . 4_566
C44A C45A C48A N21 -23(4) . 4_566
N18 C45A C48A N21 158(5) 4_566 4_566
N20 C45A C48A N18 160(7) 4_566 4_566
N19 C45A C48A N18 33(4) 4_566 4_566
C46A C45A C48A N18 10(5) . 4_566
C44A C45A C48A N18 180(4) . 4_566
N21 C45A C48A N18 -158(5) 4_566 4_566
N20 C45A C48A N18A 163(7) 4_566 .
N19 C45A C48A N18A 36(5) 4_566 .
C46A C45A C48A N18A 13(6) . .
C44A C45A C48A N18A -177(3) . .
N21 C45A C48A N18A -154(6) 4_566 .
N18 C45A C48A N18A 3(4) 4_566 .
N20 C45A C48A N21A -29(8) 4_566 .
N19 C45A C48A N21A -156(5) 4_566 .
C46A C45A C48A N21A -179(4) . .
C44A C45A C48A N21A -9(5) . .
N21 C45A C48A N21A 14(4) 4_566 .
N18 C45A C48A N21A 171(6) 4_566 .
N19 C45A C48A N20 -127(8) 4_566 4_566
C46A C45A C48A N20 -150(9) . 4_566
C44A C45A C48A N20 20(5) . 4_566
N21 C45A C48A N20 43(6) 4_566 4_566
N18 C45A C48A N20 -160(7) 4_566 4_566
N20 C45A C48A N19 127(8) 4_566 4_566
C46A C45A C48A N19 -23(4) . 4_566
C44A C45A C48A N19 147(6) . 4_566
N21 C45A C48A N19 170(5) 4_566 4_566
N18 C45A C48A N19 -33(4) 4_566 4_566
C25A C40 C42 C26A -80(6) 4_565 4_565
C39 C40 C42 C26A 16(3) . 4_565
C25A C40 C42 C26A -141(5) . 4_565
C40 C40 C42 C26A -157(3) 4_565 4_565
N12A C40 C42 C26A -8(4) 4_565 4_565
C25A C40 C42 C43 -39(5) 4_565 .
C26A C40 C42 C43 41(3) 4_565 .
C39 C40 C42 C43 57(3) . .
C25A C40 C42 C43 -100(3) . .
C40 C40 C42 C43 -116.2(13) 4_565 .
N12A C40 C42 C43 32(4) 4_565 .
C25A C40 C42 C47 142(6) 4_565 .
C26A C40 C42 C47 -138(3) 4_565 .
C39 C40 C42 C47 -121(3) . .
C25A C40 C42 C47 81(3) . .
C40 C40 C42 C47 65.0(16) 4_565 .
N12A C40 C42 C47 -146(5) 4_565 .
C26A C40 C42 C25A 80(6) 4_565 4_565
C39 C40 C42 C25A 97(7) . 4_565
C25A C40 C42 C25A -61(4) . 4_565
C40 C40 C42 C25A -77(5) 4_565 4_565
N12A C40 C42 C25A 72(8) 4_565 4_565
C25A C40 C42 C42 77(5) 4_565 4_565
C26A C40 C42 C42 157(3) 4_565 4_565
C39 C40 C42 C42 174(3) . 4_565
C25A C40 C42 C42 16(2) . 4_565
C40 C40 C42 C42 0.000(8) 4_565 4_565
N12A C40 C42 C42 149(5) 4_565 4_565
C26A C42 C43 C44 -152(3) 4_565 .
C47 C42 C43 C44 -3(3) . .
C40 C42 C43 C44 178(2) . .
C25A C42 C43 C44 170(2) 4_565 .
C42 C42 C43 C44 81(2) 4_565 .
C47 C42 C43 C26A 149(3) . 4_565
C40 C42 C43 C26A -29.6(18) . 4_565
C25A C42 C43 C26A -37.7(14) 4_565 4_565
C42 C42 C43 C26A -126.3(18) 4_565 4_565
C26A C42 C47 C47 -123(3) 4_565 4_565
C43 C42 C47 C47 111.5(14) . 4_565
C40 C42 C47 C47 -69.7(10) . 4_565
C25A C42 C47 C47 -61.3(17) 4_565 4_565
C42 C42 C47 C47 0.000(6) 4_565 4_565
C26A C42 C47 C46 130(4) 4_565 .
C43 C42 C47 C46 4(4) . .
C40 C42 C47 C46 -177(2) . .
C25A C42 C47 C46 -169(2) 4_565 .
C42 C42 C47 C46 -108(3) 4_565 .
C26A C42 C47 C46 -172(3) 4_565 4_565
C43 C42 C47 C46 63(2) . 4_565
C40 C42 C47 C46 -118.4(17) . 4_565
C25A C42 C47 C46 -110(2) 4_565 4_565
C42 C42 C47 C46 -48.7(17) 4_565 4_565
C42 C43 C44 N19A 58(5) . 4_564
C26A C43 C44 N19A 15(8) 4_565 4_564
C42 C43 C44 C45 7(4) . .
C26A C43 C44 C45 -36(7) 4_565 .
C43 C44 C45 N19A 127(4) . 4_564
N19A C44 C45 N20A -52(4) 4_564 4_564
C43 C44 C45 N20A 74(5) . 4_564
N19A C44 C45 C46 -139(5) 4_564 .
C43 C44 C45 C46 -12(6) . .
N19A C44 C45 C48 56(4) 4_564 .
C43 C44 C45 C48 -177(3) . .
N19A C44 C45 N18A 45(2) 4_564 4_564
C43 C44 C45 N18A 172(3) . 4_564
N19A C44 C45 N21A 18(6) 4_564 4_564
C43 C44 C45 N21A 145(5) . 4_564
C47 C47 C46 N20A -175(3) 4_565 4_564
C42 C47 C46 N20A -61(5) . 4_564
C46 C47 C46 N20A -175(3) 4_565 4_564
C47 C47 C46 C45 -123(3) 4_565 .
C42 C47 C46 C45 -9(5) . .
C46 C47 C46 C45 -123(3) 4_565 .
C47 C47 C46 C46 0.00(2) 4_565 4_565
C42 C47 C46 C46 114(3) . 4_565
C42 C47 C46 C47 114(3) . 4_565
C46 C47 C46 C47 0.00(3) 4_565 4_565
N19A C45 C46 N20A 49(5) 4_564 4_564
C44 C45 C46 N20A 127(5) . 4_564
C48 C45 C46 N20A -67(4) . 4_564
N18A C45 C46 N20A -62(8) 4_564 4_564
N21A C45 C46 N20A -42(2) 4_564 4_564
N19A C45 C46 C47 -65(7) 4_564 .
N20A C45 C46 C47 -115(4) 4_564 .
C44 C45 C46 C47 13(6) . .
C48 C45 C46 C47 179(4) . .
N18A C45 C46 C47 -176(7) 4_564 .
N21A C45 C46 C47 -157(3) 4_564 .
N19A C45 C46 C46 -167(5) 4_564 4_565
N20A C45 C46 C46 144(2) 4_564 4_565
C44 C45 C46 C46 -89(4) . 4_565
C48 C45 C46 C46 77(4) . 4_565
N18A C45 C46 C46 82(8) 4_564 4_565
N21A C45 C46 C46 101.5(16) 4_564 4_565
N19A C45 C46 C47 -109(6) 4_564 4_565
N20A C45 C46 C47 -159(3) 4_564 4_565
C44 C45 C46 C47 -31(6) . 4_565
C48 C45 C46 C47 135(3) . 4_565
N18A C45 C46 C47 140(7) 4_564 4_565
N21A C45 C46 C47 159(3) 4_564 4_565
N21A N21 C48 C48A -115(6) 4_564 4_564
N20 N21 C48 C48A 21(5) . 4_564
C45A N21 C48 C48A 33(4) 4_564 4_564
N21A N21 C48 N18A -116(8) 4_564 4_564
C48A N21 C48 N18A -1(6) 4_564 4_564
N20 N21 C48 N18A 20(9) . 4_564
C45A N21 C48 N18A 32(8) 4_564 4_564
C48A N21 C48 N21A 115(6) 4_564 4_564
N20 N21 C48 N21A 136(5) . 4_564
C45A N21 C48 N21A 148(5) 4_564 4_564
N21A N21 C48 N18 -137(5) 4_564 .
C48A N21 C48 N18 -22(4) 4_564 .
N20 N21 C48 N18 -2(5) . .
C45A N21 C48 N18 10(4) 4_564 .
N21A N21 C48 C45 40(5) 4_564 .
C48A N21 C48 C45 155(8) 4_564 .
N20 N21 C48 C45 176(4) . .
C45A N21 C48 C45 -172(5) 4_564 .
N21A N21 C48 N19A -7(7) 4_564 4_564
C48A N21 C48 N19A 108(9) 4_564 4_564
N20 N21 C48 N19A 129(6) . 4_564
C45A N21 C48 N19A 141(6) 4_564 4_564
N21A N21 C48 N20A 13(4) 4_564 4_564
C48A N21 C48 N20A 128(6) 4_564 4_564
N20 N21 C48 N20A 149(3) . 4_564
C45A N21 C48 N20A 161(3) 4_564 4_564
N18A N18 C48 C48A 137(8) 4_564 4_564
N19 N18 C48 C48A -17(5) . 4_564
C45A N18 C48 C48A -30(4) 4_564 4_564
C48A N18 C48 N18A -137(8) 4_564 4_564
N19 N18 C48 N18A -154(7) . 4_564
C45A N18 C48 N18A -167(6) 4_564 4_564
N18A N18 C48 N21A 113(7) 4_564 4_564
C48A N18 C48 N21A -24(5) 4_564 4_564
N19 N18 C48 N21A -41(7) . 4_564
C45A N18 C48 N21A -54(5) 4_564 4_564
N18A N18 C48 N21 157(6) 4_564 .
C48A N18 C48 N21 21(4) 4_564 .
N19 N18 C48 N21 4(5) . .
C45A N18 C48 N21 -9(4) 4_564 .
N18A N18 C48 C45 -20(6) 4_564 .
C48A N18 C48 C45 -157(7) 4_564 .
N19 N18 C48 C45 -174(4) . .
C45A N18 C48 C45 173(4) 4_564 .
N18A N18 C48 N19A 2(5) 4_564 4_564
C48A N18 C48 N19A -135(6) 4_564 4_564
N19 N18 C48 N19A -152(3) . 4_564
C45A N18 C48 N19A -165(3) 4_564 4_564
N18A N18 C48 N20A 26(7) 4_564 4_564
C48A N18 C48 N20A -111(7) 4_564 4_564
N19 N18 C48 N20A -128(5) . 4_564
C45A N18 C48 N20A -141(5) 4_564 4_564
N19A C45 C48 C48A -51(16) 4_564 4_564
N20A C45 C48 C48A 39(16) 4_564 4_564
C44 C45 C48 C48A -96(16) . 4_564
C46 C45 C48 C48A 97(16) . 4_564
N18A C45 C48 C48A -79(16) 4_564 4_564
N21A C45 C48 C48A 58(15) 4_564 4_564
N19A C45 C48 N18A 28(4) 4_564 4_564
N20A C45 C48 N18A 118(4) 4_564 4_564
C44 C45 C48 N18A -17(5) . 4_564
C46 C45 C48 N18A 177(4) . 4_564
N21A C45 C48 N18A 138(5) 4_564 4_564
N19A C45 C48 N21A -109(4) 4_564 4_564
N20A C45 C48 N21A -20(4) 4_564 4_564
C44 C45 C48 N21A -155(4) . 4_564
C46 C45 C48 N21A 39(5) . 4_564
N18A C45 C48 N21A -138(5) 4_564 4_564
N19A C45 C48 N21 -137(5) 4_564 .
N20A C45 C48 N21 -47(6) 4_564 .
C44 C45 C48 N21 177(4) . .
C46 C45 C48 N21 11(7) . .
N18A C45 C48 N21 -165(7) 4_564 .
N21A C45 C48 N21 -28(4) 4_564 .
N19A C45 C48 N18 40(5) 4_564 .
N20A C45 C48 N18 130(5) 4_564 .
C44 C45 C48 N18 -5(7) . .
C46 C45 C48 N18 -171(4) . .
N18A C45 C48 N18 12(4) 4_564 .
N21A C45 C48 N18 150(6) 4_564 .
N20A C45 C48 N19A 90(4) 4_564 4_564
C44 C45 C48 N19A -46(3) . 4_564
C46 C45 C48 N19A 148(5) . 4_564
N18A C45 C48 N19A -28(4) 4_564 4_564
N21A C45 C48 N19A 109(4) 4_564 4_564
N19A C45 C48 N20A -90(4) 4_564 4_564
C44 C45 C48 N20A -135(5) . 4_564
C46 C45 C48 N20A 59(4) . 4_564
N18A C45 C48 N20A -118(4) 4_564 4_564
N21A C45 C48 N20A 20(4) 4_564 4_564
loop_
_platon_squeeze_void_nr
_platon_squeeze_void_average_x
_platon_squeeze_void_average_y
_platon_squeeze_void_average_z
_platon_squeeze_void_volume
_platon_squeeze_void_count_electrons
_platon_squeeze_void_content
1 -0.013 -0.002 -0.010 1996 634 ' '
