# Electronic Supplementary Material (ESI) for Chemical Science.
# This journal is © The Royal Society of Chemistry 2020

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
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data_xb9571
_database_code_depnum_ccdc_archive 'CCDC 1894830'
loop_
_audit_author_name
_audit_author_address
'Frank Aell'
;North West University
China
;
_audit_update_record             
;
2019-01-31 deposited with the CCDC.	2020-01-30 downloaded from the CCDC.
;
_audit_creation_method           SHELXL-97
_audit_creation_date             2017-01-16
_chemical_formula_sum            'C58 H62 N6 O13 Zn2'
_chemical_formula_weight         1181.880
_refine_ls_R_factor_all          0.218
_cell_length_a                   15.210(5)
_cell_length_b                   16.731(5)
_cell_length_c                   23.716(7)
_cell_angle_alpha                90.000
_cell_angle_beta                 104.529(6)
_cell_angle_gamma                90.000
_cell_volume                     5842.2(30)
_cell_formula_units_Z            4
_symmetry_int_tables_number      14
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_symmetry_space_group_name_Hall  -P_2ybc

loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 x,y,z
2 -x,0.500+y,0.500-z
3 -x,-y,-z
4 x,0.500-y,0.500+z

loop_
_atom_type_symbol
_atom_type_oxidation_number
_atom_type_radius_bond
Zn ? 1.200
C ? 1.200
H ? 1.200
N ? 1.200
O ? 1.200


loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_attached_hydrogens
_atom_site_calc_flag
_atom_site_thermal_displace_type
_atom_site_u_iso_or_equiv
Zn1 Zn 0.2483(1) 0.2294(0) 0.0391(0) 1.000 4 e ? d Uani 0.0629(3)
Zn2 Zn 0.4638(1) 0.2494(0) 0.0871(0) 1.000 4 e ? d Uani 0.0663(3)
C1 C 0.4112(8) 0.4212(6) -0.0469(4) 1.000 4 e ? d Uani 0.114(4)
H1A H 0.4759 0.4281 -0.0380 1.000 4 e ? calc Uiso 0.17100
H1B H 0.3902 0.4316 -0.0127 1.000 4 e ? calc Uiso 0.17100
H1C H 0.3827 0.4576 -0.0772 1.000 4 e ? calc Uiso 0.17100
C2 C 0.3883(7) 0.3398(6) -0.0661(3) 1.000 4 e ? d Uani 0.082(3)
C3 C 0.4488(8) 0.2833(7) -0.0732(4) 1.000 4 e ? d Uani 0.103(3)
H3A H 0.5103 0.2956 -0.0654 1.000 4 e ? calc Uiso 0.15500
H3B H 0.4287 0.2323 -0.0857 1.000 4 e ? calc Uiso 0.15500
C4 C 0.2902(7) 0.3173(6) -0.0823(3) 1.000 4 e ? d Uani 0.076(2)
C5 C 0.1825(6) 0.2023(6) -0.1023(3) 1.000 4 e ? d Uani 0.075(2)
C6 C 0.1482(7) 0.2154(7) -0.1614(4) 1.000 4 e ? d Uani 0.104(3)
H6A H 0.1790 0.2474 -0.1822 1.000 4 e ? calc Uiso 0.12400
C7 C 0.0667(8) 0.1791(8) -0.1887(5) 1.000 4 e ? d Uani 0.133(5)
H7A H 0.0407 0.1890 -0.2280 1.000 4 e ? calc Uiso 0.16000
C8 C 0.0246(9) 0.1299(9) -0.1590(5) 1.000 4 e ? d Uani 0.140(5)
H8A H -0.0286 0.1041 -0.1785 1.000 4 e ? calc Uiso 0.16800
C9 C 0.0592(6) 0.1170(6) -0.0998(4) 1.000 4 e ? d Uani 0.097(3)
H9A H 0.0274 0.0854 -0.0794 1.000 4 e ? calc Uiso 0.11600
C10 C 0.1409(6) 0.1511(5) -0.0711(3) 1.000 4 e ? d Uani 0.075(2)
C11 C 0.1699(5) 0.0727(5) 0.0117(3) 1.000 4 e ? d Uani 0.068(2)
H11A H 0.1428 0.0332 -0.0145 1.000 4 e ? calc Uiso 0.08200
C12 C 0.1961(6) 0.0488(5) 0.0731(4) 1.000 4 e ? d Uani 0.071(2)
C13 C 0.1830(7) -0.0339(5) 0.0885(5) 1.000 4 e ? d Uani 0.093(3)
H13A H 0.1561 -0.0691 0.0589 1.000 4 e ? calc Uiso 0.11100
C14 C 0.2070(8) -0.0611(6) 0.1420(5) 1.000 4 e ? d Uani 0.107(3)
H14A H 0.2003 -0.1151 0.1492 1.000 4 e ? calc Uiso 0.12900
C15 C 0.2421(7) -0.0104(6) 0.1873(4) 1.000 4 e ? d Uani 0.092(3)
H15A H 0.2571 -0.0292 0.2255 1.000 4 e ? calc Uiso 0.11100
C16 C 0.2548(6) 0.0687(5) 0.1759(4) 1.000 4 e ? d Uani 0.074(2)
C17 C 0.2320(5) 0.1014(5) 0.1186(3) 1.000 4 e ? d Uani 0.067(2)
C18 C 0.3126(9) 0.1047(6) 0.2768(4) 1.000 4 e ? d Uani 0.128(4)
H18A H 0.3376 0.1503 0.2999 1.000 4 e ? calc Uiso 0.19200
H18B H 0.3562 0.0620 0.2841 1.000 4 e ? calc Uiso 0.19200
H18C H 0.2583 0.0877 0.2870 1.000 4 e ? calc Uiso 0.19200
C19 C 0.5704(7) 0.4063(7) 0.1709(4) 1.000 4 e ? d Uani 0.123(4)
H19A H 0.5602 0.4586 0.1847 1.000 4 e ? calc Uiso 0.18500
H19B H 0.6151 0.4095 0.1487 1.000 4 e ? calc Uiso 0.18500
H19C H 0.5916 0.3712 0.2035 1.000 4 e ? calc Uiso 0.18500
C20 C 0.4164(6) 0.4266(5) 0.1121(3) 1.000 4 e ? d Uani 0.070(2)
C21 C 0.3371(6) 0.3874(5) 0.0787(3) 1.000 4 e ? d Uani 0.061(2)
C22 C 0.2586(6) 0.4317(4) 0.0583(3) 1.000 4 e ? d Uani 0.062(2)
C23 C 0.2603(7) 0.5116(5) 0.0673(4) 1.000 4 e ? d Uani 0.087(3)
H23A H 0.2075 0.5412 0.0534 1.000 4 e ? calc Uiso 0.10500
C24 C 0.3390(9) 0.5504(5) 0.0969(5) 1.000 4 e ? d Uani 0.099(3)
H24A H 0.3399 0.6058 0.1005 1.000 4 e ? calc Uiso 0.11900
C25 C 0.4146(8) 0.5073(6) 0.1205(4) 1.000 4 e ? d Uani 0.097(3)
H25A H 0.4660 0.5329 0.1427 1.000 4 e ? calc Uiso 0.11700
C26 C 0.1725(6) 0.3975(5) 0.0304(3) 1.000 4 e ? d Uani 0.065(2)
H26A H 0.1241 0.4328 0.0193 1.000 4 e ? calc Uiso 0.07800
C27 C 0.0614(6) 0.3022(5) -0.0065(4) 1.000 4 e ? d Uani 0.075(2)
C28 C 0.0193(7) 0.2459(5) 0.0211(5) 1.000 4 e ? d Uani 0.097(3)
H28A H 0.0504 0.2209 0.0553 1.000 4 e ? calc Uiso 0.11600
C29 C -0.0736(9) 0.2283(7) -0.0053(7) 1.000 4 e ? d Uani 0.133(5)
H29A H -0.1027 0.1916 0.0133 1.000 4 e ? calc Uiso 0.16000
C30 C -0.1210(9) 0.2604(9) -0.0543(7) 1.000 4 e ? d Uani 0.132(5)
H30A H -0.1814 0.2467 -0.0700 1.000 4 e ? calc Uiso 0.15800
C31 C -0.0798(7) 0.3122(8) -0.0797(5) 1.000 4 e ? d Uani 0.116(4)
H31A H -0.1122 0.3350 -0.1145 1.000 4 e ? calc Uiso 0.14000
C32 C 0.0113(7) 0.3352(6) -0.0573(5) 1.000 4 e ? d Uani 0.088(3)
C33 C 0.0187(8) 0.4704(8) -0.0990(5) 1.000 4 e ? d Uani 0.117(4)
C34 C 0.0700(11) 0.5234(9) -0.1317(8) 1.000 4 e ? d Uani 0.154(5)
C35 C 0.0913(18) 0.4976(12) -0.1779(12) 1.000 4 e ? d Uani 0.327(19)
H35A H 0.1150 0.5326 -0.2008 1.000 4 e ? calc Uiso 0.49000
H35B H 0.0828 0.4440 -0.1883 1.000 4 e ? calc Uiso 0.49000
C36 C 0.0730(13) 0.5977(10) -0.1031(9) 1.000 4 e ? d Uani 0.244(10)
H36A H 0.1052 0.6358 -0.1207 1.000 4 e ? calc Uiso 0.36600
H36B H 0.1036 0.5915 -0.0627 1.000 4 e ? calc Uiso 0.36600
H36C H 0.0122 0.6164 -0.1064 1.000 4 e ? calc Uiso 0.36600
C37 C 0.3177(7) 0.0338(6) -0.1119(4) 1.000 4 e ? d Uani 0.109(3)
H37A H 0.2999 0.0688 -0.1448 1.000 4 e ? calc Uiso 0.16300
H37B H 0.2670 0.0010 -0.1093 1.000 4 e ? calc Uiso 0.16300
H37C H 0.3668 0.0004 -0.1164 1.000 4 e ? calc Uiso 0.16300
C38 C 0.3746(5) 0.0405(5) -0.0083(4) 1.000 4 e ? d Uani 0.069(2)
C39 C 0.3811(6) -0.0426(5) -0.0020(4) 1.000 4 e ? d Uani 0.088(3)
H39A H 0.3651 -0.0755 -0.0345 1.000 4 e ? calc Uiso 0.10600
C40 C 0.4116(7) -0.0756(5) 0.0531(5) 1.000 4 e ? d Uani 0.098(3)
H40A H 0.4142 -0.1308 0.0574 1.000 4 e ? calc Uiso 0.11700
C41 C 0.4378(6) -0.0281(5) 0.1008(4) 1.000 4 e ? d Uani 0.085(3)
H41A H 0.4601 -0.0516 0.1371 1.000 4 e ? calc Uiso 0.10200
C42 C 0.4321(5) 0.0571(5) 0.0966(3) 1.000 4 e ? d Uani 0.067(2)
C43 C 0.3993(5) 0.0926(5) 0.0404(3) 1.000 4 e ? d Uani 0.064(2)
C44 C 0.4655(5) 0.1016(5) 0.1499(3) 1.000 4 e ? d Uani 0.070(2)
H44A H 0.4821 0.0710 0.1837 1.000 4 e ? calc Uiso 0.08300
C45 C 0.5217(6) 0.2030(5) 0.2151(3) 1.000 4 e ? d Uani 0.071(2)
C46 C 0.6087(7) 0.1757(6) 0.2380(4) 1.000 4 e ? d Uani 0.097(3)
H46A H 0.6347 0.1386 0.2179 1.000 4 e ? calc Uiso 0.11700
C47 C 0.6571(8) 0.2049(8) 0.2921(5) 1.000 4 e ? d Uani 0.121(4)
H47A H 0.7167 0.1882 0.3071 1.000 4 e ? calc Uiso 0.14500
C48 C 0.6199(9) 0.2566(7) 0.3230(5) 1.000 4 e ? d Uani 0.113(4)
H48A H 0.6528 0.2742 0.3594 1.000 4 e ? calc Uiso 0.13600
C49 C 0.5319(8) 0.2833(5) 0.2999(4) 1.000 4 e ? d Uani 0.094(3)
H49A H 0.5058 0.3189 0.3210 1.000 4 e ? calc Uiso 0.11300
C50 C 0.4814(6) 0.2570(5) 0.2447(4) 1.000 4 e ? d Uani 0.073(2)
C51 C 0.3602(8) 0.3579(7) 0.2320(4) 1.000 4 e ? d Uani 0.094(3)
C52 C 0.2601(10) 0.3727(8) 0.2086(4) 1.000 4 e ? d Uani 0.108(4)
C53 C 0.2373(9) 0.4629(6) 0.2104(5) 1.000 4 e ? d Uani 0.142(5)
H53A H 0.1732 0.4706 0.1953 1.000 4 e ? calc Uiso 0.21300
H53B H 0.2694 0.4923 0.1870 1.000 4 e ? calc Uiso 0.21300
H53C H 0.2554 0.4817 0.2499 1.000 4 e ? calc Uiso 0.21300
C54 C 0.1996(8) 0.3171(8) 0.1881(5) 1.000 4 e ? d Uani 0.125(4)
H54A H 0.2177 0.2641 0.1873 1.000 4 e ? calc Uiso 0.18800
H54B H 0.1387 0.3307 0.1743 1.000 4 e ? calc Uiso 0.18800
C55 C 0.6371(8) 0.2489(8) 0.0704(5) 1.000 4 e ? d Uani 0.098(3)
C56 C 0.7095(8) 0.2742(8) 0.0400(6) 1.000 4 e ? d Uani 0.168(6)
H56A H 0.7640 0.2440 0.0552 1.000 4 e ? calc Uiso 0.25300
H56B H 0.7222 0.3302 0.0466 1.000 4 e ? calc Uiso 0.25300
H56C H 0.6881 0.2646 -0.0011 1.000 4 e ? calc Uiso 0.25300
C57 C 0.1208(18) 0.6391(17) 0.3323(11) 1.000 4 e ? d Uani 0.42(3)
H57A H 0.1188 0.5886 0.3521 1.000 4 e ? calc Uiso 0.50400
H57B H 0.1753 0.6668 0.3530 1.000 4 e ? calc Uiso 0.50400
C58 C 0.0460(13) 0.6843(11) 0.3367(5) 1.000 4 e ? d Uani 0.242(11)
H58A H 0.0496 0.6951 0.3770 1.000 4 e ? calc Uiso 0.36200
H58B H -0.0087 0.6552 0.3200 1.000 4 e ? calc Uiso 0.36200
H58C H 0.0456 0.7338 0.3162 1.000 4 e ? calc Uiso 0.36200
N1 N 0.2686(5) 0.2393(4) -0.0746(3) 1.000 4 e ? d Uani 0.0743(19)
H1D H 0.3089 0.2103 -0.0517 1.000 4 e ? calc Uiso 0.08900
N2 N 0.1793(4) 0.1415(4) -0.0106(3) 1.000 4 e ? d Uani 0.0636(16)
N3 N 0.1548(4) 0.3228(4) 0.0190(2) 1.000 4 e ? d Uani 0.0607(16)
N4 N 0.0504(5) 0.3929(6) -0.0877(3) 1.000 4 e ? d Uani 0.102(3)
H4A H 0.0968 0.3787 -0.1000 1.000 4 e ? calc Uiso 0.12300
N5 N 0.4757(4) 0.1776(4) 0.1572(2) 1.000 4 e ? d Uani 0.0669(17)
N6 N 0.3931(5) 0.2837(4) 0.2214(3) 1.000 4 e ? d Uani 0.0763(19)
H6B H 0.3561 0.2517 0.1988 1.000 4 e ? calc Uiso 0.09200
O1 O 0.2310(5) 0.3664(4) -0.1022(3) 1.000 4 e ? d Uani 0.098(2)
O2 O 0.2479(4) 0.1772(3) 0.1118(2) 1.000 4 e ? d Uani 0.0716(15)
O3 O 0.2921(5) 0.1252(4) 0.2180(2) 1.000 4 e ? d Uani 0.0962(19)
O4 O 0.4861(4) 0.3756(4) 0.1344(3) 1.000 4 e ? d Uani 0.0924(18)
O5 O 0.3455(3) 0.3101(3) 0.0686(2) 1.000 4 e ? d Uani 0.0645(13)
O6 O -0.0490(7) 0.4905(5) -0.0822(5) 1.000 4 e ? d Uani 0.183(4)
O7 O 0.3464(4) 0.0801(3) -0.0600(2) 1.000 4 e ? d Uani 0.0838(17)
O8 O 0.3878(3) 0.1706(3) 0.0330(2) 1.000 4 e ? d Uani 0.0636(13)
O9 O 0.4108(6) 0.4099(4) 0.2609(3) 1.000 4 e ? d Uani 0.128(3)
O10 O 0.5625(5) 0.2824(5) 0.0556(3) 1.000 4 e ? d Uani 0.121(2)
O11 O 0.6542(7) 0.1972(6) 0.1058(5) 1.000 4 e ? d Uani 0.160(4)
O12 O 0.1302(9) 0.6184(8) 0.2606(6) 1.000 4 e ? d Uani 0.279(7)
H12A H 0.1780 0.5947 0.2622 1.000 4 e ? calc Uiso 0.41800
O13 O 0.1677(10) 0.7756(10) 0.2776(6) 1.000 4 e ? d Uani 0.280(8)



loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_1
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Zn1 O2 . . 1.935(5) no
Zn1 O5 . . 1.995(5) no
Zn1 N2 . . 2.008(6) no
Zn1 N3 . . 2.087(6) no
Zn1 O8 . . 2.375(5) no
Zn2 O10 . . 1.918(7) no
Zn2 O8 . . 1.995(5) no
Zn2 O5 . . 2.016(5) no
Zn2 N5 . . 2.023(6) no
Zn2 O4 . . 2.374(6) no
C1 C2 . . 1.451(13) no
C2 C3 . . 1.357(13) no
C2 C4 . . 1.492(12) no
C4 O1 . . 1.223(10) no
C4 N1 . . 1.369(10) no
C5 C6 . . 1.384(11) no
C5 C10 . . 1.384(11) no
C5 N1 . . 1.449(10) no
C6 C7 . . 1.387(13) no
C7 C8 . . 1.346(15) no
C8 C9 . . 1.387(13) no
C9 C10 . . 1.382(11) no
C10 N2 . . 1.416(9) no
C11 N2 . . 1.290(9) no
C11 C12 . . 1.464(11) no
C12 C17 . . 1.395(10) no
C12 C13 . . 1.458(11) no
C13 C14 . . 1.312(12) no
C14 C15 . . 1.368(12) no
C15 C16 . . 1.374(11) no
C16 O3 . . 1.387(9) no
C16 C17 . . 1.424(10) no
C17 O2 . . 1.308(8) no
C18 O3 . . 1.395(9) no
C19 O4 . . 1.449(10) no
C20 O4 . . 1.361(9) no
C20 C25 . . 1.365(12) no
C20 C21 . . 1.425(10) no
C21 O5 . . 1.328(8) no
C21 C22 . . 1.385(10) no
C22 C23 . . 1.353(10) no
C22 C26 . . 1.429(10) no
C23 C24 . . 1.388(13) no
C24 C25 . . 1.354(13) no
C26 N3 . . 1.293(9) no
C27 C32 . . 1.369(12) no
C27 C28 . . 1.391(12) no
C27 N3 . . 1.439(10) no
C28 C29 . . 1.426(16) no
C29 C30 . . 1.318(18) no
C30 C31 . . 1.302(17) no
C31 C32 . . 1.408(13) no
C32 N4 . . 1.422(12) no
C33 O6 . . 1.239(12) no
C33 N4 . . 1.386(13) no
C33 C34 . . 1.519(18) no
C34 C35 . . 1.29(2) no
C34 C36 . . 1.411(19) no
C37 O7 . . 1.425(9) no
C38 O7 . . 1.367(9) no
C38 C39 . . 1.398(11) no
C38 C43 . . 1.419(10) no
C39 C40 . . 1.386(12) no
C40 C41 . . 1.358(11) no
C41 C42 . . 1.429(11) no
C42 C43 . . 1.431(10) no
C42 C44 . . 1.445(10) no
C43 O8 . . 1.323(8) no
C44 N5 . . 1.288(9) no
C45 C46 . . 1.376(12) no
C45 C50 . . 1.378(11) no
C45 N5 . . 1.438(9) no
C46 C47 . . 1.397(13) no
C47 C48 . . 1.348(15) no
C48 C49 . . 1.386(15) no
C49 C50 . . 1.412(11) no
C50 N6 . . 1.391(11) no
C51 O9 . . 1.247(12) no
C51 N6 . . 1.384(11) no
C51 C52 . . 1.504(15) no
C52 C54 . . 1.314(14) no
C52 C53 . . 1.551(14) no
C55 O11 . . 1.186(12) no
C55 O10 . . 1.236(12) no
C55 C56 . . 1.521(15) no
C57 C58 . . 1.39(2) no
C57 O12 . . 1.78(3) no

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_2
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
O2 Zn1 O5 . . . 99.3(2) no
O2 Zn1 N2 . . . 94.2(2) no
O5 Zn1 N2 . . . 159.1(2) no
O2 Zn1 N3 . . . 112.8(2) no
O5 Zn1 N3 . . . 88.6(2) no
N2 Zn1 N3 . . . 100.9(3) no
O2 Zn1 O8 . . . 94.0(2) no
O5 Zn1 O8 . . . 72.98(19) no
N2 Zn1 O8 . . . 90.2(2) no
N3 Zn1 O8 . . . 149.8(2) no
O10 Zn2 O8 . . . 108.9(3) no
O10 Zn2 O5 . . . 120.9(3) no
O8 Zn2 O5 . . . 81.5(2) no
O10 Zn2 N5 . . . 125.0(3) no
O8 Zn2 N5 . . . 93.1(2) no
O5 Zn2 N5 . . . 111.7(2) no
O10 Zn2 O4 . . . 84.0(3) no
O8 Zn2 O4 . . . 152.0(2) no
O5 Zn2 O4 . . . 70.7(2) no
N5 Zn2 O4 . . . 99.7(2) no
C3 C2 C1 . . . 125.2(10) no
C3 C2 C4 . . . 117.3(10) no
C1 C2 C4 . . . 117.5(9) no
O1 C4 N1 . . . 120.9(9) no
O1 C4 C2 . . . 121.5(9) no
N1 C4 C2 . . . 117.6(8) no
C6 C5 C10 . . . 122.2(9) no
C6 C5 N1 . . . 117.4(8) no
C10 C5 N1 . . . 120.2(7) no
C5 C6 C7 . . . 117.9(10) no
C8 C7 C6 . . . 120.7(10) no
C7 C8 C9 . . . 121.0(11) no
C10 C9 C8 . . . 120.(1) no
C9 C10 C5 . . . 117.9(8) no
C9 C10 N2 . . . 122.9(8) no
C5 C10 N2 . . . 119.0(7) no
N2 C11 C12 . . . 128.4(7) no
C17 C12 C13 . . . 117.1(8) no
C17 C12 C11 . . . 123.6(7) no
C13 C12 C11 . . . 119.2(7) no
C14 C13 C12 . . . 123.4(9) no
C13 C14 C15 . . . 120.2(9) no
C14 C15 C16 . . . 119.3(9) no
C15 C16 O3 . . . 124.5(8) no
C15 C16 C17 . . . 123.0(8) no
O3 C16 C17 . . . 112.5(7) no
O2 C17 C12 . . . 124.3(7) no
O2 C17 C16 . . . 118.8(7) no
C12 C17 C16 . . . 116.9(8) no
O4 C20 C25 . . . 127.2(9) no
O4 C20 C21 . . . 113.4(7) no
C25 C20 C21 . . . 119.4(9) no
O5 C21 C22 . . . 124.9(7) no
O5 C21 C20 . . . 116.2(8) no
C22 C21 C20 . . . 118.9(7) no
C23 C22 C21 . . . 119.5(8) no
C23 C22 C26 . . . 116.6(8) no
C21 C22 C26 . . . 123.8(7) no
C22 C23 C24 . . . 121.5(9) no
C25 C24 C23 . . . 119.7(9) no
C24 C25 C20 . . . 120.8(9) no
N3 C26 C22 . . . 127.1(8) no
C32 C27 C28 . . . 117.8(10) no
C32 C27 N3 . . . 123.1(8) no
C28 C27 N3 . . . 119.1(9) no
C27 C28 C29 . . . 117.1(12) no
C30 C29 C28 . . . 124.4(13) no
C31 C30 C29 . . . 117.4(13) no
C30 C31 C32 . . . 123.3(13) no
C27 C32 C31 . . . 120.0(11) no
C27 C32 N4 . . . 120.6(9) no
C31 C32 N4 . . . 119.4(11) no
O6 C33 N4 . . . 118.1(13) no
O6 C33 C34 . . . 125.4(13) no
N4 C33 C34 . . . 116.5(11) no
C35 C34 C36 . . . 135.9(18) no
C35 C34 C33 . . . 120.6(17) no
C36 C34 C33 . . . 103.1(17) no
O7 C38 C39 . . . 125.2(7) no
O7 C38 C43 . . . 113.0(7) no
C39 C38 C43 . . . 121.8(8) no
C40 C39 C38 . . . 119.6(8) no
C41 C40 C39 . . . 120.7(9) no
C40 C41 C42 . . . 121.7(8) no
C41 C42 C43 . . . 118.6(7) no
C41 C42 C44 . . . 116.8(7) no
C43 C42 C44 . . . 124.4(7) no
O8 C43 C38 . . . 120.0(7) no
O8 C43 C42 . . . 122.5(7) no
C38 C43 C42 . . . 117.5(7) no
N5 C44 C42 . . . 129.1(7) no
C46 C45 C50 . . . 121.5(8) no
C46 C45 N5 . . . 117.9(8) no
C50 C45 N5 . . . 120.5(8) no
C45 C46 C47 . . . 118.7(10) no
C48 C47 C46 . . . 121.9(11) no
C47 C48 C49 . . . 119.1(10) no
C48 C49 C50 . . . 120.9(10) no
C45 C50 N6 . . . 121.2(8) no
C45 C50 C49 . . . 117.9(9) no
N6 C50 C49 . . . 120.9(9) no
O9 C51 N6 . . . 121.6(10) no
O9 C51 C52 . . . 121.(1) no
N6 C51 C52 . . . 117.4(10) no
C54 C52 C51 . . . 124.7(11) no
C54 C52 C53 . . . 124.0(12) no
C51 C52 C53 . . . 111.3(12) no
O11 C55 O10 . . . 123.7(12) no
O11 C55 C56 . . . 118.9(12) no
O10 C55 C56 . . . 117.4(11) no
C58 C57 O12 . . . 116.2(16) no
C4 N1 C5 . . . 124.5(7) no
C11 N2 C10 . . . 117.2(7) no
C11 N2 Zn1 . . . 120.5(5) no
C10 N2 Zn1 . . . 122.3(5) no
C26 N3 C27 . . . 116.9(7) no
C26 N3 Zn1 . . . 125.6(6) no
C27 N3 Zn1 . . . 117.4(5) no
C33 N4 C32 . . . 124.2(9) no
C44 N5 C45 . . . 115.7(6) no
C44 N5 Zn2 . . . 119.5(5) no
C45 N5 Zn2 . . . 122.0(5) no
C51 N6 C50 . . . 125.0(8) no
C17 O2 Zn1 . . . 126.2(4) no
C16 O3 C18 . . . 120.0(7) no
C20 O4 C19 . . . 119.7(7) no
C20 O4 Zn2 . . . 111.7(5) no
C19 O4 Zn2 . . . 126.7(6) no
C21 O5 Zn1 . . . 128.7(5) no
C21 O5 Zn2 . . . 125.0(5) no
Zn1 O5 Zn2 . . . 106.1(2) no
C38 O7 C37 . . . 118.1(7) no
C43 O8 Zn2 . . . 122.1(5) no
C43 O8 Zn1 . . . 119.4(4) no
Zn2 O8 Zn1 . . . 93.97(19) no
C55 O10 Zn2 . . . 120.8(7) no
