# Electronic Supplementary Material (ESI) for ChemComm.
# This journal is © The Royal Society of Chemistry 2018

####################################################################### 
# 
# 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. 
# 
#######################################################################

data_1
_database_code_depnum_ccdc_archive 'CCDC 1819521'
_audit_update_record             
;
2018-01-26 deposited with the CCDC.
2018-03-20 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2016/6
_shelx_SHELXL_version_number     2016/6
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C30 H44 N12 O30 P8 Zn8'
_chemical_formula_weight         1823.49

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Zn Zn 0.2839 1.4301 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      trigonal
_space_group_IT_number           145
_space_group_name_H-M_alt        'P 32'
_space_group_name_Hall           'P 32'

_shelx_space_group_comment       
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z+2/3'
'-x+y, -x, z+1/3'

_cell_length_a                   15.2377(9)
_cell_length_b                   15.2377(9)
_cell_length_c                   21.055(2)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_volume                     4233.8(6)
_cell_formula_units_Z            3
_cell_measurement_temperature    293(2)
_cell_measurement_reflns_used    3524
_cell_measurement_theta_min      2.5200
_cell_measurement_theta_max      30.7990

_exptl_crystal_description       block
_exptl_crystal_colour            colorless
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    2.146
_exptl_crystal_F_000             2724
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.22
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.17
_exptl_absorpt_coefficient_mu    3.666
_shelx_estimated_absorpt_T_min   ?
_shelx_estimated_absorpt_T_max   ?
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.464
_exptl_absorpt_correction_T_max  0.536
_exptl_absorpt_process_details   ?
_exptl_absorpt_special_details   ?
_diffrn_ambient_temperature      293(2)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           MoK\a
_diffrn_source                   ?
_diffrn_measurement_device_type  'XtaLAB Mini'
_diffrn_measurement_method       ?
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            15862
_diffrn_reflns_av_unetI/netI     0.0910
_diffrn_reflns_av_R_equivalents  0.0447
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_h_max       4
_diffrn_reflns_limit_k_min       -6
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_theta_min         2.475
_diffrn_reflns_theta_max         32.559
_diffrn_reflns_theta_full        25.242
_diffrn_measured_fraction_theta_max 0.909
_diffrn_measured_fraction_theta_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.909
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.909
_diffrn_reflns_point_group_measured_fraction_full 0.999
_reflns_number_total             13492
_reflns_number_gt                10137
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         1.000
_reflns_Friedel_fraction_max     0.909
_reflns_Friedel_fraction_full    0.999

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 _reflns_Friedel_fraction is defined as the number of unique
 Friedel pairs measured divided by the number that would be
 possible theoretically, ignoring centric projections and
 systematic absences.
;

_computing_data_collection       ?
_computing_cell_refinement       ?
_computing_data_reduction        ?
_computing_structure_solution    ?
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    ?
_computing_publication_material  ?
_refine_special_details          
;
 Refined as a 2-component inversion twin.
;
_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0217P)²+188.6482P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?
_atom_sites_solution_hydrogens   mixed
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_abs_structure_details 
;
 Refined as an inversion twin.
;
_refine_ls_abs_structure_Flack   0.57(5)
_chemical_absolute_configuration ?
_refine_ls_number_reflns         13492
_refine_ls_number_parameters     734
_refine_ls_number_restraints     333
_refine_ls_R_factor_all          0.1302
_refine_ls_R_factor_gt           0.1015
_refine_ls_wR_factor_ref         0.2683
_refine_ls_wR_factor_gt          0.2526
_refine_ls_goodness_of_fit_ref   1.074
_refine_ls_restrained_S_all      1.069
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C1 C 0.8352(10) 0.3038(12) 0.8564(10) 0.038(6) Uani 1 1 d G U . . .
H1 H 0.771039 0.286015 0.841386 0.045 Uiso 1 1 calc R U . . .
C2 C 0.9178(13) 0.4040(10) 0.8637(10) 0.036(6) Uani 1 1 d G U . . .
H2 H 0.917161 0.463353 0.854278 0.044 Uiso 1 1 calc R U . . .
N1 N 1.0014(10) 0.3978(9) 0.8879(9) 0.028(4) Uani 1 1 d G U . . .
C3 C 0.9706(10) 0.2937(10) 0.8956(9) 0.027(5) Uani 1 1 d G U . . .
H3 H 1.010638 0.268070 0.910775 0.032 Uiso 1 1 calc R U . . .
N2 N 0.8679(10) 0.2357(8) 0.8762(8) 0.023(4) Uani 1 1 d G U . . .
N3 N 0.5570(13) -0.0786(13) 0.8779(10) 0.021(4) Uani 1 1 d . U . . .
N4 N 0.4048(12) -0.1082(12) 0.8880(9) 0.018(3) Uani 1 1 d . U . . .
C4 C 0.497(3) -0.183(3) 0.879(2) 0.067(10) Uani 1 1 d . U . . .
H4 H 0.518203 -0.230502 0.875547 0.080 Uiso 1 1 calc R U . . .
C5 C 0.3990(18) -0.201(2) 0.8861(15) 0.037(6) Uani 1 1 d . U . . .
H5 H 0.340380 -0.263658 0.888998 0.045 Uiso 1 1 calc R U . . .
C6 C 0.4969(17) -0.0394(16) 0.8841(12) 0.024(4) Uani 1 1 d . U . . .
H6 H 0.519507 0.029661 0.885528 0.029 Uiso 1 1 calc R U . . .
C9 C 0.8302(8) -0.1765(10) 0.8803(9) 0.035(6) Uani 1 1 d G U . . .
H9 H 0.761726 -0.223027 0.885825 0.042 Uiso 1 1 calc R U . . .
N5 N 0.8729(11) -0.0711(11) 0.8689(9) 0.029(4) Uani 1 1 d G U . . .
C7 C 0.9795(11) -0.0279(8) 0.8632(11) 0.046(7) Uani 1 1 d G U . . .
H7 H 1.025905 0.040019 0.855723 0.055 Uiso 1 1 calc R U . . .
C8 C 1.0027(9) -0.1067(11) 0.8711(10) 0.031(5) Uani 1 1 d G U . . .
H8 H 1.066976 -0.099354 0.869621 0.037 Uiso 1 1 calc R U . . .
N6 N 0.9104(11) -0.1985(9) 0.8816(7) 0.016(3) Uani 1 1 d G U . . .
C10 C 0.8178(10) 0.1347(7) 0.8762(8) 0.021(4) Uani 1 1 d G U . . .
C11 C 0.8726(7) 0.0841(11) 0.8758(8) 0.024(4) Uani 1 1 d G U . . .
H11 H 0.943024 0.120758 0.875030 0.028 Uiso 1 1 calc R U . . .
C12 C 0.8220(11) -0.0212(11) 0.8766(8) 0.027(5) Uani 1 1 d G U . . .
C13 C 0.7168(11) -0.0759(7) 0.8778(8) 0.029(5) Uani 1 1 d G U . . .
H13 H 0.682949 -0.146370 0.878293 0.035 Uiso 1 1 calc R U . . .
C14 C 0.6620(7) -0.0254(10) 0.8782(8) 0.022(4) Uani 1 1 d G U . . .
C15 C 0.7125(10) 0.0799(10) 0.8774(8) 0.022(4) Uani 1 1 d G U . . .
H15 H 0.675898 0.113743 0.877652 0.026 Uiso 1 1 calc R U . . .
C18 C 1.0424(10) 0.0909(8) 1.0307(8) 0.021(4) Uani 1 1 d G U . . .
H18 H 1.020425 0.024224 1.018921 0.026 Uiso 1 1 calc R U . . .
N8 N 0.9795(7) 0.1330(10) 1.0434(7) 0.019(3) Uani 1 1 d G U . . .
C16 C 1.0430(11) 0.2365(10) 1.0598(9) 0.025(5) Uani 1 1 d G U . . .
H16 H 1.021495 0.282026 1.070276 0.030 Uiso 1 1 calc R U . . .
C17 C 1.1451(9) 0.2583(9) 1.0572(9) 0.027(5) Uani 1 1 d G U . . .
H17 H 1.202197 0.320638 1.065825 0.033 Uiso 1 1 calc R U . . .
N7 N 1.1447(8) 0.1683(11) 1.0393(8) 0.032(5) Uani 1 1 d G U . . .
N10 N 0.6588(14) 0.1308(14) 1.0324(9) 0.021(4) Uani 1 1 d . U . . .
N9 N 0.6283(16) 0.2532(17) 1.0212(11) 0.031(5) Uani 1 1 d . U . . .
C19 C 0.562(2) 0.0930(19) 1.0387(15) 0.036(6) Uani 1 1 d . U . . .
H19 H 0.514041 0.025765 1.047294 0.043 Uiso 1 1 calc R U . . .
C20 C 0.544(2) 0.169(2) 1.0304(15) 0.039(6) Uani 1 1 d . U . . .
H20 H 0.479768 0.163152 1.031116 0.046 Uiso 1 1 calc R U . . .
C21 C 0.6982(17) 0.2292(16) 1.0230(12) 0.026(5) Uani 1 1 d . U . . .
H21 H 0.767055 0.274827 1.018344 0.031 Uiso 1 1 calc R U . . .
C24 C 0.5597(9) -0.2467(10) 1.0407(9) 0.031(5) Uani 1 1 d G U . . .
H24 H 0.512783 -0.225443 1.034530 0.037 Uiso 1 1 calc R U . . .
N11 N 0.5369(9) -0.3482(9) 1.0505(9) 0.029(4) Uani 1 1 d G U . . .
C22 C 0.6299(11) -0.3476(9) 1.0579(10) 0.034(5) Uani 1 1 d G U . . .
H22 H 0.636946 -0.403983 1.064907 0.041 Uiso 1 1 calc R U . . .
C23 C 0.7101(8) -0.2458(11) 1.0525(9) 0.027(5) Uani 1 1 d G U . . .
H23 H 0.778893 -0.223812 1.055496 0.033 Uiso 1 1 calc R U . . .
N12 N 0.6667(9) -0.1834(8) 1.0419(8) 0.020(4) Uani 1 1 d G U . . .
C25 C 0.8765(6) 0.0787(10) 1.0465(8) 0.020(4) Uani 1 1 d G U . . .
C26 C 0.8238(10) -0.0265(10) 1.0484(8) 0.021(4) Uani 1 1 d G U . . .
H26 H 0.858996 -0.061658 1.051359 0.025 Uiso 1 1 calc R U . . .
C27 C 0.7185(10) -0.0793(7) 1.0461(8) 0.021(4) Uani 1 1 d G U . . .
C28 C 0.6659(6) -0.0268(10) 1.0417(8) 0.020(4) Uani 1 1 d G U . . .
H28 H 0.595497 -0.062154 1.040100 0.024 Uiso 1 1 calc R U . . .
C29 C 0.7186(10) 0.0785(10) 1.0397(8) 0.019(4) Uani 1 1 d G U . . .
C30 C 0.8238(10) 0.1312(7) 1.0421(8) 0.032(5) Uani 1 1 d G U . . .
H30 H 0.859075 0.201688 1.040770 0.038 Uiso 1 1 calc R U . . .
O1 O 1.6680(17) 0.4201(17) 0.9218(6) 0.049(5) Uani 1 1 d D U . . .
O2 O 1.5788(12) 0.4720(14) 0.8371(10) 0.039(5) Uani 1 1 d D . . . .
O3 O 1.7603(13) 0.5645(11) 0.8473(9) 0.045(5) Uani 1 1 d D . . . .
O4 O 1.5519(12) 0.4091(11) 1.0522(7) 0.024(3) Uani 1 1 d D U . . .
O5 O 1.3752(14) 0.2455(12) 1.0501(8) 0.029(4) Uani 1 1 d D U . . .
O6 O 1.3899(12) 0.4186(13) 1.0571(8) 0.031(4) Uani 1 1 d D . . . .
O7 O 1.2077(15) 0.0126(16) 1.0502(10) 0.046(5) Uani 1 1 d D U . . .
O8 O 1.1435(11) -0.1624(11) 1.0864(9) 0.031(4) Uani 1 1 d D . . . .
O9 O 1.266(2) -0.0995(16) 0.9929(7) 0.065(7) Uani 1 1 d D . . . .
O10 O 1.3477(12) 0.4152(12) 0.8483(7) 0.026(4) Uani 1 1 d D U . . .
O11 O 1.3926(13) 0.5360(11) 0.9384(9) 0.039(5) Uani 1 1 d D . . . .
O12 O 1.2347(17) 0.4834(15) 0.8709(8) 0.043(5) Uani 1 1 d D . . . .
O13 O 1.3092(14) 0.5841(19) 1.0527(11) 0.055(6) Uani 1 1 d D . . . .
O14 O 1.1378(14) 0.5028(15) 0.9990(6) 0.039(5) Uani 1 1 d D . . . .
O15 O 1.2081(12) 0.6694(11) 1.0580(8) 0.028(4) Uani 1 1 d D U . . .
O16 O 1.1527(16) 0.6386(14) 0.8777(9) 0.039(5) Uani 1 1 d D U . . .
O17 O 0.9982(13) 0.6444(15) 0.8646(8) 0.035(4) Uani 1 1 d D U . . .
O18 O 1.1636(14) 0.8024(13) 0.8663(8) 0.039(5) Uani 1 1 d D . . . .
O19 O 0.8819(12) 0.6503(11) 0.9846(8) 0.028(4) Uani 1 1 d D . . . .
O20 O 0.7830(11) 0.4892(13) 1.0500(7) 0.027(4) Uani 1 1 d D . . . .
O21 O 0.9645(13) 0.6037(11) 1.0743(6) 0.029(4) Uani 1 1 d D . . . .
O22 O 1.3416(15) 1.0491(15) 0.8799(12) 0.063(8) Uani 1 1 d D . . . .
O23 O 1.2518(15) 1.142(2) 0.9245(7) 0.050(6) Uani 1 1 d D . . . .
O24 O 1.4076(13) 1.2317(13) 0.8662(10) 0.041(5) Uani 1 1 d D . . . .
P1 P 1.6741(5) 0.4707(5) 0.8590(3) 0.0273(13) Uani 1 1 d D . . . .
P2 P 1.4385(4) 0.3608(4) 1.0326(3) 0.0221(13) Uani 1 1 d D . . . .
P3 P 1.2326(4) -0.0705(4) 1.0564(3) 0.0249(12) Uani 1 1 d D . . . .
P4 P 1.3084(4) 0.4545(4) 0.9007(3) 0.0252(12) Uani 1 1 d D . . . .
P5 P 1.2060(5) 0.5676(5) 1.0545(3) 0.0318(15) Uani 1 1 d D . . . .
P6 P 1.1038(4) 0.6970(5) 0.8892(3) 0.0292(16) Uani 1 1 d D . . . .
P7 P 0.8832(4) 0.5650(4) 1.0205(3) 0.0226(11) Uani 1 1 d D . . . .
P8 P 1.3121(5) 1.1355(4) 0.8729(3) 0.0255(12) Uani 1 1 d D . . . .
Zn1 Zn 1.6553(2) 0.3951(2) 1.00973(14) 0.0257(6) Uani 1 1 d . . . . .
Zn2 Zn 1.2517(2) 0.1423(2) 1.01651(15) 0.0271(6) Uani 1 1 d . . . . .
Zn3 Zn 1.44312(19) 0.36144(18) 0.83070(15) 0.0236(6) Uani 1 1 d . . . . .
Zn4 Zn 1.29966(18) 0.41083(18) 0.75706(15) 0.0230(6) Uani 1 1 d . . . . .
Zn5 Zn 1.4035(2) 0.5436(2) 1.03048(14) 0.0248(6) Uani 1 1 d . . . . .
Zn6 Zn 1.1363(2) 0.5113(2) 0.90859(14) 0.0241(6) Uani 1 1 d . . . . .
Zn7 Zn 0.8856(2) 0.6622(2) 0.89243(14) 0.0237(6) Uani 1 1 d . . . . .
Zn8 Zn 1.28476(19) 0.91356(19) 0.90650(12) 0.0251(6) Uani 1 1 d . . . . .
H1A H 1.674060 0.403078 0.817920 0.030 Uiso 1 1 d DR U . . .
H2A H 1.438519 0.362874 0.968665 0.030 Uiso 1 1 d DR U . . .
H3A H 1.312953 -0.038971 1.095344 0.030 Uiso 1 1 d DR U . . .
H4A H 1.252632 0.375891 0.939554 0.030 Uiso 1 1 d DR U . . .
H5A H 1.157866 0.516418 1.107591 0.030 Uiso 1 1 d DR U . . .
H6A H 1.095440 0.703512 0.952988 0.030 Uiso 1 1 d DR U . . .
H7A H 0.910902 0.514433 0.979295 0.030 Uiso 1 1 d DR U . . .
H8A H 1.259874 1.111266 0.817935 0.030 Uiso 1 1 d DR U . . .
O1W O 0.1181(15) 0.2075(18) 0.8731(12) 0.054(6) Uani 1 1 d . . . . .
O2W O 0.9406(12) 0.3773(13) 0.0464(9) 0.031(4) Uani 1 1 d . . . . .
O3W O 0.9584(15) 0.8514(16) 0.0398(13) 0.048(6) Uani 1 1 d . . . . .
O4W O 0.5886(18) 0.6560(16) 0.8840(10) 0.045(5) Uani 1 1 d . . . . .
O5W O 0.578(2) 0.195(2) 0.8463(13) 0.063(7) Uani 1 1 d . . . . .
O6W O 0.4214(14) 0.8431(15) 0.0679(14) 0.054(7) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 N2 1.4200 . ?
C1 C2 1.4200 . ?
C2 N1 1.4200 . ?
N1 C3 1.4200 . ?
N1 Zn6 1.962(11) . ?
C3 N2 1.4200 . ?
N2 C10 1.333(14) . ?
N3 C6 1.33(3) . ?
N3 C4 1.38(4) . ?
N3 C14 1.39(2) . ?
N4 C6 1.27(3) . ?
N4 C5 1.37(3) . ?
N4 Zn8 2.053(17) 1_445 ?
C4 C5 1.39(5) . ?
C9 N6 1.4200 . ?
C9 N5 1.4200 . ?
N5 C12 1.339(14) . ?
N5 C7 1.4200 . ?
C7 C8 1.4200 . ?
C8 N6 1.4200 . ?
N6 Zn7 1.974(11) 1_545 ?
C10 C11 1.3900 . ?
C10 C15 1.3900 . ?
C11 C12 1.3900 . ?
C12 C13 1.3900 . ?
C13 C14 1.3900 . ?
C14 C15 1.3900 . ?
C18 N8 1.4200 . ?
C18 N7 1.4200 . ?
N8 C25 1.363(13) . ?
N8 C16 1.4200 . ?
C16 C17 1.4200 . ?
C17 N7 1.4200 . ?
N7 Zn2 1.922(10) . ?
N10 C19 1.30(3) . ?
N10 C21 1.32(3) . ?
N10 C29 1.489(19) . ?
N9 C21 1.29(3) . ?
N9 C20 1.30(3) . ?
N9 Zn1 2.00(2) 1_455 ?
C19 C20 1.33(3) . ?
C24 N11 1.4200 . ?
C24 N12 1.4200 . ?
N11 C22 1.4200 . ?
N11 Zn5 1.918(11) 1_445 ?
C22 C23 1.4200 . ?
C23 N12 1.4200 . ?
N12 C27 1.377(13) . ?
C25 C26 1.3900 . ?
C25 C30 1.3900 . ?
C26 C27 1.3900 . ?
C27 C28 1.3900 . ?
C28 C29 1.3900 . ?
C29 C30 1.3900 . ?
O1 P1 1.509(17) . ?
O1 Zn1 1.881(14) . ?
O2 P1 1.533(16) . ?
O2 Zn3 1.910(18) . ?
O3 P1 1.397(16) . ?
O3 Zn7 1.981(15) 1_655 ?
O4 P2 1.558(15) . ?
O4 Zn1 1.915(17) . ?
O5 P2 1.568(15) . ?
O5 Zn2 1.885(19) . ?
O6 P2 1.498(16) . ?
O6 Zn5 1.894(19) . ?
O7 P3 1.498(18) . ?
O7 Zn2 1.880(19) . ?
O8 P3 1.518(15) . ?
O8 Zn4 1.896(15) 3_765 ?
O9 P3 1.57(2) . ?
O9 Zn8 1.838(17) 1_545 ?
O10 P4 1.515(14) . ?
O10 Zn3 2.028(14) . ?
O10 Zn4 2.044(16) . ?
O11 P4 1.491(16) . ?
O11 Zn5 1.95(2) . ?
O12 P4 1.530(16) . ?
O12 Zn6 1.923(18) . ?
O13 P5 1.465(19) . ?
O13 Zn5 1.884(19) . ?
O14 P5 1.548(17) . ?
O14 Zn6 1.908(14) . ?
O15 P5 1.536(15) . ?
O15 Zn4 1.888(15) 3_775 ?
O16 P6 1.438(16) . ?
O16 Zn6 1.940(17) . ?
O17 P6 1.487(17) . ?
O17 Zn7 1.956(18) . ?
O18 P6 1.476(17) . ?
O18 Zn8 1.967(18) . ?
O19 P7 1.512(15) . ?
O19 Zn7 1.947(17) . ?
O20 P7 1.513(14) . ?
O20 Zn1 1.941(16) 1_455 ?
O21 P7 1.560(16) . ?
O21 Zn4 1.996(17) 3_775 ?
O21 Zn3 2.017(15) 3_775 ?
O22 P8 1.595(19) . ?
O22 Zn8 1.882(17) . ?
O23 P8 1.457(17) . ?
O23 Zn2 1.937(14) 1_565 ?
O24 P8 1.467(18) . ?
O24 Zn3 1.92(2) 1_565 ?
Zn3 Zn4 3.065(3) . ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
N2 C1 C2 108.0 . . ?
N1 C2 C1 108.0 . . ?
C3 N1 C2 108.0 . . ?
C3 N1 Zn6 125.1(9) . . ?
C2 N1 Zn6 126.9(9) . . ?
N2 C3 N1 108.0 . . ?
C10 N2 C3 122.4(12) . . ?
C10 N2 C1 129.6(12) . . ?
C3 N2 C1 108.0 . . ?
C6 N3 C4 108(2) . . ?
C6 N3 C14 126.2(18) . . ?
C4 N3 C14 125(2) . . ?
C6 N4 C5 108.9(18) . . ?
C6 N4 Zn8 125.9(14) . 1_445 ?
C5 N4 Zn8 124.7(15) . 1_445 ?
N3 C4 C5 105(3) . . ?
N4 C5 C4 107(2) . . ?
N4 C6 N3 111.3(18) . . ?
N6 C9 N5 108.0 . . ?
C12 N5 C7 126.8(13) . . ?
C12 N5 C9 123.7(13) . . ?
C7 N5 C9 108.0 . . ?
C8 C7 N5 108.0 . . ?
N6 C8 C7 108.0 . . ?
C9 N6 C8 108.0 . . ?
C9 N6 Zn7 122.1(8) . 1_545 ?
C8 N6 Zn7 129.8(8) . 1_545 ?
N2 C10 C11 119.0(13) . . ?
N2 C10 C15 121.0(13) . . ?
C11 C10 C15 120.0 . . ?
C10 C11 C12 120.0 . . ?
N5 C12 C11 120.7(13) . . ?
N5 C12 C13 118.9(13) . . ?
C11 C12 C13 120.0 . . ?
C14 C13 C12 120.0 . . ?
N3 C14 C13 120.8(13) . . ?
N3 C14 C15 119.1(13) . . ?
C13 C14 C15 120.0 . . ?
C14 C15 C10 120.0 . . ?
N8 C18 N7 108.0 . . ?
C25 N8 C18 124.6(11) . . ?
C25 N8 C16 126.9(11) . . ?
C18 N8 C16 108.0 . . ?
N8 C16 C17 108.0 . . ?
N7 C17 C16 108.0 . . ?
C17 N7 C18 108.0 . . ?
C17 N7 Zn2 132.2(8) . . ?
C18 N7 Zn2 119.3(8) . . ?
C19 N10 C21 106.9(18) . . ?
C19 N10 C29 128.2(19) . . ?
C21 N10 C29 124.8(18) . . ?
C21 N9 C20 106(2) . . ?
C21 N9 Zn1 123.9(17) . 1_455 ?
C20 N9 Zn1 130.5(17) . 1_455 ?
N10 C19 C20 107(2) . . ?
N9 C20 C19 110(2) . . ?
N9 C21 N10 111(2) . . ?
N11 C24 N12 108.0 . . ?
C24 N11 C22 108.0 . . ?
C24 N11 Zn5 118.8(8) . 1_445 ?
C22 N11 Zn5 130.8(8) . 1_445 ?
C23 C22 N11 108.0 . . ?
N12 C23 C22 108.0 . . ?
C27 N12 C23 124.8(11) . . ?
C27 N12 C24 125.9(11) . . ?
C23 N12 C24 108.0 . . ?
N8 C25 C26 121.8(12) . . ?
N8 C25 C30 118.0(12) . . ?
C26 C25 C30 120.0 . . ?
C25 C26 C27 120.0 . . ?
N12 C27 C26 120.0(12) . . ?
N12 C27 C28 119.7(12) . . ?
C26 C27 C28 120.0 . . ?
C29 C28 C27 120.0 . . ?
C28 C29 C30 120.0 . . ?
C28 C29 N10 117.8(13) . . ?
C30 C29 N10 122.1(13) . . ?
C29 C30 C25 120.0 . . ?
P1 O1 Zn1 160.0(15) . . ?
P1 O2 Zn3 128.7(12) . . ?
P1 O3 Zn7 138.1(13) . 1_655 ?
P2 O4 Zn1 127.1(9) . . ?
P2 O5 Zn2 130.2(10) . . ?
P2 O6 Zn5 130.7(10) . . ?
P3 O7 Zn2 144.4(14) . . ?
P3 O8 Zn4 130.9(10) . 3_765 ?
P3 O9 Zn8 150.2(16) . 1_545 ?
P4 O10 Zn3 142.9(10) . . ?
P4 O10 Zn4 119.4(9) . . ?
Zn3 O10 Zn4 97.6(6) . . ?
P4 O11 Zn5 126.3(10) . . ?
P4 O12 Zn6 131.3(11) . . ?
P5 O13 Zn5 151.6(19) . . ?
P5 O14 Zn6 137.4(11) . . ?
P5 O15 Zn4 130.2(10) . 3_775 ?
P6 O16 Zn6 135.6(13) . . ?
P6 O17 Zn7 127.5(11) . . ?
P6 O18 Zn8 126.8(11) . . ?
P7 O19 Zn7 124.6(9) . . ?
P7 O20 Zn1 129.9(9) . 1_455 ?
P7 O21 Zn4 141.8(10) . 3_775 ?
P7 O21 Zn3 118.4(10) . 3_775 ?
Zn4 O21 Zn3 99.6(6) 3_775 3_775 ?
P8 O22 Zn8 140.2(14) . . ?
P8 O23 Zn2 138.3(14) . 1_565 ?
P8 O24 Zn3 133.9(11) . 1_565 ?
O3 P1 O1 117.6(12) . . ?
O3 P1 O2 110.2(12) . . ?
O1 P1 O2 117.0(12) . . ?
O6 P2 O4 112.9(9) . . ?
O6 P2 O5 111.7(10) . . ?
O4 P2 O5 112.5(9) . . ?
O7 P3 O8 109.1(11) . . ?
O7 P3 O9 114.7(13) . . ?
O8 P3 O9 111.2(11) . . ?
O11 P4 O10 111.8(11) . . ?
O11 P4 O12 115.3(12) . . ?
O10 P4 O12 107.9(10) . . ?
O13 P5 O15 110.5(13) . . ?
O13 P5 O14 114.3(14) . . ?
O15 P5 O14 110.5(12) . . ?
O16 P6 O18 113.0(12) . . ?
O16 P6 O17 111.4(11) . . ?
O18 P6 O17 112.6(11) . . ?
O19 P7 O20 114.8(10) . . ?
O19 P7 O21 112.9(10) . . ?
O20 P7 O21 107.4(9) . . ?
O23 P8 O24 110.4(14) . . ?
O23 P8 O22 115.8(14) . . ?
O24 P8 O22 106.6(11) . . ?
O1 Zn1 O4 116.4(8) . . ?
O1 Zn1 O20 108.4(8) . 1_655 ?
O4 Zn1 O20 106.8(6) . 1_655 ?
O1 Zn1 N9 106.4(10) . 1_655 ?
O4 Zn1 N9 109.1(8) . 1_655 ?
O20 Zn1 N9 109.6(8) 1_655 1_655 ?
O7 Zn2 O5 114.7(7) . . ?
O7 Zn2 N7 103.2(8) . . ?
O5 Zn2 N7 109.3(7) . . ?
O7 Zn2 O23 112.0(11) . 1_545 ?
O5 Zn2 O23 112.1(8) . 1_545 ?
N7 Zn2 O23 104.6(8) . 1_545 ?
O2 Zn3 O24 120.2(7) . 1_545 ?
O2 Zn3 O21 107.1(8) . 2_754 ?
O24 Zn3 O21 116.3(8) 1_545 2_754 ?
O2 Zn3 O10 108.0(6) . . ?
O24 Zn3 O10 117.0(7) 1_545 . ?
O21 Zn3 O10 81.3(7) 2_754 . ?
O2 Zn3 Zn4 114.2(6) . . ?
O24 Zn3 Zn4 125.5(5) 1_545 . ?
O21 Zn3 Zn4 40.0(5) 2_754 . ?
O10 Zn3 Zn4 41.4(4) . . ?
O15 Zn4 O8 117.1(6) 2_754 2_644 ?
O15 Zn4 O21 118.7(7) 2_754 2_754 ?
O8 Zn4 O21 112.6(7) 2_644 2_754 ?
O15 Zn4 O10 113.9(7) 2_754 . ?
O8 Zn4 O10 107.1(7) 2_644 . ?
O21 Zn4 O10 81.4(6) 2_754 . ?
O15 Zn4 Zn3 126.5(4) 2_754 . ?
O8 Zn4 Zn3 115.9(5) 2_644 . ?
O21 Zn4 Zn3 40.5(4) 2_754 . ?
O10 Zn4 Zn3 41.0(4) . . ?
O13 Zn5 O6 122.5(8) . . ?
O13 Zn5 N11 108(4) . 1_665 ?
O6 Zn5 N11 110(3) . 1_665 ?
O13 Zn5 O11 102.2(10) . . ?
O6 Zn5 O11 105.8(7) . . ?
N11 Zn5 O11 107(5) 1_665 . ?
O14 Zn6 O12 111.1(8) . . ?
O14 Zn6 O16 113.7(8) . . ?
O12 Zn6 O16 110.9(7) . . ?
O14 Zn6 N1 101.8(8) . . ?
O12 Zn6 N1 107.6(9) . . ?
O16 Zn6 N1 111.2(8) . . ?
O19 Zn7 O17 105.8(7) . . ?
O19 Zn7 N6 101(5) . 1_565 ?
O17 Zn7 N6 114(4) . 1_565 ?
O19 Zn7 O3 115.8(8) . 1_455 ?
O17 Zn7 O3 109.6(8) . 1_455 ?
N6 Zn7 O3 110(4) 1_565 1_455 ?
O9 Zn8 O22 112.0(11) 1_565 . ?
O9 Zn8 O18 107.7(9) 1_565 . ?
O22 Zn8 O18 122.4(8) . . ?
O9 Zn8 N4 105.9(11) 1_565 1_665 ?
O22 Zn8 N4 99.4(8) . 1_665 ?
O18 Zn8 N4 107.9(8) . 1_665 ?

_refine_diff_density_max         1.963
_refine_diff_density_min         -1.330
_refine_diff_density_rms         0.294

