#------------------------------------------------------------------------------
#$Date: 2016-03-21 10:23:07 +0200 (Mon, 21 Mar 2016) $
#$Revision: 178648 $
#$URL: svn://www.crystallography.net/cod/cif/4/07/59/4075989.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_4075989
loop_
_publ_author_name
'Majoumo-Mbe, Félicité'
'Lönnecke, Peter'
'Hey-Hawkins, Evamarie'
_publ_section_title
;
 Zwitterionic and Bis-amido Zinc Complexes with Bulky
 Bis(phosphanylamino)benzene Ligands:  Synthesis, Reactivity, and
 Molecular Structures of [ZnCl2(1,2-{N(PHMes2)}2C6H4-κ2N,N‘)],
 [ZnPr{1-N(PMes2)-2-N(PHMes2)C6H4-κ2N,N‘}], and
 [Zn{1-N(PMes2)-2-N(μ-PMes2)C6H4-κ3N,N‘,P}]2
;
_journal_issue                   22
_journal_name_full               Organometallics
_journal_page_first              5287
_journal_paper_doi               10.1021/om050401t
_journal_volume                  24
_journal_year                    2005
_chemical_formula_sum            'C118 H140 N4 O2 P4 Zn2'
_chemical_formula_weight         1900.96
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                93.516(3)
_cell_angle_beta                 102.306(3)
_cell_angle_gamma                112.238(3)
_cell_formula_units_Z            1
_cell_length_a                   12.0882(19)
_cell_length_b                   14.910(2)
_cell_length_c                   16.002(3)
_cell_measurement_reflns_used    964
_cell_measurement_temperature    210(2)
_cell_measurement_theta_max      27.42
_cell_measurement_theta_min      2.56
_cell_volume                     2575.9(7)
_computing_cell_refinement       'Bruker SAINT'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_computing_molecular_graphics    'ORTEP3 for Windows (L. J. Farrugia, 1997)'
_computing_publication_material  'WINGX  (L.J. Farrugia,1999)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      210(2)
_diffrn_measured_fraction_theta_full 0.870
_diffrn_measured_fraction_theta_max 0.870
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0524
_diffrn_reflns_av_sigmaI/netI    0.1008
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            23152
_diffrn_reflns_theta_full        29.54
_diffrn_reflns_theta_max         29.54
_diffrn_reflns_theta_min         1.83
_exptl_absorpt_coefficient_mu    0.580
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            'pale yellow'
_exptl_crystal_density_diffrn    1.225
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1012
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.641
_refine_diff_density_min         -0.425
_refine_diff_density_rms         0.076
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.138
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     618
_refine_ls_number_reflns         12523
_refine_ls_number_restraints     60
_refine_ls_restrained_S_all      1.142
_refine_ls_R_factor_all          0.1448
_refine_ls_R_factor_gt           0.0860
_refine_ls_shift/su_max          0.012
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ2^(Fo2^)+(0.0475P)2^+3.1547P] where P=(Fo2+2Fc2)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1504
_refine_ls_wR_factor_ref         0.1702
_reflns_number_gt                7972
_reflns_number_total             12523
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            om050401tsi20050523_015832.cif
_cod_data_source_block           c1532fin
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_cell_volume        2576.0(7)
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               4075989
loop_
_symmetry_equiv_pos_as_xyz
'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
_atom_site_disorder_assembly
_atom_site_disorder_group
Zn1 Zn 0.57047(5) 0.95485(3) 0.55970(3) 0.02635(14) Uani 1 1 d . . .
P1 P 0.60779(11) 0.97273(8) 0.75973(7) 0.0291(3) Uani 1 1 d . . .
P2 P 0.58643(10) 0.81202(7) 0.40864(6) 0.0255(2) Uani 1 1 d . . .
O1 O 0.4086(3) 0.91651(19) 0.47451(17) 0.0289(6) Uani 1 1 d . . .
N1 N 0.6330(3) 0.9244(2) 0.6716(2) 0.0292(8) Uani 1 1 d . . .
N2 N 0.6250(3) 0.8523(2) 0.5103(2) 0.0278(7) Uani 1 1 d . . .
C1 C 0.5332(4) 0.8688(3) 0.8158(3) 0.0321(10) Uani 1 1 d . . .
C2 C 0.4057(4) 0.8158(3) 0.7754(3) 0.0375(11) Uani 1 1 d . . .
C3 C 0.3331(5) 0.7445(3) 0.8153(4) 0.0468(12) Uani 1 1 d . . .
H3 H 0.2481 0.7115 0.7887 0.056 Uiso 1 1 calc R . .
C4 C 0.3817(5) 0.7201(3) 0.8932(4) 0.0487(13) Uani 1 1 d . . .
C5 C 0.5054(5) 0.7692(3) 0.9301(3) 0.0454(12) Uani 1 1 d . . .
H5 H 0.5398 0.7523 0.9820 0.054 Uiso 1 1 calc R . .
C6 C 0.5835(4) 0.8433(3) 0.8944(3) 0.0365(10) Uani 1 1 d . . .
C7 C 0.3456(5) 0.8329(4) 0.6892(3) 0.0508(13) Uani 1 1 d . . .
H7A H 0.2565 0.7999 0.6782 0.076 Uiso 1 1 calc R . .
H7B H 0.3729 0.8071 0.6441 0.076 Uiso 1 1 calc R . .
H7C H 0.3687 0.9027 0.6896 0.076 Uiso 1 1 calc R . .
C8 C 0.2994(6) 0.6406(4) 0.9348(4) 0.078(2) Uani 1 1 d . . .
H8A H 0.3135 0.5813 0.9255 0.117 Uiso 1 1 calc R . .
H8B H 0.2134 0.6271 0.9090 0.117 Uiso 1 1 calc R . .
H8C H 0.3192 0.6628 0.9965 0.117 Uiso 1 1 calc R . .
C9 C 0.7179(5) 0.8896(4) 0.9463(3) 0.0459(12) Uani 1 1 d . . .
H9A H 0.7299 0.9441 0.9886 0.069 Uiso 1 1 calc R . .
H9B H 0.7706 0.9132 0.9075 0.069 Uiso 1 1 calc R . .
H9C H 0.7389 0.8411 0.9758 0.069 Uiso 1 1 calc R . .
C10 C 0.7507(4) 1.0570(3) 0.8403(3) 0.0319(10) Uani 1 1 d . . .
C11 C 0.8735(4) 1.0913(3) 0.8332(3) 0.0391(11) Uani 1 1 d . . .
C12 C 0.9665(5) 1.1627(4) 0.8979(4) 0.0526(13) Uani 1 1 d . . .
H12 H 1.0485 1.1838 0.8934 0.063 Uiso 1 1 calc R . .
C13 C 0.9437(6) 1.2040(4) 0.9687(3) 0.0577(15) Uani 1 1 d . . .
C14 C 0.8243(5) 1.1735(4) 0.9738(3) 0.0489(13) Uani 1 1 d . . .
H14 H 0.8071 1.2018 1.0209 0.059 Uiso 1 1 calc R . .
C15 C 0.7270(5) 1.1018(3) 0.9117(3) 0.0376(11) Uani 1 1 d . . .
C16 C 0.9140(5) 1.0547(4) 0.7591(3) 0.0487(13) Uani 1 1 d . . .
H16A H 0.9955 1.1012 0.7584 0.073 Uiso 1 1 calc R . .
H16B H 0.8556 1.0481 0.7046 0.073 Uiso 1 1 calc R . .
H16C H 0.9165 0.9915 0.7669 0.073 Uiso 1 1 calc R . .
C17 C 1.0485(7) 1.2830(5) 1.0377(4) 0.097(2) Uani 1 1 d . . .
H17A H 1.0742 1.3448 1.0156 0.145 Uiso 1 1 calc R . .
H17B H 1.1178 1.2641 1.0525 0.145 Uiso 1 1 calc R . .
H17C H 1.0200 1.2903 1.0890 0.145 Uiso 1 1 calc R . .
C18 C 0.5999(5) 1.0727(3) 0.9264(3) 0.0468(13) Uani 1 1 d . . .
H18A H 0.5791 1.0135 0.9526 0.070 Uiso 1 1 calc R . .
H18B H 0.5401 1.0606 0.8714 0.070 Uiso 1 1 calc R . .
H18C H 0.5986 1.1252 0.9646 0.070 Uiso 1 1 calc R . .
C19 C 0.6828(4) 0.8545(3) 0.6638(3) 0.0281(9) Uani 1 1 d . . .
C20 C 0.7326(4) 0.8178(3) 0.7338(3) 0.0384(11) Uani 1 1 d . . .
H20 H 0.7269 0.8366 0.7894 0.046 Uiso 1 1 calc R . .
C21 C 0.7900(5) 0.7548(4) 0.7239(3) 0.0433(12) Uani 1 1 d . . .
H21 H 0.8212 0.7304 0.7722 0.052 Uiso 1 1 calc R . .
C22 C 0.8013(4) 0.7279(3) 0.6440(3) 0.0424(12) Uani 1 1 d . . .
H22 H 0.8427 0.6869 0.6374 0.051 Uiso 1 1 calc R . .
C23 C 0.7510(4) 0.7617(3) 0.5724(3) 0.0370(10) Uani 1 1 d . . .
H23 H 0.7606 0.7440 0.5178 0.044 Uiso 1 1 calc R . .
C24 C 0.6871(4) 0.8208(3) 0.5798(3) 0.0278(9) Uani 1 1 d . . .
C25 C 0.5883(4) 0.6906(3) 0.3825(3) 0.0289(9) Uani 1 1 d . . .
C26 C 0.6830(4) 0.6776(3) 0.3501(3) 0.0334(10) Uani 1 1 d . . .
C27 C 0.6709(5) 0.5821(3) 0.3270(3) 0.0402(11) Uani 1 1 d . . .
H27 H 0.7318 0.5732 0.3037 0.048 Uiso 1 1 calc R . .
C28 C 0.5743(5) 0.4998(3) 0.3364(3) 0.0418(11) Uani 1 1 d . . .
C29 C 0.4890(4) 0.5144(3) 0.3744(3) 0.0396(11) Uani 1 1 d . . .
H29 H 0.4245 0.4595 0.3838 0.048 Uiso 1 1 calc R . .
C30 C 0.4951(4) 0.6079(3) 0.3993(3) 0.0329(10) Uani 1 1 d . . .
C31 C 0.8012(4) 0.7582(4) 0.3430(4) 0.0486(13) Uani 1 1 d . . .
H31A H 0.8628 0.7316 0.3418 0.073 Uiso 1 1 calc R . .
H31B H 0.8315 0.8098 0.3925 0.073 Uiso 1 1 calc R . .
H31C H 0.7852 0.7849 0.2901 0.073 Uiso 1 1 calc R . .
C32 C 0.5645(6) 0.3981(4) 0.3079(4) 0.0610(16) Uani 1 1 d . . .
H32A H 0.5102 0.3515 0.3364 0.092 Uiso 1 1 calc R . .
H32B H 0.6458 0.3968 0.3235 0.092 Uiso 1 1 calc R . .
H32C H 0.5310 0.3807 0.2457 0.092 Uiso 1 1 calc R . .
C33 C 0.4020(4) 0.6136(3) 0.4461(3) 0.0410(11) Uani 1 1 d . . .
H33A H 0.3343 0.6201 0.4056 0.061 Uiso 1 1 calc R . .
H33B H 0.4412 0.6699 0.4918 0.061 Uiso 1 1 calc R . .
H33C H 0.3704 0.5543 0.4711 0.061 Uiso 1 1 calc R . .
C34 C 0.6781(4) 0.8948(3) 0.3456(3) 0.0304(9) Uani 1 1 d . . .
C35 C 0.6350(4) 0.8730(3) 0.2538(3) 0.0356(10) Uani 1 1 d . . .
C36 C 0.7019(4) 0.9369(4) 0.2049(3) 0.0445(12) Uani 1 1 d . . .
H36 H 0.6732 0.9231 0.1443 0.053 Uiso 1 1 calc R . .
C37 C 0.8076(5) 1.0190(4) 0.2416(3) 0.0450(12) Uani 1 1 d . . .
C38 C 0.8494(4) 1.0369(3) 0.3313(3) 0.0423(11) Uani 1 1 d . . .
H38 H 0.9230 1.0917 0.3573 0.051 Uiso 1 1 calc R . .
C39 C 0.7875(4) 0.9777(3) 0.3842(3) 0.0310(9) Uani 1 1 d . . .
C40 C 0.5236(4) 0.7840(4) 0.2034(3) 0.0442(12) Uani 1 1 d . . .
H40A H 0.5345 0.7683 0.1468 0.066 Uiso 1 1 calc R . .
H40B H 0.4501 0.7977 0.1966 0.066 Uiso 1 1 calc R . .
H40C H 0.5146 0.7288 0.2344 0.066 Uiso 1 1 calc R . .
C41 C 0.8748(5) 1.0882(5) 0.1863(4) 0.0699(18) Uani 1 1 d . . .
H41A H 0.8851 1.0508 0.1390 0.105 Uiso 1 1 calc R . .
H41B H 0.9553 1.1334 0.2214 0.105 Uiso 1 1 calc R . .
H41C H 0.8270 1.1248 0.1630 0.105 Uiso 1 1 calc R . .
C42 C 0.8452(4) 1.0075(3) 0.4805(3) 0.0436(12) Uani 1 1 d . . .
H42A H 0.9264 1.0603 0.4908 0.065 Uiso 1 1 calc R . .
H42B H 0.8529 0.9517 0.5052 0.065 Uiso 1 1 calc R . .
H42C H 0.7932 1.0295 0.5073 0.065 Uiso 1 1 calc R . .
C43 C 0.4300(4) 0.8062(3) 0.3647(3) 0.0277(9) Uani 1 1 d . . .
C44 C 0.3552(4) 0.8202(3) 0.4276(3) 0.0288(9) Uani 1 1 d . . .
C45 C 0.2246(5) 0.7960(4) 0.3758(4) 0.0451(12) Uani 1 1 d . . .
C46 C 0.9606(7) 0.4613(7) 0.7703(6) 0.121(4) Uani 1 1 d D . .
C47 C 0.8893(8) 0.5147(6) 0.7466(5) 0.093(2) Uani 1 1 d D . .
H47 H 0.9065 0.5575 0.7059 0.112 Uiso 1 1 calc R . .
C48 C 0.7919(10) 0.5036(7) 0.7841(7) 0.125(4) Uani 1 1 d D . .
H48 H 0.7410 0.5372 0.7668 0.150 Uiso 1 1 calc R . .
C49 C 0.7702(9) 0.4460(7) 0.8442(7) 0.112(3) Uani 1 1 d D . .
H49 H 0.7062 0.4400 0.8710 0.134 Uiso 1 1 calc R . .
C50 C 0.8408(13) 0.3975(9) 0.8654(8) 0.160(5) Uani 1 1 d D . .
H50 H 0.8253 0.3571 0.9081 0.192 Uiso 1 1 calc R . .
C51 C 0.9305(11) 0.4021(7) 0.8307(6) 0.123(4) Uani 1 1 d D . .
H51 H 0.9755 0.3639 0.8476 0.148 Uiso 1 1 calc R . .
C52 C 1.0575(9) 0.4633(9) 0.7345(7) 0.229(8) Uani 1 1 d D . .
H52A H 1.0951 0.4219 0.7621 0.343 Uiso 1 1 calc R . .
H52B H 1.1190 0.5301 0.7438 0.343 Uiso 1 1 calc R . .
H52C H 1.0254 0.4392 0.6729 0.343 Uiso 1 1 calc R . .
C53 C 0.4154(12) 0.4327(9) 0.9510(8) 0.055(3) Uiso 0.50 1 d PD A -1
C54 C 0.5021(11) 0.4933(9) 0.9123(8) 0.057(3) Uiso 0.50 1 d PD A -1
H54 H 0.4908 0.4791 0.8523 0.068 Uiso 0.50 1 calc PR A -1
C55 C 0.6042(13) 0.5737(10) 0.9591(9) 0.072(4) Uiso 0.50 1 d PD A -1
H55 H 0.6603 0.6136 0.9306 0.086 Uiso 0.50 1 calc PR A -1
C56 C 0.6243(16) 0.5954(13) 1.0449(10) 0.097(6) Uiso 0.50 1 d PD A -1
H56 H 0.6943 0.6502 1.0767 0.116 Uiso 0.50 1 calc PR A -1
C57 C 0.5422(15) 0.5375(12) 1.0855(11) 0.094(5) Uiso 0.50 1 d PD A -1
H57 H 0.5566 0.5523 1.1458 0.113 Uiso 0.50 1 calc PR A -1
C58 C 0.4404(14) 0.4590(11) 1.0410(8) 0.082(5) Uiso 0.50 1 d PD A -1
H58 H 0.3849 0.4210 1.0709 0.099 Uiso 0.50 1 calc PR A -1
C59 C 0.3075(12) 0.3536(10) 0.9029(9) 0.098(5) Uiso 0.50 1 d PD A -1
H59A H 0.3214 0.3313 0.8494 0.147 Uiso 0.50 1 calc PR A -1
H59B H 0.2399 0.3747 0.8896 0.147 Uiso 0.50 1 calc PR A -1
H59C H 0.2868 0.3004 0.9364 0.147 Uiso 0.50 1 calc PR A -1
C60 C -0.0086(11) 0.4270(9) 0.4917(9) 0.070(4) Uiso 0.50 1 d PD B -1
C61 C 0.1057(12) 0.5054(8) 0.5138(9) 0.064(3) Uiso 0.50 1 d PD B -1
H61 H 0.1781 0.4940 0.5196 0.077 Uiso 0.50 1 calc PR B -1
C62 C 0.1139(13) 0.6009(10) 0.5274(10) 0.081(4) Uiso 0.50 1 d PD B -1
H62 H 0.1919 0.6535 0.5439 0.097 Uiso 0.50 1 calc PR B -1
C63 C 0.0102(14) 0.6191(12) 0.5170(12) 0.088(5) Uiso 0.50 1 d PD B -1
H63 H 0.0163 0.6839 0.5244 0.105 Uiso 0.50 1 calc PR B -1
C64 C -0.1024(13) 0.5426(10) 0.4958(9) 0.076(4) Uiso 0.50 1 d PD B -1
H64 H -0.1742 0.5549 0.4894 0.091 Uiso 0.50 1 calc PR B -1
C65 C -0.1123(11) 0.4481(9) 0.4838(8) 0.054(3) Uiso 0.50 1 d PD B -1
H65 H -0.1910 0.3963 0.4699 0.065 Uiso 0.50 1 calc PR B -1
C66 C -0.0194(15) 0.3282(9) 0.4767(13) 0.107(6) Uiso 0.50 1 d PD B -1
H66A H -0.1042 0.2834 0.4712 0.161 Uiso 0.50 1 calc PR B -1
H66B H 0.0347 0.3166 0.5249 0.161 Uiso 0.50 1 calc PR B -1
H66C H 0.0039 0.3176 0.4238 0.161 Uiso 0.50 1 calc PR B -1
H43A H 0.438(4) 0.859(3) 0.329(3) 0.029(11) Uiso 1 1 d . . .
H43B H 0.380(4) 0.745(3) 0.326(3) 0.041(13) Uiso 1 1 d . . .
H44 H 0.357(3) 0.776(3) 0.472(2) 0.020(10) Uiso 1 1 d . . .
H45A H 0.182(4) 0.729(4) 0.351(3) 0.044(13) Uiso 1 1 d . . .
H45B H 0.176(4) 0.809(3) 0.409(3) 0.039(13) Uiso 1 1 d . . .
H45C H 0.218(5) 0.829(4) 0.330(4) 0.062(18) Uiso 1 1 d . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Zn Zn 0.2839 1.4301 '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'
O O 0.0106 0.0060 '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'
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'
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
N1 Zn1 O1 128.97(13) . 2_676
N1 Zn1 O1 137.59(13) . .
O1 Zn1 O1 80.90(12) 2_676 .
N1 Zn1 N2 85.00(13) . .
O1 Zn1 N2 128.24(12) 2_676 .
O1 Zn1 N2 98.75(12) . .
N1 Zn1 Zn1 153.99(10) . 2_676
O1 Zn1 Zn1 40.68(8) 2_676 2_676
O1 Zn1 Zn1 40.23(8) . 2_676
N2 Zn1 Zn1 120.35(9) . 2_676
N1 P1 C10 114.07(19) . .
N1 P1 C1 106.97(18) . .
C10 P1 C1 105.72(19) . .
N2 P2 C34 114.59(19) . .
N2 P2 C43 107.22(18) . .
C34 P2 C43 103.2(2) . .
N2 P2 C25 114.24(18) . .
C34 P2 C25 107.47(18) . .
C43 P2 C25 109.5(2) . .
C44 O1 Zn1 132.9(2) . 2_676
C44 O1 Zn1 116.6(2) . .
Zn1 O1 Zn1 99.10(12) 2_676 .
C19 N1 P1 129.2(3) . .
C19 N1 Zn1 111.8(2) . .
P1 N1 Zn1 118.56(18) . .
C24 N2 P2 129.0(3) . .
C24 N2 Zn1 108.8(2) . .
P2 N2 Zn1 121.96(18) . .
C6 C1 C2 118.1(4) . .
C6 C1 P1 129.0(4) . .
C2 C1 P1 112.6(3) . .
C3 C2 C1 119.8(4) . .
C3 C2 C7 118.1(5) . .
C1 C2 C7 122.1(4) . .
C2 C3 C4 122.3(5) . .
C5 C4 C3 117.5(4) . .
C5 C4 C8 121.5(5) . .
C3 C4 C8 120.9(6) . .
C4 C5 C6 123.2(5) . .
C5 C6 C1 119.0(5) . .
C5 C6 C9 114.9(4) . .
C1 C6 C9 126.0(4) . .
C11 C10 C15 117.8(4) . .
C11 C10 P1 128.4(3) . .
C15 C10 P1 113.1(3) . .
C12 C11 C10 119.1(4) . .
C12 C11 C16 116.3(5) . .
C10 C11 C16 124.5(4) . .
C13 C12 C11 122.9(5) . .
C14 C13 C12 117.9(5) . .
C14 C13 C17 121.0(6) . .
C12 C13 C17 121.1(6) . .
C13 C14 C15 122.2(5) . .
C14 C15 C10 120.0(5) . .
C14 C15 C18 116.9(4) . .
C10 C15 C18 123.1(4) . .
C20 C19 N1 124.1(4) . .
C20 C19 C24 117.8(4) . .
N1 C19 C24 118.1(3) . .
C21 C20 C19 122.0(4) . .
C22 C21 C20 119.9(4) . .
C21 C22 C23 119.7(4) . .
C24 C23 C22 121.5(4) . .
C23 C24 N2 125.6(4) . .
C23 C24 C19 118.7(4) . .
N2 C24 C19 115.7(3) . .
C30 C25 C26 118.8(4) . .
C30 C25 P2 118.3(3) . .
C26 C25 P2 122.8(3) . .
C27 C26 C25 118.0(4) . .
C27 C26 C31 115.7(4) . .
C25 C26 C31 126.2(4) . .
C28 C27 C26 123.5(4) . .
C29 C28 C27 117.3(4) . .
C29 C28 C32 121.6(5) . .
C27 C28 C32 121.1(4) . .
C28 C29 C30 122.3(4) . .
C29 C30 C25 119.5(4) . .
C29 C30 C33 116.7(4) . .
C25 C30 C33 123.7(4) . .
C39 C34 C35 119.5(4) . .
C39 C34 P2 122.9(3) . .
C35 C34 P2 117.7(3) . .
C36 C35 C34 118.3(4) . .
C36 C35 C40 116.3(4) . .
C34 C35 C40 125.4(4) . .
C37 C36 C35 122.9(4) . .
C36 C37 C38 117.5(4) . .
C36 C37 C41 121.2(5) . .
C38 C37 C41 121.3(5) . .
C39 C38 C37 123.0(4) . .
C38 C39 C34 118.8(4) . .
C38 C39 C42 116.4(4) . .
C34 C39 C42 124.8(4) . .
C44 C43 P2 119.4(3) . .
O1 C44 C45 110.8(3) . .
O1 C44 C43 112.1(3) . .
C45 C44 C43 108.4(4) . .
C51 C46 C47 116.8(8) . .
C51 C46 C52 119.0(10) . .
C47 C46 C52 124.1(10) . .
C46 C47 C48 118.9(8) . .
C49 C48 C47 120.7(9) . .
C50 C49 C48 118.3(10) . .
C51 C50 C49 124.0(11) . .
C50 C51 C46 121.2(10) . .
C54 C53 C58 115.0(11) . .
C54 C53 C59 122.3(10) . .
C58 C53 C59 122.6(12) . .
C55 C54 C53 122.0(11) . .
C56 C55 C54 120.7(14) . .
C55 C56 C57 119.2(16) . .
C58 C57 C56 121.4(15) . .
C57 C58 C53 121.7(13) . .
C61 C60 C65 117.4(10) . .
C61 C60 C66 121.4(11) . .
C65 C60 C66 121.2(11) . .
C60 C61 C62 120.3(12) . .
C63 C62 C61 120.7(13) . .
C62 C63 C64 119.4(15) . .
C63 C64 C65 120.8(13) . .
C64 C65 C60 121.3(11) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Zn1 N1 1.940(3) .
Zn1 O1 1.965(3) 2_676
Zn1 O1 1.984(3) .
Zn1 N2 2.058(3) .
Zn1 Zn1 3.0051(10) 2_676
P1 N1 1.681(3) .
P1 C10 1.853(4) .
P1 C1 1.865(4) .
P2 N2 1.602(3) .
P2 C34 1.834(4) .
P2 C43 1.838(4) .
P2 C25 1.842(4) .
O1 C44 1.415(5) .
O1 Zn1 1.965(3) 2_676
N1 C19 1.400(5) .
N2 C24 1.412(5) .
C1 C6 1.416(6) .
C1 C2 1.417(6) .
C2 C3 1.386(6) .
C2 C7 1.501(7) .
C3 C4 1.392(7) .
C4 C5 1.365(7) .
C4 C8 1.525(7) .
C5 C6 1.398(6) .
C6 C9 1.520(7) .
C10 C11 1.408(6) .
C10 C15 1.423(6) .
C11 C12 1.390(7) .
C11 C16 1.521(6) .
C12 C13 1.383(8) .
C13 C14 1.362(8) .
C13 C17 1.525(8) .
C14 C15 1.391(7) .
C15 C18 1.505(7) .
C19 C20 1.396(6) .
C19 C24 1.424(5) .
C20 C21 1.383(6) .
C21 C22 1.366(6) .
C22 C23 1.393(6) .
C23 C24 1.390(6) .
C25 C30 1.408(6) .
C25 C26 1.423(6) .
C26 C27 1.395(6) .
C26 C31 1.511(6) .
C27 C28 1.380(6) .
C28 C29 1.379(6) .
C28 C32 1.509(6) .
C29 C30 1.395(6) .
C30 C33 1.503(6) .
C34 C39 1.407(6) .
C34 C35 1.422(6) .
C35 C36 1.396(6) .
C35 C40 1.510(6) .
C36 C37 1.372(7) .
C37 C38 1.389(7) .
C37 C41 1.514(6) .
C38 C39 1.384(6) .
C39 C42 1.511(6) .
C43 C44 1.542(6) .
C44 C45 1.511(7) .
C46 C51 1.362(11) .
C46 C47 1.392(11) .
C46 C52 1.401(10) .
C47 C48 1.392(11) .
C48 C49 1.332(11) .
C49 C50 1.319(12) .
C50 C51 1.302(12) .
C53 C54 1.389(14) .
C53 C58 1.405(13) .
C53 C59 1.407(14) .
C54 C55 1.377(14) .
C55 C56 1.339(14) .
C56 C57 1.359(16) .
C57 C58 1.351(15) .
C60 C61 1.386(13) .
C60 C65 1.386(13) .
C60 C66 1.429(14) .
C61 C62 1.389(14) .
C62 C63 1.358(15) .
C63 C64 1.360(15) .
C64 C65 1.366(14) .
