#------------------------------------------------------------------------------
#$Date: 2016-03-23 20:25:45 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179411 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/08/4330830.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_4330830
loop_
_publ_author_name
'Shigehisa Akine'
'Toshio Tadokoro'
'Tatsuya Nabeshima'
_publ_contact_author_address
;
Tsukuba, Ibaraki 305-8571, Japan
;
_publ_contact_author_email       akine@chem.tsukuba.ac.jp
_publ_contact_author_fax         +81-29-853-4527
_publ_contact_author_name        'Shigehisa Akine'
_publ_contact_author_phone       +81-29-853-4527
_publ_section_title
;
 Oligometallic Template Strategy for Synthesis of a Macrocyclic Dimer-Type
 Octaoxime Ligand for Its Cooperative Complexation
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              11478
_journal_page_last               11486
_journal_paper_doi               10.1021/ic3012525
_journal_volume                  51
_journal_year                    2012
_chemical_formula_moiety         'C38 H40 N4 O14 Sr Zn2, 2(C H Cl3)'
_chemical_formula_sum            'C40 H42 Cl6 N4 O14 Sr Zn2'
_chemical_formula_weight         1233.84
_chemical_name_common            '[LZn2Sr(OAc)2]_2CHCL3'
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 117.1231(19)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   24.5784(14)
_cell_length_b                   12.7449(7)
_cell_length_c                   17.2856(9)
_cell_measurement_reflns_used    22718
_cell_measurement_temperature    120
_cell_measurement_theta_max      27.45
_cell_measurement_theta_min      3.20
_cell_volume                     4819.2(5)
_computing_cell_refinement       'Rapid AUTO (Rigaku Corp.)'
_computing_data_collection       'Rapid AUTO (Rigaku Corp.)'
_computing_data_reduction        'Rapid AUTO (Rigaku Corp.)'
_computing_molecular_graphics    ORTEP-3
_computing_publication_material  ORTEP-3
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'DIRDIF99 (Beurskens et al., 1999)'
_diffrn_ambient_temperature      120
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Rigaku R-AXIS Rapid'
_diffrn_measurement_method       IP
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0393
_diffrn_reflns_av_sigmaI/netI    0.0300
_diffrn_reflns_limit_h_max       26
_diffrn_reflns_limit_h_min       -31
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            22718
_diffrn_reflns_theta_full        27.45
_diffrn_reflns_theta_max         27.45
_diffrn_reflns_theta_min         3.20
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    2.491
_exptl_absorpt_correction_T_max  0.6357
_exptl_absorpt_correction_T_min  0.3690
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Rapid AUTO (Rigaku Corp.)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.701
_exptl_crystal_description       prismatic
_exptl_crystal_F_000             2488
_exptl_crystal_size_max          0.50
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.20
_refine_diff_density_max         1.802
_refine_diff_density_min         -1.121
_refine_diff_density_rms         0.110
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.057
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     305
_refine_ls_number_reflns         5493
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.057
_refine_ls_R_factor_all          0.0464
_refine_ls_R_factor_gt           0.0417
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0659P)²+18.1885P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1165
_refine_ls_wR_factor_ref         0.1203
_reflns_number_gt                4981
_reflns_number_total             5493
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic3012525_si_001_1.cif
_cod_data_source_block           LZn2Sr
_cod_database_code               4330830
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Sr1 Sr 0.0000 0.49082(3) 0.2500 0.01849(11) Uani 1 2 d S
Zn1 Zn 0.109056(15) 0.36781(3) 0.43788(2) 0.01816(11) Uani 1 1 d .
C1 C 0.08241(14) 0.5538(2) 0.5567(2) 0.0228(6) Uani 1 1 d .
C2 C 0.05286(13) 0.5620(2) 0.46590(19) 0.0202(6) Uani 1 1 d .
C3 C 0.02553(14) 0.6607(2) 0.4301(2) 0.0227(6) Uani 1 1 d .
C4 C 0.03243(15) 0.7463(2) 0.4818(2) 0.0258(6) Uani 1 1 d .
H1 H 0.0154 0.8118 0.4558 0.031 Uiso 1 1 calc R
C5 C 0.06449(16) 0.7383(2) 0.5733(2) 0.0268(6) Uani 1 1 d .
C6 C 0.08686(16) 0.6420(3) 0.6092(2) 0.0262(7) Uani 1 1 d .
H2 H 0.1058 0.6343 0.6706 0.031 Uiso 1 1 calc R
O1 O 0.04742(10) 0.48524(16) 0.41291(14) 0.0214(4) Uani 1 1 d .
O2 O -0.00609(10) 0.66031(17) 0.34008(14) 0.0252(5) Uani 1 1 d .
C7 C -0.04491(15) 0.7494(2) 0.3000(2) 0.0281(7) Uani 1 1 d .
H3 H -0.0733 0.7588 0.3248 0.042 Uiso 1 1 calc R
H4 H -0.0681 0.7375 0.2372 0.042 Uiso 1 1 calc R
H5 H -0.0197 0.8125 0.3106 0.042 Uiso 1 1 calc R
C8 C 0.07465(18) 0.8364(3) 0.6279(2) 0.0321(7) Uani 1 1 d .
H6 H 0.0345 0.8661 0.6168 0.039 Uiso 1 1 calc R
H7 H 0.0966 0.8173 0.6902 0.039 Uiso 1 1 calc R
C9 C 0.11012(19) 0.9173(3) 0.6093(2) 0.0352(8) Uani 1 1 d .
H8 H 0.1488 0.8971 0.6143 0.042 Uiso 1 1 calc R
C10 C 0.0930(3) 1.0136(3) 0.5867(3) 0.0537(12) Uani 1 1 d .
H9 H 0.0547 1.0371 0.5810 0.064 Uiso 1 1 calc R
H10 H 0.1188 1.0605 0.5759 0.064 Uiso 1 1 calc R
C11 C 0.10984(15) 0.4569(3) 0.6009(2) 0.0238(6) Uani 1 1 d .
H11 H 0.1174 0.4493 0.6596 0.029 Uiso 1 1 calc R
N1 N 0.12463(12) 0.3805(2) 0.56593(17) 0.0228(5) Uani 1 1 d .
O3 O 0.14548(11) 0.29131(18) 0.62313(15) 0.0283(5) Uani 1 1 d .
C12 C 0.20951(16) 0.2739(3) 0.6538(2) 0.0296(7) Uani 1 1 d .
H12 H 0.2221 0.2133 0.6940 0.036 Uiso 1 1 calc R
H13 H 0.2320 0.3362 0.6873 0.036 Uiso 1 1 calc R
C13 C 0.22840(14) 0.2530(3) 0.5830(2) 0.0251(6) Uani 1 1 d .
H14 H 0.2217 0.3172 0.5475 0.030 Uiso 1 1 calc R
H15 H 0.2726 0.2364 0.6100 0.030 Uiso 1 1 calc R
O4 O 0.19467(10) 0.16802(18) 0.52771(14) 0.0265(5) Uani 1 1 d .
N2 N 0.14036(12) 0.2050(2) 0.45560(16) 0.0216(5) Uani 1 1 d .
C14 C 0.11093(15) 0.1261(2) 0.4086(2) 0.0231(6) Uani 1 1 d .
H16 H 0.1277 0.0585 0.4285 0.028 Uiso 1 1 calc R
C15 C 0.05465(14) 0.1312(2) 0.3283(2) 0.0213(6) Uani 1 1 d .
C16 C 0.02793(13) 0.2272(2) 0.29010(19) 0.0196(6) Uani 1 1 d .
C17 C 0.02667(16) 0.0357(2) 0.2879(2) 0.0261(6) Uani 1 1 d .
H17 H 0.0451 -0.0290 0.3138 0.031 Uiso 1 1 calc R
O5 O 0.05056(10) 0.31945(16) 0.32139(14) 0.0233(4) Uani 1 1 d .
O6 O 0.11354(10) 0.51554(18) 0.29801(14) 0.0241(5) Uani 1 1 d .
O7 O 0.17593(9) 0.44408(17) 0.42676(14) 0.0226(4) Uani 1 1 d .
C18 C 0.16500(14) 0.4988(2) 0.3591(2) 0.0215(6) Uani 1 1 d .
C19 C 0.22061(16) 0.5447(3) 0.3549(2) 0.0370(8) Uani 1 1 d .
H18 H 0.2188 0.5282 0.2984 0.056 Uiso 1 1 calc R
H19 H 0.2578 0.5144 0.4013 0.056 Uiso 1 1 calc R
H20 H 0.2211 0.6210 0.3621 0.056 Uiso 1 1 calc R
Cl1 Cl 0.21679(6) 0.65152(11) 0.59582(10) 0.0635(3) Uani 1 1 d .
Cl2 Cl 0.32681(5) 0.66191(9) 0.57249(7) 0.0486(3) Uani 1 1 d .
Cl3 Cl 0.31986(6) 0.52236(10) 0.69951(7) 0.0540(3) Uani 1 1 d .
C20 C 0.27780(18) 0.5801(4) 0.5967(3) 0.0425(9) Uani 1 1 d .
H21 H 0.2612 0.5233 0.5519 0.051 Uiso 1 1 calc R
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sr Sr -1.5307 3.2498 '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'
Cl Cl 0.1484 0.1585 '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
O1 Sr1 O1 176.75(9) 2 .
O1 Sr1 O5 63.65(7) 2 2
O1 Sr1 O5 113.27(7) . 2
O1 Sr1 O5 113.27(7) 2 .
O1 Sr1 O5 63.65(7) . .
O5 Sr1 O5 61.20(10) 2 .
O1 Sr1 O6 104.41(7) 2 .
O1 Sr1 O6 76.00(7) . .
O5 Sr1 O6 119.12(7) 2 .
O5 Sr1 O6 74.13(7) . .
O1 Sr1 O6 76.00(7) 2 2
O1 Sr1 O6 104.41(7) . 2
O5 Sr1 O6 74.13(7) 2 2
O5 Sr1 O6 119.12(7) . 2
O6 Sr1 O6 165.76(10) . 2
O1 Sr1 O2 123.29(7) 2 .
O1 Sr1 O2 59.76(7) . .
O5 Sr1 O2 145.43(7) 2 .
O5 Sr1 O2 123.40(7) . .
O6 Sr1 O2 93.08(7) . .
O6 Sr1 O2 75.44(7) 2 .
O1 Sr1 O2 59.76(7) 2 2
O1 Sr1 O2 123.29(7) . 2
O5 Sr1 O2 123.40(7) 2 2
O5 Sr1 O2 145.43(7) . 2
O6 Sr1 O2 75.44(7) . 2
O6 Sr1 O2 93.08(7) 2 2
O2 Sr1 O2 74.10(10) . 2
O1 Sr1 Zn1 34.81(5) 2 2
O1 Sr1 Zn1 142.72(5) . 2
O5 Sr1 Zn1 33.41(5) 2 2
O5 Sr1 Zn1 93.66(5) . 2
O6 Sr1 Zn1 128.36(5) . 2
O6 Sr1 Zn1 59.36(5) 2 2
O2 Sr1 Zn1 132.18(5) . 2
O2 Sr1 Zn1 92.49(5) 2 2
O1 Sr1 Zn1 142.72(5) 2 .
O1 Sr1 Zn1 34.81(5) . .
O5 Sr1 Zn1 93.66(5) 2 .
O5 Sr1 Zn1 33.41(5) . .
O6 Sr1 Zn1 59.36(5) . .
O6 Sr1 Zn1 128.36(5) 2 .
O2 Sr1 Zn1 92.49(5) . .
O2 Sr1 Zn1 132.18(5) 2 .
Zn1 Sr1 Zn1 126.783(15) 2 .
O5 Zn1 O7 107.72(9) . .
O5 Zn1 O1 83.51(9) . .
O7 Zn1 O1 100.84(9) . .
O5 Zn1 N1 144.20(10) . .
O7 Zn1 N1 107.82(10) . .
O1 Zn1 N1 85.78(10) . .
O5 Zn1 N2 83.81(9) . .
O7 Zn1 N2 102.91(9) . .
O1 Zn1 N2 155.54(9) . .
N1 Zn1 N2 92.43(10) . .
O5 Zn1 Sr1 45.31(6) . .
O7 Zn1 Sr1 90.48(6) . .
O1 Zn1 Sr1 44.87(6) . .
N1 Zn1 Sr1 130.25(7) . .
N2 Zn1 Sr1 128.83(7) . .
C2 C1 C6 120.5(3) . .
C2 C1 C11 122.2(3) . .
C6 C1 C11 117.3(3) . .
O1 C2 C1 124.5(3) . .
O1 C2 C3 118.6(3) . .
C1 C2 C3 116.9(3) . .
C4 C3 O2 125.0(3) . .
C4 C3 C2 121.6(3) . .
O2 C3 C2 113.3(3) . .
C3 C4 C5 120.8(3) . .
C3 C4 H1 119.6 . .
C5 C4 H1 119.6 . .
C6 C5 C4 118.3(3) . .
C6 C5 C8 122.6(3) . .
C4 C5 C8 119.1(3) . .
C5 C6 C1 121.5(3) . .
C5 C6 H2 119.2 . .
C1 C6 H2 119.2 . .
C2 O1 Zn1 125.14(19) . .
C2 O1 Sr1 127.80(19) . .
Zn1 O1 Sr1 100.32(8) . .
C3 O2 C7 116.5(2) . .
C3 O2 Sr1 119.91(17) . .
C7 O2 Sr1 123.38(18) . .
O2 C7 H3 109.5 . .
O2 C7 H4 109.5 . .
H3 C7 H4 109.5 . .
O2 C7 H5 109.5 . .
H3 C7 H5 109.5 . .
H4 C7 H5 109.5 . .
C9 C8 C5 112.7(3) . .
C9 C8 H6 109.1 . .
C5 C8 H6 109.1 . .
C9 C8 H7 109.1 . .
C5 C8 H7 109.1 . .
H6 C8 H7 107.8 . .
C10 C9 C8 125.6(4) . .
C10 C9 H8 117.2 . .
C8 C9 H8 117.2 . .
C9 C10 H9 120.0 . .
C9 C10 H10 120.0 . .
H9 C10 H10 120.0 . .
N1 C11 C1 124.3(3) . .
N1 C11 H11 117.8 . .
C1 C11 H11 117.8 . .
C11 N1 O3 111.4(2) . .
C11 N1 Zn1 127.4(2) . .
O3 N1 Zn1 120.44(18) . .
C12 O3 N1 111.4(2) . .
O3 C12 C13 114.7(3) . .
O3 C12 H12 108.6 . .
C13 C12 H12 108.6 . .
O3 C12 H13 108.6 . .
C13 C12 H13 108.6 . .
H12 C12 H13 107.6 . .
O4 C13 C12 111.9(3) . .
O4 C13 H14 109.2 . .
C12 C13 H14 109.2 . .
O4 C13 H15 109.2 . .
C12 C13 H15 109.2 . .
H14 C13 H15 107.9 . .
N2 O4 C13 111.0(2) . .
C14 N2 O4 109.0(2) . .
C14 N2 Zn1 126.3(2) . .
O4 N2 Zn1 124.39(18) . .
N2 C14 C15 125.9(3) . .
N2 C14 H16 117.0 . .
C15 C14 H16 117.0 . .
C16 C15 C17 120.0(3) . .
C16 C15 C14 121.9(3) . .
C17 C15 C14 118.2(3) . .
O5 C16 C15 124.7(3) . .
O5 C16 C16 115.94(16) . 2
C15 C16 C16 119.31(18) . 2
C17 C17 C15 120.71(18) 2 .
C17 C17 H17 119.6 2 .
C15 C17 H17 119.6 . .
C16 O5 Zn1 132.86(19) . .
C16 O5 Sr1 123.45(18) . .
Zn1 O5 Sr1 101.28(8) . .
C18 O6 Sr1 142.9(2) . .
C18 O7 Zn1 121.0(2) . .
O6 C18 O7 125.3(3) . .
O6 C18 C19 118.9(3) . .
O7 C18 C19 115.8(3) . .
C18 C19 H18 109.5 . .
C18 C19 H19 109.5 . .
H18 C19 H19 109.5 . .
C18 C19 H20 109.5 . .
H18 C19 H20 109.5 . .
H19 C19 H20 109.5 . .
Cl1 C20 Cl3 109.4(2) . .
Cl1 C20 Cl2 111.2(2) . .
Cl3 C20 Cl2 109.5(2) . .
Cl1 C20 H21 108.9 . .
Cl3 C20 H21 108.9 . .
Cl2 C20 H21 108.9 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Sr1 O1 2.510(2) 2
Sr1 O1 2.510(2) .
Sr1 O5 2.538(2) 2
Sr1 O5 2.538(2) .
Sr1 O6 2.542(2) .
Sr1 O6 2.542(2) 2
Sr1 O2 2.707(2) .
Sr1 O2 2.707(2) 2
Sr1 Zn1 3.5003(4) 2
Sr1 Zn1 3.5003(4) .
Zn1 O5 1.965(2) .
Zn1 O7 1.993(2) .
Zn1 O1 2.031(2) .
Zn1 N1 2.074(3) .
Zn1 N2 2.185(3) .
C1 C2 1.401(4) .
C1 C6 1.416(4) .
C1 C11 1.447(4) .
C2 O1 1.305(4) .
C2 C3 1.427(4) .
C3 C4 1.371(4) .
C3 O2 1.386(4) .
C4 C5 1.413(5) .
C4 H1 0.9500 .
C5 C6 1.372(5) .
C5 C8 1.518(4) .
C6 H2 0.9500 .
O2 C7 1.441(3) .
C7 H3 0.9800 .
C7 H4 0.9800 .
C7 H5 0.9800 .
C8 C9 1.477(5) .
C8 H6 0.9900 .
C8 H7 0.9900 .
C9 C10 1.298(6) .
C9 H8 0.9500 .
C10 H9 0.9500 .
C10 H10 0.9500 .
C11 N1 1.282(4) .
C11 H11 0.9500 .
N1 O3 1.439(3) .
O3 C12 1.431(4) .
C12 C13 1.517(4) .
C12 H12 0.9900 .
C12 H13 0.9900 .
C13 O4 1.432(4) .
C13 H14 0.9900 .
C13 H15 0.9900 .
O4 N2 1.429(3) .
N2 C14 1.287(4) .
C14 C15 1.447(4) .
C14 H16 0.9500 .
C15 C16 1.403(4) .
C15 C17 1.415(4) .
C16 O5 1.308(4) .
C16 C16 1.439(6) 2
C17 C17 1.368(7) 2
C17 H17 0.9500 .
O6 C18 1.242(4) .
O7 C18 1.281(4) .
C18 C19 1.519(4) .
C19 H18 0.9800 .
C19 H19 0.9800 .
C19 H20 0.9800 .
Cl1 C20 1.749(5) .
Cl2 C20 1.781(4) .
Cl3 C20 1.759(4) .
C20 H21 1.0000 .
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
O1 Sr1 Zn1 O5 -36.21(12) 2 .
O1 Sr1 Zn1 O5 140.21(13) . .
O5 Sr1 Zn1 O5 13.21(14) 2 .
O6 Sr1 Zn1 O5 -108.72(11) . .
O6 Sr1 Zn1 O5 85.83(11) 2 .
O2 Sr1 Zn1 O5 159.18(11) . .
O2 Sr1 Zn1 O5 -130.12(12) 2 .
Zn1 Sr1 Zn1 O5 8.52(9) 2 .
O1 Sr1 Zn1 O7 78.62(10) 2 .
O1 Sr1 Zn1 O7 -104.97(11) . .
O5 Sr1 Zn1 O7 128.04(8) 2 .
O5 Sr1 Zn1 O7 114.83(11) . .
O6 Sr1 Zn1 O7 6.11(9) . .
O6 Sr1 Zn1 O7 -159.34(9) 2 .
O2 Sr1 Zn1 O7 -85.99(8) . .
O2 Sr1 Zn1 O7 -15.30(9) 2 .
Zn1 Sr1 Zn1 O7 123.35(6) 2 .
O1 Sr1 Zn1 O1 -176.42(10) 2 .
O5 Sr1 Zn1 O1 -126.99(10) 2 .
O5 Sr1 Zn1 O1 -140.21(13) . .
O6 Sr1 Zn1 O1 111.07(10) . .
O6 Sr1 Zn1 O1 -54.38(11) 2 .
O2 Sr1 Zn1 O1 18.97(10) . .
O2 Sr1 Zn1 O1 89.67(11) 2 .
Zn1 Sr1 Zn1 O1 -131.68(9) 2 .
O1 Sr1 Zn1 N1 -167.30(12) 2 .
O1 Sr1 Zn1 N1 9.12(13) . .
O5 Sr1 Zn1 N1 -117.87(11) 2 .
O5 Sr1 Zn1 N1 -131.09(14) . .
O6 Sr1 Zn1 N1 120.19(12) . .
O6 Sr1 Zn1 N1 -45.26(12) 2 .
O2 Sr1 Zn1 N1 28.09(11) . .
O2 Sr1 Zn1 N1 98.79(12) 2 .
Zn1 Sr1 Zn1 N1 -122.56(10) 2 .
O1 Sr1 Zn1 N2 -28.46(12) 2 .
O1 Sr1 Zn1 N2 147.96(12) . .
O5 Sr1 Zn1 N2 20.97(10) 2 .
O5 Sr1 Zn1 N2 7.75(13) . .
O6 Sr1 Zn1 N2 -100.97(10) . .
O6 Sr1 Zn1 N2 93.58(11) 2 .
O2 Sr1 Zn1 N2 166.93(10) . .
O2 Sr1 Zn1 N2 -122.37(11) 2 .
Zn1 Sr1 Zn1 N2 16.27(9) 2 .
C6 C1 C2 O1 179.1(3) . .
C11 C1 C2 O1 -0.4(5) . .
C6 C1 C2 C3 -2.9(4) . .
C11 C1 C2 C3 177.6(3) . .
O1 C2 C3 C4 -176.2(3) . .
C1 C2 C3 C4 5.6(4) . .
O1 C2 C3 O2 2.1(4) . .
C1 C2 C3 O2 -176.1(3) . .
O2 C3 C4 C5 178.7(3) . .
C2 C3 C4 C5 -3.3(5) . .
C3 C4 C5 C6 -2.0(5) . .
C3 C4 C5 C8 176.0(3) . .
C4 C5 C6 C1 4.7(5) . .
C8 C5 C6 C1 -173.2(3) . .
C2 C1 C6 C5 -2.2(5) . .
C11 C1 C6 C5 177.3(3) . .
C1 C2 O1 Zn1 -31.7(4) . .
C3 C2 O1 Zn1 150.3(2) . .
C1 C2 O1 Sr1 -177.1(2) . .
C3 C2 O1 Sr1 4.9(4) . .
O5 Zn1 O1 C2 179.9(2) . .
O7 Zn1 O1 C2 -73.3(2) . .
N1 Zn1 O1 C2 34.1(2) . .
N2 Zn1 O1 C2 120.7(3) . .
Sr1 Zn1 O1 C2 -152.9(3) . .
O5 Zn1 O1 Sr1 -27.25(9) . .
O7 Zn1 O1 Sr1 79.61(9) . .
N1 Zn1 O1 Sr1 -173.03(10) . .
N2 Zn1 O1 Sr1 -86.4(2) . .
O5 Sr1 O1 C2 -148.0(2) 2 .
O5 Sr1 O1 C2 175.0(3) . .
O6 Sr1 O1 C2 96.0(2) . .
O6 Sr1 O1 C2 -69.3(2) 2 .
O2 Sr1 O1 C2 -6.1(2) . .
O2 Sr1 O1 C2 34.3(3) 2 .
Zn1 Sr1 O1 C2 -127.2(2) 2 .
Zn1 Sr1 O1 C2 151.8(3) . .
O5 Sr1 O1 Zn1 60.19(10) 2 .
O5 Sr1 O1 Zn1 23.16(7) . .
O6 Sr1 O1 Zn1 -55.83(8) . .
O6 Sr1 O1 Zn1 138.85(8) 2 .
O2 Sr1 O1 Zn1 -157.92(11) . .
O2 Sr1 O1 Zn1 -117.56(9) 2 .
Zn1 Sr1 O1 Zn1 80.93(11) 2 .
C4 C3 O2 C7 -13.8(4) . .
C2 C3 O2 C7 167.9(3) . .
C4 C3 O2 Sr1 171.0(2) . .
C2 C3 O2 Sr1 -7.2(3) . .
O1 Sr1 O2 C3 -174.63(19) 2 .
O1 Sr1 O2 C3 6.69(19) . .
O5 Sr1 O2 C3 94.4(2) 2 .
O5 Sr1 O2 C3 7.8(2) . .
O6 Sr1 O2 C3 -65.1(2) . .
O6 Sr1 O2 C3 123.4(2) 2 .
O2 Sr1 O2 C3 -139.1(2) 2 .
Zn1 Sr1 O2 C3 142.30(18) 2 .
Zn1 Sr1 O2 C3 -5.7(2) . .
O1 Sr1 O2 C7 10.6(2) 2 .
O1 Sr1 O2 C7 -168.1(2) . .
O5 Sr1 O2 C7 -80.4(2) 2 .
O5 Sr1 O2 C7 -167.0(2) . .
O6 Sr1 O2 C7 120.0(2) . .
O6 Sr1 O2 C7 -51.4(2) 2 .
O2 Sr1 O2 C7 46.12(19) 2 .
Zn1 Sr1 O2 C7 -32.5(2) 2 .
Zn1 Sr1 O2 C7 179.5(2) . .
C6 C5 C8 C9 117.6(4) . .
C4 C5 C8 C9 -60.4(5) . .
C5 C8 C9 C10 124.9(4) . .
C2 C1 C11 N1 19.6(5) . .
C6 C1 C11 N1 -159.9(3) . .
C1 C11 N1 O3 -174.5(3) . .
C1 C11 N1 Zn1 -4.5(5) . .
O5 Zn1 N1 C11 -89.5(3) . .
O7 Zn1 N1 C11 83.3(3) . .
O1 Zn1 N1 C11 -16.7(3) . .
N2 Zn1 N1 C11 -172.3(3) . .
Sr1 Zn1 N1 C11 -23.1(3) . .
O5 Zn1 N1 O3 79.8(3) . .
O7 Zn1 N1 O3 -107.4(2) . .
O1 Zn1 N1 O3 152.6(2) . .
N2 Zn1 N1 O3 -3.0(2) . .
Sr1 Zn1 N1 O3 146.12(17) . .
C11 N1 O3 C12 -111.0(3) . .
Zn1 N1 O3 C12 78.1(3) . .
N1 O3 C12 C13 -59.9(3) . .
O3 C12 C13 O4 -54.4(4) . .
C12 C13 O4 N2 90.3(3) . .
C13 O4 N2 C14 -178.8(2) . .
C13 O4 N2 Zn1 -4.8(3) . .
O5 Zn1 N2 C14 -17.1(3) . .
O7 Zn1 N2 C14 -123.9(2) . .
O1 Zn1 N2 C14 42.0(4) . .
N1 Zn1 N2 C14 127.2(3) . .
Sr1 Zn1 N2 C14 -22.7(3) . .
O5 Zn1 N2 O4 169.8(2) . .
O7 Zn1 N2 O4 63.0(2) . .
O1 Zn1 N2 O4 -131.0(2) . .
N1 Zn1 N2 O4 -45.9(2) . .
Sr1 Zn1 N2 O4 164.31(16) . .
O4 N2 C14 C15 -177.9(3) . .
Zn1 N2 C14 C15 8.2(4) . .
N2 C14 C15 C16 4.1(5) . .
N2 C14 C15 C17 -176.2(3) . .
C17 C15 C16 O5 -178.9(3) . .
C14 C15 C16 O5 0.8(5) . .
C17 C15 C16 C16 0.0(5) . 2
C14 C15 C16 C16 179.7(3) . 2
C16 C15 C17 C17 -0.5(6) . 2
C14 C15 C17 C17 179.8(4) . 2
C15 C16 O5 Zn1 -20.8(4) . .
C16 C16 O5 Zn1 160.3(2) 2 .
C15 C16 O5 Sr1 -179.7(2) . .
C16 C16 O5 Sr1 1.4(4) 2 .
O7 Zn1 O5 C16 125.5(3) . .
O1 Zn1 O5 C16 -135.1(3) . .
N1 Zn1 O5 C16 -61.7(3) . .
N2 Zn1 O5 C16 23.9(3) . .
Sr1 Zn1 O5 C16 -162.2(3) . .
O7 Zn1 O5 Sr1 -72.32(10) . .
O1 Zn1 O5 Sr1 27.03(9) . .
N1 Zn1 O5 Sr1 100.50(16) . .
N2 Zn1 O5 Sr1 -173.93(10) . .
O1 Sr1 O5 C16 -38.5(2) 2 .
O1 Sr1 O5 C16 140.3(2) . .
O5 Sr1 O5 C16 -0.52(16) 2 .
O6 Sr1 O5 C16 -137.7(2) . .
O6 Sr1 O5 C16 47.9(2) 2 .
O2 Sr1 O5 C16 139.2(2) . .
O2 Sr1 O5 C16 -108.5(2) 2 .
Zn1 Sr1 O5 C16 -8.8(2) 2 .
Zn1 Sr1 O5 C16 164.4(3) . .
O1 Sr1 O5 Zn1 157.07(8) 2 .
O1 Sr1 O5 Zn1 -24.06(8) . .
O5 Sr1 O5 Zn1 -164.91(16) 2 .
O6 Sr1 O5 Zn1 57.90(9) . .
O6 Sr1 O5 Zn1 -116.47(9) 2 .
O2 Sr1 O5 Zn1 -25.17(12) . .
O2 Sr1 O5 Zn1 87.07(13) 2 .
Zn1 Sr1 O5 Zn1 -173.17(7) 2 .
O1 Sr1 O6 C18 -153.3(3) 2 .
O1 Sr1 O6 C18 23.4(3) . .
O5 Sr1 O6 C18 -85.7(3) 2 .
O5 Sr1 O6 C18 -42.8(3) . .
O6 Sr1 O6 C18 116.8(3) 2 .
O2 Sr1 O6 C18 81.1(3) . .
O2 Sr1 O6 C18 153.8(3) 2 .
Zn1 Sr1 O6 C18 -124.7(3) 2 .
Zn1 Sr1 O6 C18 -9.9(3) . .
O5 Zn1 O7 C18 34.5(2) . .
O1 Zn1 O7 C18 -52.0(2) . .
N1 Zn1 O7 C18 -141.0(2) . .
N2 Zn1 O7 C18 122.1(2) . .
Sr1 Zn1 O7 C18 -8.1(2) . .
Sr1 O6 C18 O7 7.7(6) . .
Sr1 O6 C18 C19 -173.2(3) . .
Zn1 O7 C18 O6 4.7(4) . .
Zn1 O7 C18 C19 -174.5(2) . .
