#------------------------------------------------------------------------------
#$Date: 2024-11-15 14:46:36 +0200 (Fri, 15 Nov 2024) $
#$Revision: 295934 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/32/75/4327595.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_4327595
loop_
_publ_author_name
'Michael Rombach'
'Heinrich Vahrenkamp'
_publ_section_title
;
 Pyrazolylborate-Zinc-Hydrosulfide Complexes and Their Reactions
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              6144
_journal_page_last               6150
_journal_paper_doi               10.1021/ic010510+
_journal_volume                  40
_journal_year                    2001
_chemical_formula_sum            'C37 H35 B F6 N10 O2 Zn'
_chemical_formula_weight         841.93
_chemical_melting_point          475
_chemical_name_common            LPic,MeZn(CF3COCHCOCF3)
_chemical_name_systematic
;
Hydrotris(5-methyl-3-3'-(4-methyl)-pyridyl-pyrazol-1-
yl)borato-zink-hexafloracetylacetonate
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 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                 97.29(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   12.135(2)
_cell_length_b                   20.655(4)
_cell_length_c                   15.792(3)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    293(2)
_cell_volume                     3926.2(13)
_computing_cell_refinement       'CAD4 5.1'
_computing_data_collection       'CAD4 5.1'
_computing_data_reduction        'CADFOR und CADSEX'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997), Bruker SHELXTL'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.996
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  Nonius-Turbo-CAD4
_diffrn_measurement_method       Omega-2Theta
_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  0.0432
_diffrn_reflns_av_sigmaI/netI    0.0515
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       0
_diffrn_reflns_limit_k_min       -25
_diffrn_reflns_limit_l_max       0
_diffrn_reflns_limit_l_min       -19
_diffrn_reflns_number            7972
_diffrn_reflns_theta_full        26.00
_diffrn_reflns_theta_max         26.00
_diffrn_reflns_theta_min         2.78
_diffrn_standards_decay_%        10%
_diffrn_standards_interval_count 'OCR every 200 refl.'
_diffrn_standards_interval_time  'ICR every 1800s'
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    0.701
_exptl_absorpt_correction_T_max  none
_exptl_absorpt_correction_T_min  none
_exptl_absorpt_correction_type   none
_exptl_absorpt_process_details   none
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.424
_exptl_crystal_description       isometric
_exptl_crystal_F_000             1728
_exptl_crystal_size_max          0.4
_exptl_crystal_size_mid          0.3
_exptl_crystal_size_min          0.3
_refine_diff_density_max         0.526
_refine_diff_density_min         -0.690
_refine_diff_density_rms         0.084
_refine_ls_extinction_coef       none
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.049
_refine_ls_hydrogen_treatment    Riding-Model
_refine_ls_matrix_type           full
_refine_ls_number_parameters     542
_refine_ls_number_reflns         7690
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.049
_refine_ls_R_factor_all          0.0998
_refine_ls_R_factor_gt           0.0514
_refine_ls_shift/su_max          0.067
_refine_ls_shift/su_mean         0.004
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0794P)²+5.3914P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1315
_refine_ls_wR_factor_ref         0.1564
_reflns_number_gt                5398
_reflns_number_total             7690
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic0105102B_5.cif
_cod_data_source_block           M13
_cod_original_cell_volume        3926.1(14)
_cod_database_code               4327595
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -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
Zn1 Zn 0.23763(3) 0.243295(18) 0.59383(3) 0.02366(13) Uani 1 1 d .
N1 N 0.1482(2) 0.33040(14) 0.59977(19) 0.0244(6) Uani 1 1 d .
N2 N 0.1520(2) 0.21133(14) 0.68862(19) 0.0264(6) Uani 1 1 d .
N3 N 0.1276(2) 0.21133(14) 0.49416(19) 0.0262(6) Uani 1 1 d .
N4 N 0.0356(2) 0.32035(14) 0.58852(19) 0.0263(6) Uani 1 1 d .
N5 N 0.0389(2) 0.21561(14) 0.67050(19) 0.0260(6) Uani 1 1 d .
N6 N 0.0191(2) 0.21329(14) 0.50938(19) 0.0266(7) Uani 1 1 d .
N7 N 0.4499(3) 0.43401(16) 0.7075(2) 0.0376(8) Uani 1 1 d .
N8 N 0.4274(3) 0.08808(17) 0.8568(2) 0.0416(8) Uani 1 1 d .
N9 N 0.4176(3) 0.20194(18) 0.3710(2) 0.0400(8) Uani 1 1 d .
N10 N 0.9116(5) 0.0401(2) 0.5960(3) 0.0682(13) Uani 1 1 d .
O1 O 0.3837(2) 0.28369(13) 0.58374(19) 0.0351(6) Uani 1 1 d .
O2 O 0.3258(2) 0.15221(12) 0.60112(17) 0.0309(6) Uani 1 1 d .
B1 B -0.0123(3) 0.2509(2) 0.5881(3) 0.0279(9) Uani 1 1 d .
H1 H -0.0933 0.2527 0.5860 0.033 Uiso 1 1 calc R
F1 F 0.5318(3) 0.35454(17) 0.5209(3) 0.1044(16) Uani 1 1 d .
F2 F 0.6496(3) 0.27858(17) 0.5281(3) 0.1035(15) Uani 1 1 d .
F3 F 0.6142(3) 0.3280(2) 0.6416(3) 0.1097(16) Uani 1 1 d .
F4A F 0.5527(12) 0.0625(6) 0.5667(18) 0.126(9) Uani 0.55(2) 1 d P
F4B F 0.509(3) 0.0593(9) 0.5349(10) 0.134(11) Uani 0.45(2) 1 d P
F5A F 0.472(3) 0.0522(6) 0.6762(5) 0.120(10) Uani 0.55(2) 1 d P
F5B F 0.5586(17) 0.0707(6) 0.6608(13) 0.090(5) Uani 0.45(2) 1 d P
F6A F 0.3896(9) 0.0347(5) 0.5551(12) 0.087(4) Uani 0.55(2) 1 d P
F6B F 0.4025(13) 0.0346(6) 0.623(3) 0.121(11) Uani 0.45(2) 1 d P
C1 C -0.0182(3) 0.37804(18) 0.5829(2) 0.0313(8) Uani 1 1 d .
C2 C 0.0606(3) 0.42616(18) 0.5917(3) 0.0329(9) Uani 1 1 d .
H2A H 0.0481 0.4706 0.5907 0.039 Uiso 1 1 calc R
C3 C 0.1622(3) 0.39498(16) 0.6024(2) 0.0253(7) Uani 1 1 d .
C4 C -0.1421(3) 0.3837(2) 0.5732(3) 0.0424(10) Uani 1 1 d .
H4A H -0.1745 0.3413 0.5684 0.064 Uiso 1 1 calc R
H4B H -0.1670 0.4083 0.5228 0.064 Uiso 1 1 calc R
H4C H -0.1641 0.4052 0.6223 0.064 Uiso 1 1 calc R
C5 C 0.2742(3) 0.42448(16) 0.6181(2) 0.0259(7) Uani 1 1 d .
C6 C 0.3081(3) 0.47205(17) 0.5654(2) 0.0280(8) Uani 1 1 d .
H6A H 0.2606 0.4858 0.5179 0.034 Uiso 1 1 calc R
C7 C 0.4116(3) 0.49890(18) 0.5830(2) 0.0315(8) Uani 1 1 d .
H7B H 0.4347 0.5307 0.5474 0.038 Uiso 1 1 calc R
C8 C 0.4821(3) 0.47856(18) 0.6540(2) 0.0315(8) Uani 1 1 d .
C9 C 0.3493(3) 0.40805(18) 0.6886(2) 0.0331(9) Uani 1 1 d .
H9B H 0.3277 0.3766 0.7254 0.040 Uiso 1 1 calc R
C10 C 0.5978(4) 0.5044(2) 0.6749(3) 0.0442(10) Uani 1 1 d .
H10A H 0.6327 0.4844 0.7263 0.066 Uiso 1 1 calc R
H10B H 0.5949 0.5504 0.6829 0.066 Uiso 1 1 calc R
H10C H 0.6397 0.4949 0.6288 0.066 Uiso 1 1 calc R
C11 C -0.0090(3) 0.18381(18) 0.7314(2) 0.0320(8) Uani 1 1 d .
C12 C 0.0746(4) 0.15888(19) 0.7895(3) 0.0369(9) Uani 1 1 d .
H12A H 0.0665 0.1347 0.8380 0.044 Uiso 1 1 calc R
C13 C 0.1738(3) 0.17739(16) 0.7606(2) 0.0280(8) Uani 1 1 d .
C14 C -0.1325(3) 0.1786(2) 0.7292(3) 0.0424(10) Uani 1 1 d .
H14A H -0.1683 0.2014 0.6802 0.064 Uiso 1 1 calc R
H14B H -0.1544 0.1974 0.7801 0.064 Uiso 1 1 calc R
H14C H -0.1540 0.1339 0.7257 0.064 Uiso 1 1 calc R
C15 C 0.2898(3) 0.16482(18) 0.7955(2) 0.0297(8) Uani 1 1 d .
C16 C 0.3229(4) 0.1051(2) 0.8304(3) 0.0388(10) Uani 1 1 d .
H16A H 0.2678 0.0746 0.8357 0.047 Uiso 1 1 calc R
C17 C 0.4822(3) 0.19313(19) 0.8180(3) 0.0362(9) Uani 1 1 d .
H17A H 0.5388 0.2230 0.8146 0.043 Uiso 1 1 calc R
C18 C 0.5074(3) 0.1317(2) 0.8495(2) 0.0359(9) Uani 1 1 d .
C19 C 0.3739(3) 0.21004(18) 0.7916(2) 0.0343(9) Uani 1 1 d .
H19A H 0.3569 0.2516 0.7713 0.041 Uiso 1 1 calc R
C20 C 0.6248(4) 0.1106(3) 0.8746(3) 0.0521(12) Uani 1 1 d .
H20A H 0.6257 0.0667 0.8949 0.078 Uiso 1 1 calc R
H20B H 0.6595 0.1383 0.9190 0.078 Uiso 1 1 calc R
H20C H 0.6648 0.1131 0.8260 0.078 Uiso 1 1 calc R
C21 C -0.0425(3) 0.17446(18) 0.4532(2) 0.0304(8) Uani 1 1 d .
C22 C 0.0272(3) 0.14729(18) 0.4003(2) 0.0323(8) Uani 1 1 d .
H22A H 0.0078 0.1186 0.3555 0.039 Uiso 1 1 calc R
C23 C 0.1325(3) 0.17173(17) 0.4279(2) 0.0272(8) Uani 1 1 d .
C24 C -0.1649(3) 0.1667(2) 0.4517(3) 0.0424(10) Uani 1 1 d .
H24A H -0.1895 0.1918 0.4969 0.064 Uiso 1 1 calc R
H24B H -0.1820 0.1219 0.4595 0.064 Uiso 1 1 calc R
H24C H -0.2019 0.1814 0.3978 0.064 Uiso 1 1 calc R
C25 C 0.2376(3) 0.16041(18) 0.3940(2) 0.0282(8) Uani 1 1 d .
C26 C 0.2641(3) 0.1013(2) 0.3596(3) 0.0377(9) Uani 1 1 d .
H26A H 0.2136 0.0673 0.3558 0.045 Uiso 1 1 calc R
C27 C 0.3667(4) 0.0939(2) 0.3310(3) 0.0437(10) Uani 1 1 d .
H27A H 0.3845 0.0551 0.3063 0.052 Uiso 1 1 calc R
C28 C 0.4429(3) 0.1444(2) 0.3394(2) 0.0369(9) Uani 1 1 d .
C29 C 0.3177(3) 0.2085(2) 0.3960(3) 0.0357(9) Uani 1 1 d .
H29A H 0.2999 0.2488 0.4166 0.043 Uiso 1 1 calc R
C30 C 0.5572(4) 0.1366(3) 0.3145(3) 0.0536(12) Uani 1 1 d .
H30A H 0.5979 0.1763 0.3254 0.080 Uiso 1 1 calc R
H30B H 0.5520 0.1263 0.2549 0.080 Uiso 1 1 calc R
H30C H 0.5951 0.1023 0.3473 0.080 Uiso 1 1 calc R
C31 C 0.5683(4) 0.3047(3) 0.5661(5) 0.0672(17) Uani 1 1 d .
C32 C 0.4770(3) 0.2567(2) 0.5791(3) 0.0396(10) Uani 1 1 d .
C33 C 0.5051(3) 0.1922(2) 0.5852(3) 0.0394(10) Uani 1 1 d .
H33A H 0.5783 0.1799 0.5825 0.047 Uiso 1 1 calc R
C34 C 0.4260(3) 0.14491(19) 0.5955(2) 0.0344(9) Uani 1 1 d .
C35 C 0.4660(5) 0.0738(2) 0.6002(3) 0.0512(12) Uani 1 1 d .
C36 C 1.1255(5) 0.0391(3) 0.6075(4) 0.0705(16) Uani 1 1 d .
H36A H 1.1543 0.0783 0.6347 0.106 Uiso 1 1 calc R
H36B H 1.1479 0.0364 0.5514 0.106 Uiso 1 1 calc R
H36C H 1.1540 0.0025 0.6407 0.106 Uiso 1 1 calc R
C37 C 1.0053(6) 0.0395(2) 0.6008(3) 0.0564(13) Uani 1 1 d .
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'
B B 0.0013 0.0007 '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'
F F 0.0171 0.0103 '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'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_publ_flag
O1 Zn1 N2 137.69(12) y
O1 Zn1 N3 125.31(12) y
N2 Zn1 N3 96.74(12) y
O1 Zn1 N1 96.58(11) y
N2 Zn1 N1 86.02(12) y
N3 Zn1 N1 91.18(12) y
O1 Zn1 O2 85.93(10) y
N2 Zn1 O2 88.51(11) y
N3 Zn1 O2 91.74(11) y
N1 Zn1 O2 174.07(11) y
C3 N1 N4 105.9(3) y
C3 N1 Zn1 141.6(2) y
N4 N1 Zn1 112.0(2) y
C13 N2 N5 107.3(3) y
C13 N2 Zn1 137.1(3) y
N5 N2 Zn1 114.6(2) y
C23 N3 N6 107.2(3) y
C23 N3 Zn1 135.5(3) y
N6 N3 Zn1 113.9(2) y
C1 N4 N1 109.8(3) y
C1 N4 B1 129.6(3) y
N1 N4 B1 120.6(3) y
C11 N5 N2 109.2(3) y
C11 N5 B1 131.4(3) y
N2 N5 B1 119.4(3) y
C21 N6 N3 109.4(3) y
C21 N6 B1 130.7(3) y
N3 N6 B1 119.6(3) y
C9 N7 C8 117.9(3) y
C16 N8 C18 117.9(4) y
C29 N9 C28 117.5(4) y
C32 O1 Zn1 129.1(3) y
C34 O2 Zn1 125.9(2) y
N4 B1 N5 108.7(3) y
N4 B1 N6 109.7(3) y
N5 B1 N6 108.9(3) y
F4B F4A C35 73.1(19) y
F4B F4A F5B 132(2) y
C35 F4A F5B 59.8(7) y
F4A F4B C35 74.9(18) y
F4A F4B F6A 121(3) y
C35 F4B F6A 55.4(9) y
F5B F5A F6B 122.7(17) y
F5B F5A C35 68.7(9) y
F6B F5A C35 59.0(9) y
F5A F5B C35 59.2(7) y
F5A F5B F4A 103.9(10) y
C35 F5B F4A 51.8(6) y
F6B F6A C35 58.1(8) y
F6B F6A F4B 100.5(12) y
C35 F6A F4B 49.0(6) y
F6A F6B F5A 136(2) y
F6A F6B C35 73.1(15) y
F5A F6B C35 64.9(8) y
N4 C1 C2 107.8(3) y
N4 C1 C4 123.0(3) y
C2 C1 C4 129.1(4) y
C1 C2 C3 105.9(3) y
N1 C3 C2 110.6(3) y
N1 C3 C5 121.5(3) y
C2 C3 C5 127.9(3) y
C6 C5 C9 116.2(3) y
C6 C5 C3 121.8(3) y
C9 C5 C3 121.9(3) y
C7 C6 C5 120.0(3) y
C6 C7 C8 119.8(3) y
N7 C8 C7 121.3(4) y
N7 C8 C10 116.5(4) y
C7 C8 C10 122.2(4) y
N7 C9 C5 124.8(3) y
N5 C11 C12 108.0(3) y
N5 C11 C14 122.4(4) y
C12 C11 C14 129.7(4) y
C11 C12 C13 105.8(3) y
N2 C13 C12 109.7(3) y
N2 C13 C15 119.3(3) y
C12 C13 C15 131.0(3) y
C16 C15 C19 115.9(4) y
C16 C15 C13 121.4(3) y
C19 C15 C13 122.6(3) y
N8 C16 C15 125.0(4) y
C19 C17 C18 120.1(4) y
N8 C18 C17 121.2(4) y
N8 C18 C20 117.2(4) y
C17 C18 C20 121.6(4) y
C17 C19 C15 119.7(4) y
N6 C21 C22 108.0(3) y
N6 C21 C24 122.8(3) y
C22 C21 C24 129.2(4) y
C21 C22 C23 105.8(3) y
N3 C23 C22 109.7(3) y
N3 C23 C25 120.8(3) y
C22 C23 C25 129.4(3) y
C29 C25 C26 116.1(4) y
C29 C25 C23 121.2(3) y
C26 C25 C23 122.6(3) y
C25 C26 C27 119.1(4) y
C28 C27 C26 120.1(4) y
N9 C28 C27 121.3(4) y
N9 C28 C30 117.2(4) y
C27 C28 C30 121.5(4) y
N9 C29 C25 125.7(4) y
F1 C31 F2 107.1(5) y
F1 C31 F3 106.2(5) y
F2 C31 F3 107.4(5) y
F1 C31 C32 112.8(5) y
F2 C31 C32 113.0(4) y
F3 C31 C32 110.0(5) y
O1 C32 C33 129.4(4) y
O1 C32 C31 113.0(4) y
C33 C32 C31 117.6(4) y
C32 C33 C34 121.2(4) y
O2 C34 C33 128.3(4) y
O2 C34 C35 114.7(4) y
C33 C34 C35 117.0(4) y
F6B C35 F4B 116.0(15) y
F6B C35 F4A 127.1(10) y
F4B C35 F4A 32.0(11) y
F6B C35 F5A 56.1(10) y
F4B C35 F5A 135.6(10) y
F4A C35 F5A 112.2(10) y
F6B C35 F6A 48.8(14) y
F4B C35 F6A 75.6(12) y
F4A C35 F6A 102.7(10) y
F5A C35 F6A 103.9(10) y
F6B C35 F5B 104.7(12) y
F4B C35 F5B 100.1(11) y
F4A C35 F5B 68.4(9) y
F5A C35 F5B 52.1(8) y
F6A C35 F5B 140.8(7) y
F6B C35 C34 116.3(7) y
F4B C35 C34 110.4(9) y
F4A C35 C34 115.5(7) y
F5A C35 C34 111.0(5) y
F6A C35 C34 110.5(6) y
F5B C35 C34 107.4(6) y
N10 C37 C36 179.6(7) y
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_publ_flag
Zn1 O1 1.984(3) y
Zn1 N2 2.037(3) y
Zn1 N3 2.040(3) y
Zn1 N1 2.109(3) y
Zn1 O2 2.160(2) y
N1 C3 1.345(4) y
N1 N4 1.372(4) y
N2 C13 1.334(5) y
N2 N5 1.369(4) y
N3 C23 1.335(5) y
N3 N6 1.369(4) y
N4 C1 1.356(5) y
N4 B1 1.548(5) y
N5 C11 1.355(5) y
N5 B1 1.551(5) y
N6 C21 1.349(5) y
N6 B1 1.553(5) y
N7 C9 1.333(5) y
N7 C8 1.339(5) y
N8 C16 1.331(5) y
N8 C18 1.340(5) y
N9 C29 1.329(5) y
N9 C28 1.340(5) y
N10 C37 1.131(7) y
O1 C32 1.273(5) y
O2 C34 1.239(5) y
F1 C31 1.298(7) y
F2 C31 1.332(6) y
F3 C31 1.341(7) y
F4A F4B 0.69(2) y
F4A C35 1.258(11) y
F4A F5B 1.488(19) y
F4B C35 1.247(15) y
F4B F6A 1.60(3) y
F5A F5B 1.170(16) y
F5A F6B 1.168(19) y
F5A C35 1.275(9) y
F5B C35 1.383(11) y
F6A F6B 1.07(3) y
F6A C35 1.360(10) y
F6B C35 1.207(12) y
C1 C2 1.374(5) y
C1 C4 1.496(5) y
C2 C3 1.382(5) y
C3 C5 1.482(5) y
C5 C6 1.384(5) y
C5 C9 1.388(5) y
C6 C7 1.369(5) y
C7 C8 1.386(5) y
C8 C10 1.499(5) y
C11 C12 1.378(6) y
C11 C14 1.499(5) y
C12 C13 1.393(5) y
C13 C15 1.468(5) y
C15 C16 1.391(5) y
C15 C19 1.391(5) y
C17 C19 1.372(6) y
C17 C18 1.383(6) y
C18 C20 1.495(6) y
C21 C22 1.382(5) y
C21 C24 1.491(5) y
C22 C23 1.392(5) y
C23 C25 1.463(5) y
C25 C29 1.387(5) y
C25 C26 1.390(5) y
C26 C27 1.385(6) y
C27 C28 1.389(6) y
C28 C30 1.497(6) y
C31 C32 1.521(6) y
C32 C33 1.375(6) y
C33 C34 1.393(6) y
C34 C35 1.545(6) y
C36 C37 1.449(8) y
loop_
_cod_changelog_entry_id
_cod_changelog_entry_author
_cod_changelog_entry_date
_cod_changelog_entry_text
1 'Vaitkus, Antanas' 2024-11-15T14:40:08+02:00
;
 Removed multiple data items that had the 'y' placeholder value.
;
