#------------------------------------------------------------------------------
#$Date: 2016-03-24 14:25:36 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179663 $
#$URL: svn://www.crystallography.net/cod/cif/4/51/16/4511648.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_4511648
loop_
_publ_author_name
'Podgajny, Robert'
'Pinkowicz, Dawid'
'Czarnecki, Bernard'
'Kozieł, Marcin'
'Chorąży, Szymon'
'Wis, Magdalena'
'Nitek, Wojciech'
'Rams, Michał'
'Sieklucka, Barbara'
_publ_section_title
;
 Role of Pyrazine-N,N′-dioxide in [W(CN)8]n−-Based Hybrid
 Networks: Anion−π Interactions
;
_journal_issue                   8
_journal_name_full               'Crystal Growth & Design'
_journal_page_first              4030
_journal_paper_doi               10.1021/cg500636m
_journal_volume                  14
_journal_year                    2014
_chemical_formula_sum            'C62 H28 Mn6 N40 O22 W4'
_chemical_formula_weight         2750.28
_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_conform_dict_location     ftp://ftp.iucr.org/pub/cif_core.dic
_audit_conform_dict_name         cif_core.dic
_audit_conform_dict_version      2.4
_audit_creation_date             2013-09-30T19:59:11-00:00
_audit_creation_method           'WinGX routine CIF_UPDATE'
_cell_angle_alpha                108.690(5)
_cell_angle_beta                 94.850(5)
_cell_angle_gamma                97.985(5)
_cell_formula_units_Z            2
_cell_length_a                   16.270(5)
_cell_length_b                   16.578(5)
_cell_length_c                   19.748(5)
_cell_measurement_temperature    293(2)
_cell_volume                     4949(2)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.916
_diffrn_measurement_device       '95mm CCD camera on κ-goniostat'
_diffrn_measurement_device_type  KappaCCD
_diffrn_measurement_method       CCD
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0342
_diffrn_reflns_av_unetI/netI     0.043
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            77963
_diffrn_reflns_theta_full        25
_diffrn_reflns_theta_max         28.66
_diffrn_reflns_theta_min         2.81
_exptl_absorpt_coefficient_mu    5.445
_exptl_absorpt_correction_T_max  0.520
_exptl_absorpt_correction_T_min  0.417
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            brown
_exptl_crystal_density_diffrn    1.846
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             2604
_exptl_crystal_size_max          0.35
_exptl_crystal_size_mid          0.14
_exptl_crystal_size_min          0.12
_refine_diff_density_max         1.408
_refine_diff_density_min         -0.847
_refine_diff_density_rms         0.173
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.013
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1211
_refine_ls_number_reflns         23329
_refine_ls_number_restraints     23
_refine_ls_restrained_S_all      1.024
_refine_ls_R_factor_all          0.0538
_refine_ls_R_factor_gt           0.0273
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0403P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0743
_refine_ls_wR_factor_ref         0.0825
_reflns_number_gt                14759
_reflns_number_total             23329
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            cg500636m_si_002.cif
_cod_data_source_block           rp_o10a
_cod_depositor_comments
'Adding full bibliography for 4511646--4511649.cif.'
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               4511648
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
W2 W 0.259331(12) 0.948948(12) 0.753802(12) 0.01586(5) Uani 1 1 d .
W3 W 0.740209(12) 0.798404(12) 0.743108(12) 0.01673(5) Uani 1 1 d .
W4 W 0.728764(12) 1.281875(12) 0.745332(12) 0.01884(6) Uani 1 1 d .
W1 W 0.272989(12) 0.474537(11) 0.756230(11) 0.01816(5) Uani 1 1 d .
Mn6 Mn 0.39802(5) 1.18022(4) 0.63080(5) 0.02160(18) Uani 1 1 d .
Mn2 Mn 0.41388(5) 0.68123(4) 0.61654(4) 0.01957(18) Uani 1 1 d .
Mn5 Mn 0.60162(5) 0.57358(4) 0.87417(5) 0.02111(18) Uani 1 1 d .
Mn3 Mn 0.58697(5) 1.06930(4) 0.87799(5) 0.01978(18) Uani 1 1 d .
Mn4 Mn 0.97024(5) 1.08531(5) 0.76130(5) 0.02706(19) Uani 1 1 d .
Mn1 Mn 0.03036(5) 0.66748(5) 0.73826(5) 0.0333(2) Uani 1 1 d .
O23 O 0.4485(2) 0.7442(2) 0.5404(2) 0.0362(10) Uani 1 1 d .
N2 N 0.4609(3) 0.4956(3) 0.5696(3) 0.0295(12) Uani 1 1 d .
O32 O 0.5237(3) 1.1749(2) 0.9304(2) 0.0382(11) Uani 1 1 d .
N5 N 0.5426(3) 0.7552(2) 0.9285(3) 0.0273(12) Uani 1 1 d .
O63 O 0.4326(2) 0.2463(2) 0.5571(2) 0.0379(11) Uani 1 1 d .
N1 N 0.4406(3) 0.3281(3) 0.5646(3) 0.0272(11) Uani 1 1 d .
N4 N 0.4602(3) 0.9989(3) 0.5715(3) 0.0344(13) Uani 1 1 d .
O53 O 0.5577(3) 1.5047(2) 0.9461(2) 0.0382(11) Uani 1 1 d .
N7 N 0.5343(3) 1.2541(2) 0.9292(3) 0.0255(11) Uani 1 1 d .
N26 N 0.3400(3) 1.0940(3) 0.6844(3) 0.0318(11) Uani 1 1 d .
O33 O 0.5621(3) 1.0091(2) 0.9559(2) 0.0365(10) Uani 1 1 d .
O62 O 0.4677(3) 1.0803(2) 0.5768(3) 0.0442(12) Uani 1 1 d .
O22 O 0.4744(2) 0.5746(2) 0.5666(2) 0.0375(11) Uani 1 1 d .
N38 N 0.6627(3) 0.6624(3) 0.8221(3) 0.0313(11) Uani 1 1 d .
N6 N 0.5576(3) 0.9262(3) 0.9450(3) 0.0264(11) Uani 1 1 d .
O52 O 0.5325(3) 0.6740(2) 0.9261(2) 0.0437(12) Uani 1 1 d .
N16 N 0.3628(3) 0.6079(3) 0.6810(3) 0.0331(12) Uani 1 1 d .
N46 N 0.6366(3) 1.1434(3) 0.8149(3) 0.0349(12) Uani 1 1 d .
N36 N 0.6426(3) 0.9592(3) 0.8202(3) 0.0338(12) Uani 1 1 d .
N21 N 0.0773(3) 1.0146(3) 0.7581(3) 0.0362(11) Uani 1 1 d .
N3 N 0.4514(3) 0.8276(3) 0.5522(3) 0.0292(12) Uani 1 1 d .
N8 N 0.5527(3) 1.4235(2) 0.9386(3) 0.0268(11) Uani 1 1 d .
C28 C 0.3234(3) 0.8462(3) 0.7021(3) 0.0233(12) Uani 1 1 d .
N28 N 0.3569(3) 0.7917(3) 0.6737(3) 0.0327(12) Uani 1 1 d .
N47 N 0.5231(3) 1.2422(3) 0.6961(3) 0.0364(13) Uani 1 1 d .
N17 N 0.4784(3) 0.5140(3) 0.8050(3) 0.0335(12) Uani 1 1 d .
C36 C 0.6760(3) 0.9035(3) 0.7925(3) 0.0263(13) Uani 1 1 d .
C45 C 0.7760(4) 1.3294(3) 0.8589(4) 0.0365(15) Uani 1 1 d .
N27 N 0.4607(3) 1.0076(3) 0.8158(3) 0.0349(12) Uani 1 1 d .
C25 C 0.2067(3) 0.9069(3) 0.6415(3) 0.0287(13) Uani 1 1 d .
C46 C 0.6690(3) 1.1898(3) 0.7902(3) 0.0281(13) Uani 1 1 d .
C18 C 0.3152(3) 0.3517(3) 0.7128(3) 0.0242(13) Uani 1 1 d .
C27 C 0.3910(3) 0.9871(3) 0.7954(3) 0.0264(13) Uani 1 1 d .
C38 C 0.6928(3) 0.7099(3) 0.7970(3) 0.0273(13) Uani 1 1 d .
C22 C 0.2744(3) 1.0694(3) 0.8409(3) 0.0307(13) Uani 1 1 d .
C26 C 0.3082(3) 1.0443(3) 0.7072(3) 0.0233(12) Uani 1 1 d .
C21 C 0.1413(3) 0.9917(3) 0.7579(3) 0.0272(12) Uani 1 1 d .
C32 C 0.7237(3) 0.6723(3) 0.6602(3) 0.0309(14) Uani 1 1 d .
C23 C 0.2690(3) 0.9120(3) 0.8489(3) 0.0318(14) Uani 1 1 d .
C48 C 0.6864(3) 1.4036(3) 0.7901(3) 0.0292(14) Uani 1 1 d .
N37 N 0.5375(3) 0.7393(3) 0.6822(3) 0.0356(12) Uani 1 1 d .
C37 C 0.6077(3) 0.7596(3) 0.7036(3) 0.0238(12) Uani 1 1 d .
C17 C 0.4096(4) 0.4992(3) 0.7888(3) 0.0305(14) Uani 1 1 d .
C13 C 0.2849(3) 0.4369(3) 0.8524(3) 0.0278(13) Uani 1 1 d .
C16 C 0.3313(3) 0.5626(3) 0.7062(3) 0.0271(13) Uani 1 1 d .
C12 C 0.2926(3) 0.5947(3) 0.8465(3) 0.0307(14) Uani 1 1 d .
C35 C 0.7968(3) 0.8479(3) 0.8555(3) 0.0316(14) Uani 1 1 d .
N12 N 0.3004(3) 0.6582(3) 0.8935(3) 0.0497(15) Uani 1 1 d .
C47 C 0.5942(3) 1.2564(3) 0.7119(3) 0.0246(12) Uani 1 1 d .
N34 N 0.8784(3) 0.9729(3) 0.7605(3) 0.0347(11) Uani 1 1 d .
C33 C 0.8591(3) 0.7553(3) 0.7391(3) 0.0337(14) Uani 1 1 d .
C15 C 0.2233(4) 0.4219(4) 0.6418(4) 0.0342(14) Uani 1 1 d .
N11 N 0.1235(3) 0.5850(3) 0.7383(3) 0.0432(13) Uani 1 1 d .
N23 N 0.2759(3) 0.8939(3) 0.9000(3) 0.0489(15) Uani 1 1 d .
N41 N 0.8788(3) 1.1726(3) 0.7623(3) 0.0377(12) Uani 1 1 d .
N24 N 0.1187(3) 0.7729(3) 0.7241(3) 0.0356(11) Uani 1 1 d .
N42 N 0.7036(4) 1.1013(3) 0.6069(3) 0.0506(15) Uani 1 1 d .
C43 C 0.7167(4) 1.3227(3) 0.6520(3) 0.0320(14) Uani 1 1 d .
C41 C 0.8273(3) 1.2111(3) 0.7569(3) 0.0282(12) Uani 1 1 d .
C11 C 0.1742(3) 0.5458(3) 0.7437(3) 0.0316(13) Uani 1 1 d .
C54 C 0.5213(4) 0.4666(3) 0.6018(4) 0.0385(16) Uani 1 1 d .
H54 H 0.5702 0.5044 0.6267 0.046 Uiso 1 1 calc R
C24 C 0.1677(3) 0.8332(3) 0.7336(3) 0.0258(11) Uani 1 1 d .
C42 C 0.7117(3) 1.1646(3) 0.6538(3) 0.0305(13) Uani 1 1 d .
N22 N 0.2838(3) 1.1342(3) 0.8865(3) 0.0502(15) Uani 1 1 d .
N31 N 0.7223(3) 0.8410(3) 0.5897(3) 0.0488(15) Uani 1 1 d .
N45 N 0.7997(4) 1.3544(4) 0.9198(3) 0.0620(17) Uani 1 1 d .
C65 C 0.6066(4) 1.3064(3) 0.9567(3) 0.0361(16) Uani 1 1 d .
H65 H 0.6521 1.2854 0.9723 0.043 Uiso 1 1 calc R
N25 N 0.1794(4) 0.8861(3) 0.5815(3) 0.0537(16) Uani 1 1 d .
N35 N 0.8226(4) 0.8740(4) 0.9142(3) 0.0564(16) Uani 1 1 d .
N13 N 0.2905(3) 0.4188(3) 0.9029(3) 0.0415(13) Uani 1 1 d .
C31 C 0.7306(3) 0.8274(3) 0.6433(3) 0.0317(14) Uani 1 1 d .
C51 C 0.3801(4) 0.3568(3) 0.5350(3) 0.0345(15) Uani 1 1 d .
H51 H 0.3306 0.3189 0.512 0.041 Uiso 1 1 calc R
C59 C 0.4781(4) 0.7837(3) 0.9012(4) 0.0379(16) Uani 1 1 d .
H59 H 0.429 0.7456 0.8773 0.045 Uiso 1 1 calc R
C62 C 0.6212(4) 0.8958(3) 0.9706(3) 0.0350(15) Uani 1 1 d .
H62 H 0.6704 0.9336 0.9946 0.042 Uiso 1 1 calc R
C52 C 0.3885(3) 0.4416(3) 0.5374(3) 0.0318(15) Uani 1 1 d .
H52 H 0.3449 0.4612 0.5172 0.038 Uiso 1 1 calc R
C53 C 0.5108(4) 0.3827(4) 0.5978(4) 0.0427(18) Uani 1 1 d .
H53 H 0.5536 0.3629 0.6187 0.051 Uiso 1 1 calc R
C60 C 0.4859(3) 0.8693(3) 0.9091(3) 0.0344(15) Uani 1 1 d .
H60 H 0.442 0.8893 0.8898 0.041 Uiso 1 1 calc R
N43 N 0.7079(3) 1.3424(3) 0.6013(3) 0.0486(15) Uani 1 1 d .
N32 N 0.7129(4) 0.6055(3) 0.6170(3) 0.0538(17) Uani 1 1 d .
C66 C 0.6143(4) 1.3911(3) 0.9624(3) 0.0346(15) Uani 1 1 d .
H66 H 0.665 1.4278 0.9839 0.042 Uiso 1 1 calc R
C57 C 0.3889(4) 0.9439(3) 0.5417(3) 0.0331(15) Uani 1 1 d .
H57 H 0.3419 0.9637 0.5274 0.04 Uiso 1 1 calc R
C55 C 0.5231(4) 0.8837(4) 0.5827(4) 0.0437(17) Uani 1 1 d .
H55 H 0.5699 0.8635 0.5968 0.052 Uiso 1 1 calc R
C34 C 0.8305(3) 0.9125(3) 0.7552(3) 0.0257(11) Uani 1 1 d .
N15 N 0.1961(4) 0.3950(4) 0.5820(3) 0.0599(17) Uani 1 1 d .
C58 C 0.3852(4) 0.8571(3) 0.5322(3) 0.0349(15) Uani 1 1 d .
H58 H 0.3354 0.8187 0.5114 0.042 Uiso 1 1 calc R
C64 C 0.4807(4) 1.3682(3) 0.9077(4) 0.0377(16) Uani 1 1 d .
H64 H 0.4365 1.388 0.8886 0.045 Uiso 1 1 calc R
C61 C 0.6144(4) 0.8101(3) 0.9617(4) 0.0411(18) Uani 1 1 d .
H61 H 0.6595 0.7895 0.9784 0.049 Uiso 1 1 calc R
C14 C 0.1558(3) 0.3932(3) 0.7548(4) 0.0417(16) Uani 1 1 d .
C63 C 0.4711(4) 1.2840(4) 0.9039(4) 0.0387(16) Uani 1 1 d .
H63 H 0.4202 1.2473 0.8835 0.046 Uiso 1 1 calc R
C56 C 0.5279(4) 0.9687(4) 0.5932(4) 0.049(2) Uani 1 1 d .
H56 H 0.5775 1.0069 0.6154 0.059 Uiso 1 1 calc R
C44 C 0.8435(3) 1.3675(3) 0.7512(3) 0.0378(14) Uani 1 1 d .
N14 N 0.0936(3) 0.3500(4) 0.7516(4) 0.079(2) Uani 1 1 d .
N44 N 0.9046(3) 1.4133(4) 0.7552(4) 0.074(2) Uani 1 1 d .
O31 O 0.7021(2) 1.1299(3) 0.9582(2) 0.0443(12) Uani 1 1 d .
O21 O 0.3011(3) 0.6255(3) 0.5351(2) 0.0469(12) Uani 1 1 d .
O51 O 0.7024(3) 0.6286(3) 0.9689(2) 0.0483(12) Uani 1 1 d .
O61 O 0.2921(3) 1.1227(3) 0.5424(2) 0.0522(13) Uani 1 1 d .
N18 N 0.3389(3) 0.2889(3) 0.6886(3) 0.0332(12) Uani 1 1 d .
N48 N 0.6612(3) 1.4663(3) 0.8168(3) 0.0348(12) Uani 1 1 d .
O42 O 1.0663(3) 1.1933(3) 0.7623(3) 0.0806(19) Uani 1 1 d .
O41 O 0.9522(3) 1.0475(3) 0.6438(3) 0.0666(14) Uani 1 1 d .
O43 O 0.9921(3) 1.1312(3) 0.8794(3) 0.0718(15) Uani 1 1 d D
O11 O -0.0074(4) 0.5938(4) 0.6255(3) 0.111(2) Uani 1 1 d .
C5 C 0.7831(4) 1.1282(5) 0.9393(4) 0.072(2) Uani 1 1 d .
H5A H 0.7982 1.0732 0.9358 0.109 Uiso 1 1 calc R
H5B H 0.8221 1.1733 0.9755 0.109 Uiso 1 1 calc R
H5C H 0.7846 1.1369 0.8936 0.109 Uiso 1 1 calc R
C4 C 0.2163(4) 0.6166(7) 0.5501(5) 0.103(4) Uani 1 1 d .
H4A H 0.2158 0.6206 0.5996 0.155 Uiso 1 1 calc R
H4B H 0.1856 0.5614 0.5193 0.155 Uiso 1 1 calc R
H4C H 0.1908 0.6618 0.5413 0.155 Uiso 1 1 calc R
C9 C 0.7865(5) 0.6728(6) 0.9749(5) 0.099(3) Uani 1 1 d .
H9A H 0.81 0.6468 0.9318 0.149 Uiso 1 1 calc R
H9B H 0.8198 0.6685 1.0157 0.149 Uiso 1 1 calc R
H9C H 0.786 0.7326 0.9813 0.149 Uiso 1 1 calc R
O13 O 0.0675(6) 0.7293(5) 0.8565(4) 0.161(4) Uani 1 1 d .
O12 O -0.0534(4) 0.5787(4) 0.7759(5) 0.141(3) Uani 1 1 d .
C7 C 1.1509(5) 1.2068(7) 0.7909(10) 0.213(9) Uani 1 1 d .
C10 C 0.2074(5) 1.0947(8) 0.5433(7) 0.168(7) Uani 1 1 d .
H10A H 0.1946 1.0327 0.5231 0.251 Uiso 1 1 calc R
H10B H 0.1739 1.1192 0.5153 0.251 Uiso 1 1 calc R
H10C H 0.1953 1.1128 0.5922 0.251 Uiso 1 1 calc R
C2 C -0.1172(7) 0.6080(8) 0.8273(9) 0.195(7) Uani 1 1 d .
C6 C 0.9860(12) 0.9807(11) 0.5979(7) 0.233(9) Uani 1 1 d .
C8 C 1.0008(10) 1.2292(7) 0.9225(10) 0.265(8) Uani 1 1 d DU
C1 C -0.0149(11) 0.5005(7) 0.5962(8) 0.243(10) Uani 1 1 d .
N33 N 0.9221(3) 0.7347(3) 0.7376(3) 0.0495(15) Uani 1 1 d .
C3 C 0.0564(14) 0.8242(17) 0.8915(13) 0.349(12) Uani 1 1 d U
O2S O 0.9159(4) 1.1434(4) 0.5604(4) 0.107(2) Uani 1 1 d D
O1S O 0.1083(5) 0.6364(7) 0.9409(4) 0.170(4) Uani 1 1 d D
C2S C 0.9312(8) 1.2347(6) 0.5976(7) 0.137(5) Uani 1 1 d D
O3S O -0.0738(6) 0.6611(6) 0.5397(5) 0.164(4) Uani 1 1 d .
C1S C 0.0741(11) 0.5326(10) 0.9031(11) 0.258(11) Uani 1 1 d D
C3S C -0.0591(8) 0.7542(8) 0.5591(7) 0.147(5) Uani 1 1 d .
O4S O 1.0764(16) 1.0819(13) 0.9547(10) 0.428(13) Uani 1 1 d DU
C4S C 1.072(2) 0.9960(16) 0.9465(18) 0.373(17) Uani 1 1 d DU
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 0 '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 0.006 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Mn Mn 0.3368 0.7283 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
W W -0.849 6.8722 '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
C21 W2 C28 144.91(19) . .
C21 W2 C22 71.86(19) . .
C28 W2 C22 143.0(2) . .
C21 W2 C23 100.9(2) . .
C28 W2 C23 88.9(2) . .
C22 W2 C23 76.3(2) . .
C21 W2 C27 143.90(19) . .
C28 W2 C27 71.08(19) . .
C22 W2 C27 72.6(2) . .
C23 W2 C27 76.4(2) . .
C21 W2 C25 77.0(2) . .
C28 W2 C25 75.7(2) . .
C22 W2 C25 133.4(2) . .
C23 W2 C25 144.39(19) . .
C27 W2 C25 125.7(2) . .
C21 W2 C24 75.05(17) . .
C28 W2 C24 76.15(18) . .
C22 W2 C24 128.2(2) . .
C23 W2 C24 72.2(2) . .
C27 W2 C24 134.49(18) . .
C25 W2 C24 73.02(19) . .
C21 W2 C26 91.55(18) . .
C28 W2 C26 99.97(19) . .
C22 W2 C26 76.1(2) . .
C23 W2 C26 144.3(2) . .
C27 W2 C26 74.00(19) . .
C25 W2 C26 70.96(19) . .
C24 W2 C26 143.5(2) . .
C33 W3 C36 145.1(2) . .
C33 W3 C34 75.30(18) . .
C36 W3 C34 76.52(18) . .
C33 W3 C37 144.11(19) . .
C36 W3 C37 70.68(19) . .
C34 W3 C37 133.32(18) . .
C33 W3 C32 71.5(2) . .
C36 W3 C32 143.2(2) . .
C34 W3 C32 127.9(2) . .
C37 W3 C32 72.95(19) . .
C33 W3 C38 92.3(2) . .
C36 W3 C38 98.8(2) . .
C34 W3 C38 144.2(2) . .
C37 W3 C38 74.4(2) . .
C32 W3 C38 76.3(2) . .
C33 W3 C31 99.2(2) . .
C36 W3 C31 90.3(2) . .
C34 W3 C31 70.6(2) . .
C37 W3 C31 77.2(2) . .
C32 W3 C31 76.5(2) . .
C38 W3 C31 145.2(2) . .
C33 W3 C35 76.9(2) . .
C36 W3 C35 75.8(2) . .
C34 W3 C35 73.68(19) . .
C37 W3 C35 126.4(2) . .
C32 W3 C35 132.8(2) . .
C38 W3 C35 70.83(19) . .
C31 W3 C35 143.79(19) . .
C41 W4 C44 74.59(19) . .
C41 W4 C42 70.8(2) . .
C44 W4 C42 112.1(2) . .
C41 W4 C45 74.5(2) . .
C44 W4 C45 77.0(2) . .
C42 W4 C45 139.6(2) . .
C41 W4 C46 78.08(19) . .
C44 W4 C46 144.2(2) . .
C42 W4 C46 79.4(2) . .
C45 W4 C46 73.7(2) . .
C41 W4 C43 118.3(2) . .
C44 W4 C43 73.1(2) . .
C42 W4 C43 74.9(2) . .
C45 W4 C43 141.9(2) . .
C46 W4 C43 141.6(2) . .
C41 W4 C48 143.8(2) . .
C44 W4 C48 81.6(2) . .
C42 W4 C48 144.7(2) . .
C45 W4 C48 73.8(2) . .
C46 W4 C48 109.0(2) . .
C43 W4 C48 78.9(2) . .
C41 W4 C47 138.66(18) . .
C44 W4 C47 143.89(19) . .
C42 W4 C47 77.5(2) . .
C45 W4 C47 119.1(2) . .
C46 W4 C47 70.38(19) . .
C43 W4 C47 76.5(2) . .
C48 W4 C47 73.7(2) . .
C11 W1 C12 71.0(2) . .
C11 W1 C16 77.85(19) . .
C12 W1 C16 80.2(2) . .
C11 W1 C14 73.30(18) . .
C12 W1 C14 110.9(2) . .
C16 W1 C14 143.0(2) . .
C11 W1 C18 144.0(2) . .
C12 W1 C18 144.5(2) . .
C16 W1 C18 108.04(19) . .
C14 W1 C18 83.6(2) . .
C11 W1 C15 74.9(2) . .
C12 W1 C15 140.3(2) . .
C16 W1 C15 73.2(2) . .
C14 W1 C15 77.2(2) . .
C18 W1 C15 73.2(2) . .
C11 W1 C13 117.7(2) . .
C12 W1 C13 74.8(2) . .
C16 W1 C13 143.0(2) . .
C14 W1 C13 72.7(2) . .
C18 W1 C13 79.6(2) . .
C15 W1 C13 141.1(2) . .
C11 W1 C17 138.94(18) . .
C12 W1 C17 77.4(2) . .
C16 W1 C17 71.32(19) . .
C14 W1 C17 144.49(19) . .
C18 W1 C17 73.15(19) . .
C15 W1 C17 119.2(2) . .
C13 W1 C17 76.9(2) . .
O63 Mn6 O62 88.49(15) 1_565 .
O63 Mn6 N26 166.32(17) 1_565 .
O62 Mn6 N26 89.22(16) . .
O63 Mn6 N18 89.48(16) 1_565 1_565
O62 Mn6 N18 174.77(17) . 1_565
N26 Mn6 N18 93.87(17) . 1_565
O63 Mn6 O61 79.07(15) 1_565 .
O62 Mn6 O61 90.00(19) . .
N26 Mn6 O61 87.44(17) . .
N18 Mn6 O61 94.35(19) 1_565 .
O63 Mn6 N47 87.39(17) 1_565 .
O62 Mn6 N47 82.54(18) . .
N26 Mn6 N47 105.68(18) . .
N18 Mn6 N47 92.55(18) 1_565 .
O61 Mn6 N47 164.72(18) . .
O22 Mn2 O23 91.99(14) . .
O22 Mn2 N16 87.57(16) . .
O23 Mn2 N16 171.35(18) . .
O22 Mn2 N28 176.55(19) . .
O23 Mn2 N28 89.77(16) . .
N16 Mn2 N28 91.13(18) . .
O22 Mn2 N37 84.40(17) . .
O23 Mn2 N37 89.46(17) . .
N16 Mn2 N37 99.09(19) . .
N28 Mn2 N37 92.66(18) . .
O22 Mn2 O21 91.62(18) . .
O23 Mn2 O21 81.64(15) . .
N16 Mn2 O21 89.74(17) . .
N28 Mn2 O21 91.57(18) . .
N37 Mn2 O21 170.13(17) . .
O52 Mn5 N48 175.21(18) . 1_545
O52 Mn5 O53 88.07(15) . 1_545
N48 Mn5 O53 90.98(16) 1_545 1_545
O52 Mn5 N38 88.11(15) . .
N48 Mn5 N38 93.73(17) 1_545 .
O53 Mn5 N38 168.00(17) 1_545 .
O52 Mn5 N17 82.68(18) . .
N48 Mn5 N17 92.57(18) 1_545 .
O53 Mn5 N17 86.37(17) 1_545 .
N38 Mn5 N17 104.41(17) . .
O52 Mn5 O51 88.90(18) . .
N48 Mn5 O51 95.52(19) 1_545 .
O53 Mn5 O51 78.50(15) 1_545 .
N38 Mn5 O51 90.06(16) . .
N17 Mn5 O51 162.93(17) . .
O33 Mn3 N46 167.62(18) . .
O33 Mn3 O32 91.84(15) . .
N46 Mn3 O32 88.48(16) . .
O33 Mn3 N36 88.76(17) . .
N46 Mn3 N36 91.76(18) . .
O32 Mn3 N36 176.05(18) . .
O33 Mn3 N27 90.52(17) . .
N46 Mn3 N27 101.82(18) . .
O32 Mn3 N27 83.99(17) . .
N36 Mn3 N27 92.10(18) . .
O33 Mn3 O31 80.08(15) . .
N46 Mn3 O31 87.53(17) . .
O32 Mn3 O31 91.06(17) . .
N36 Mn3 O31 92.89(18) . .
N27 Mn3 O31 169.25(18) . .
O41 Mn4 O43 176.4(2) . .
O41 Mn4 O42 87.3(2) . .
O43 Mn4 O42 89.3(2) . .
O41 Mn4 N41 87.58(18) . .
O43 Mn4 N41 91.08(19) . .
O42 Mn4 N41 86.46(16) . .
O41 Mn4 N34 92.90(18) . .
O43 Mn4 N34 90.55(19) . .
O42 Mn4 N34 177.23(17) . .
N41 Mn4 N34 96.31(16) . .
O41 Mn4 N21 90.83(18) . 1_655
O43 Mn4 N21 89.95(18) . 1_655
O42 Mn4 N21 84.19(16) . 1_655
N41 Mn4 N21 170.58(16) . 1_655
N34 Mn4 N21 93.04(15) . 1_655
O11 Mn1 N11 87.7(2) . .
O11 Mn1 N24 97.4(2) . .
N11 Mn1 N24 94.69(17) . .
O11 Mn1 O12 94.2(3) . .
N11 Mn1 O12 87.25(19) . .
N24 Mn1 O12 168.3(3) . .
O11 Mn1 N33 90.0(2) . 1_455
N11 Mn1 N33 171.57(17) . 1_455
N24 Mn1 N33 93.64(16) . 1_455
O12 Mn1 N33 84.85(19) . 1_455
O11 Mn1 O13 173.6(3) . .
N11 Mn1 O13 88.4(3) . .
N24 Mn1 O13 88.0(3) . .
O12 Mn1 O13 80.5(3) . .
N33 Mn1 O13 93.2(3) 1_455 .
N3 O23 Mn2 123.9(3) . .
O22 N2 C52 120.4(5) . .
O22 N2 C54 120.3(5) . .
C52 N2 C54 119.2(4) . .
N7 O32 Mn3 129.4(3) . .
O52 N5 C61 120.5(5) . .
O52 N5 C59 118.9(5) . .
C61 N5 C59 120.5(5) . .
N1 O63 Mn6 130.2(3) . 1_545
O63 N1 C51 119.9(5) . .
O63 N1 C53 121.1(5) . .
C51 N1 C53 118.8(5) . .
O62 N4 C57 121.1(5) . .
O62 N4 C56 119.5(5) . .
C57 N4 C56 119.3(5) . .
N8 O53 Mn5 129.2(3) . 1_565
O32 N7 C65 120.1(5) . .
O32 N7 C63 120.5(4) . .
C65 N7 C63 119.3(5) . .
C26 N26 Mn6 174.8(5) . .
N6 O33 Mn3 125.0(3) . .
N4 O62 Mn6 131.1(3) . .
N2 O22 Mn2 128.5(3) . .
C38 N38 Mn5 177.7(5) . .
O33 N6 C62 121.2(4) . .
O33 N6 C60 120.0(5) . .
C62 N6 C60 118.8(4) . .
N5 O52 Mn5 129.0(3) . .
C16 N16 Mn2 171.2(5) . .
C46 N46 Mn3 170.6(5) . .
C36 N36 Mn3 176.1(5) . .
C21 N21 Mn4 168.1(4) . 1_455
O23 N3 C58 120.9(5) . .
O23 N3 C55 120.1(5) . .
C58 N3 C55 119.0(5) . .
O53 N8 C66 123.5(5) . .
O53 N8 C64 119.7(5) . .
C66 N8 C64 116.8(4) . .
N28 C28 W2 178.9(5) . .
C28 N28 Mn2 176.3(5) . .
C47 N47 Mn6 159.3(5) . .
C17 N17 Mn5 159.0(5) . .
N36 C36 W3 178.4(6) . .
N45 C45 W4 178.7(6) . .
C27 N27 Mn3 166.4(5) . .
N25 C25 W2 178.5(5) . .
N46 C46 W4 178.1(5) . .
N18 C18 W1 177.5(5) . .
N27 C27 W2 178.3(5) . .
N38 C38 W3 175.2(5) . .
N22 C22 W2 178.5(6) . .
N26 C26 W2 174.7(5) . .
N21 C21 W2 178.0(5) . .
N32 C32 W3 178.1(6) . .
N23 C23 W2 178.3(5) . .
N48 C48 W4 175.6(5) . .
C37 N37 Mn2 165.7(5) . .
N37 C37 W3 179.5(5) . .
N17 C17 W1 177.9(5) . .
N13 C13 W1 178.7(5) . .
N16 C16 W1 178.8(5) . .
N12 C12 W1 177.9(5) . .
N35 C35 W3 176.9(6) . .
N47 C47 W4 178.0(5) . .
C34 N34 Mn4 175.5(5) . .
N33 C33 W3 178.4(5) . .
N15 C15 W1 178.9(6) . .
C11 N11 Mn1 174.7(5) . .
C41 N41 Mn4 173.2(5) . .
C24 N24 Mn1 164.3(5) . .
N43 C43 W4 177.7(5) . .
N41 C41 W4 179.0(5) . .
N11 C11 W1 178.4(5) . .
N2 C54 C53 120.1(5) . .
N2 C54 H54 120 . .
C53 C54 H54 120 . .
N24 C24 W2 178.7(5) . .
N42 C42 W4 177.8(6) . .
N7 C65 C66 119.8(6) . .
N7 C65 H65 120.1 . .
C66 C65 H65 120.1 . .
N31 C31 W3 177.3(5) . .
N1 C51 C52 121.7(5) . .
N1 C51 H51 119.2 . .
C52 C51 H51 119.2 . .
N5 C59 C60 119.1(5) . .
N5 C59 H59 120.5 . .
C60 C59 H59 120.5 . .
N6 C62 C61 120.7(5) . .
N6 C62 H62 119.7 . .
C61 C62 H62 119.7 . .
N2 C52 C51 118.7(5) . .
N2 C52 H52 120.6 . .
C51 C52 H52 120.6 . .
N1 C53 C54 121.3(6) . .
N1 C53 H53 119.3 . .
C54 C53 H53 119.3 . .
C59 C60 N6 120.8(5) . .
C59 C60 H60 119.6 . .
N6 C60 H60 119.6 . .
N8 C66 C65 122.6(5) . .
N8 C66 H66 118.7 . .
C65 C66 H66 118.7 . .
N4 C57 C58 119.5(5) . .
N4 C57 H57 120.3 . .
C58 C57 H57 120.3 . .
N3 C55 C56 120.9(6) . .
N3 C55 H55 119.5 . .
C56 C55 H55 119.5 . .
N34 C34 W3 179.0(5) . .
N3 C58 C57 121.2(5) . .
N3 C58 H58 119.4 . .
C57 C58 H58 119.4 . .
N8 C64 C63 121.2(6) . .
N8 C64 H64 119.4 . .
C63 C64 H64 119.4 . .
N5 C61 C62 120.1(6) . .
N5 C61 H61 120 . .
C62 C61 H61 120 . .
N14 C14 W1 177.7(6) . .
N7 C63 C64 120.2(5) . .
N7 C63 H63 119.9 . .
C64 C63 H63 119.9 . .
C55 C56 N4 120.1(6) . .
C55 C56 H56 119.9 . .
N4 C56 H56 119.9 . .
N44 C44 W4 179.2(7) . .
C5 O31 Mn3 122.6(4) . .
C4 O21 Mn2 125.7(5) . .
C9 O51 Mn5 130.7(4) . .
C10 O61 Mn6 131.3(6) . .
C18 N18 Mn6 169.4(4) . 1_545
C48 N48 Mn5 171.7(4) . 1_565
C7 O42 Mn4 125.0(5) . .
C6 O41 Mn4 124.2(6) . .
C8 O43 Mn4 120.0(8) . .
C1 O11 Mn1 123.4(8) . .
O31 C5 H5A 109.5 . .
O31 C5 H5B 109.5 . .
H5A C5 H5B 109.5 . .
O31 C5 H5C 109.5 . .
H5A C5 H5C 109.5 . .
H5B C5 H5C 109.5 . .
O21 C4 H4A 109.5 . .
O21 C4 H4B 109.5 . .
H4A C4 H4B 109.5 . .
O21 C4 H4C 109.5 . .
H4A C4 H4C 109.5 . .
H4B C4 H4C 109.5 . .
O51 C9 H9A 109.5 . .
O51 C9 H9B 109.5 . .
H9A C9 H9B 109.5 . .
O51 C9 H9C 109.5 . .
H9A C9 H9C 109.5 . .
H9B C9 H9C 109.5 . .
C3 O13 Mn1 117.9(11) . .
C2 O12 Mn1 123.6(5) . .
O61 C10 H10A 109.5 . .
O61 C10 H10B 109.5 . .
H10A C10 H10B 109.5 . .
O61 C10 H10C 109.5 . .
H10A C10 H10C 109.5 . .
H10B C10 H10C 109.5 . .
C33 N33 Mn1 166.9(4) . 1_655
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
W2 C21 2.137(5) .
W2 C28 2.142(5) .
W2 C22 2.145(5) .
W2 C23 2.154(6) .
W2 C27 2.158(6) .
W2 C25 2.159(6) .
W2 C24 2.163(4) .
W2 C26 2.164(5) .
W3 C33 2.153(5) .
W3 C36 2.161(6) .
W3 C34 2.162(4) .
W3 C37 2.163(5) .
W3 C32 2.167(5) .
W3 C38 2.170(5) .
W3 C31 2.172(6) .
W3 C35 2.173(6) .
W4 C41 2.151(5) .
W4 C44 2.153(5) .
W4 C42 2.154(6) .
W4 C45 2.157(7) .
W4 C46 2.159(5) .
W4 C43 2.161(6) .
W4 C48 2.162(6) .
W4 C47 2.174(5) .
W1 C11 2.165(5) .
W1 C12 2.167(6) .
W1 C16 2.169(5) .
W1 C14 2.170(5) .
W1 C18 2.174(5) .
W1 C15 2.181(7) .
W1 C13 2.183(5) .
W1 C17 2.204(6) .
Mn6 O63 2.151(4) 1_565
Mn6 O62 2.182(4) .
Mn6 N26 2.195(4) .
Mn6 N18 2.197(4) 1_565
Mn6 O61 2.212(4) .
Mn6 N47 2.232(5) .
Mn2 O22 2.144(4) .
Mn2 O23 2.158(3) .
Mn2 N16 2.162(4) .
Mn2 N28 2.193(4) .
Mn2 N37 2.207(5) .
Mn2 O21 2.210(4) .
Mn5 O52 2.171(4) .
Mn5 N48 2.182(5) 1_545
Mn5 O53 2.194(4) 1_545
Mn5 N38 2.224(4) .
Mn5 N17 2.233(5) .
Mn5 O51 2.234(4) .
Mn3 O33 2.122(4) .
Mn3 N46 2.143(4) .
Mn3 O32 2.171(4) .
Mn3 N36 2.180(5) .
Mn3 N27 2.227(5) .
Mn3 O31 2.232(4) .
Mn4 O41 2.184(5) .
Mn4 O43 2.189(5) .
Mn4 O42 2.200(4) .
Mn4 N41 2.212(4) .
Mn4 N34 2.216(4) .
Mn4 N21 2.226(4) 1_655
Mn1 O11 2.155(6) .
Mn1 N11 2.178(4) .
Mn1 N24 2.210(4) .
Mn1 O12 2.212(5) .
Mn1 N33 2.213(5) 1_455
Mn1 O13 2.219(8) .
O23 N3 1.320(5) .
N2 O22 1.318(5) .
N2 C52 1.345(7) .
N2 C54 1.349(7) .
O32 N7 1.308(5) .
N5 O52 1.317(5) .
N5 C61 1.347(7) .
N5 C59 1.351(7) .
O63 N1 1.302(5) .
O63 Mn6 2.150(4) 1_545
N1 C51 1.323(7) .
N1 C53 1.326(7) .
N4 O62 1.307(5) .
N4 C57 1.330(7) .
N4 C56 1.363(8) .
O53 N8 1.297(5) .
O53 Mn5 2.194(4) 1_565
N7 C65 1.318(7) .
N7 C63 1.329(7) .
N26 C26 1.144(6) .
O33 N6 1.311(5) .
N38 C38 1.136(6) .
N6 C62 1.341(7) .
N6 C60 1.372(7) .
N16 C16 1.120(6) .
N46 C46 1.130(6) .
N36 C36 1.146(6) .
N21 C21 1.156(6) .
N21 Mn4 2.226(4) 1_455
N3 C58 1.324(7) .
N3 C55 1.345(7) .
N8 C66 1.321(7) .
N8 C64 1.345(7) .
C28 N28 1.137(6) .
N47 C47 1.144(6) .
N17 C17 1.108(6) .
C45 N45 1.151(8) .
N27 C27 1.137(6) .
C25 N25 1.152(8) .
C18 N18 1.133(6) .
C22 N22 1.139(7) .
C32 N32 1.140(7) .
C23 N23 1.141(7) .
C48 N48 1.152(6) .
N37 C37 1.148(6) .
C13 N13 1.130(7) .
C12 N12 1.141(7) .
C35 N35 1.120(7) .
N34 C34 1.150(5) .
C33 N33 1.124(6) .
C15 N15 1.143(8) .
N11 C11 1.137(6) .
N41 C41 1.140(6) .
N24 C24 1.141(5) .
N42 C42 1.137(7) .
C43 N43 1.153(7) .
C54 C53 1.354(7) .
C54 H54 0.93 .
N31 C31 1.151(7) .
C65 C66 1.360(7) .
C65 H65 0.93 .
C51 C52 1.378(7) .
C51 H51 0.93 .
C59 C60 1.362(7) .
C59 H59 0.93 .
C62 C61 1.362(7) .
C62 H62 0.93 .
C52 H52 0.93 .
C53 H53 0.93 .
C60 H60 0.93 .
C66 H66 0.93 .
C57 C58 1.382(7) .
C57 H57 0.93 .
C55 C56 1.347(7) .
C55 H55 0.93 .
C58 H58 0.93 .
C64 C63 1.360(7) .
C64 H64 0.93 .
C61 H61 0.93 .
C14 N14 1.139(6) .
C63 H63 0.93 .
C56 H56 0.93 .
C44 N44 1.144(6) .
O31 C5 1.402(7) .
O21 C4 1.433(8) .
O51 C9 1.435(8) .
O61 C10 1.396(8) .
N18 Mn6 2.197(4) 1_545
N48 Mn5 2.182(5) 1_565
O42 C7 1.402(10) .
O41 C6 1.400(12) .
O43 C8 1.553(9) .
O11 C1 1.450(11) .
C5 H5A 0.96 .
C5 H5B 0.96 .
C5 H5C 0.96 .
C4 H4A 0.96 .
C4 H4B 0.96 .
C4 H4C 0.96 .
C9 H9A 0.96 .
C9 H9B 0.96 .
C9 H9C 0.96 .
O13 C3 1.54(2) .
O12 C2 1.531(11) .
C10 H10A 0.96 .
C10 H10B 0.96 .
C10 H10C 0.96 .
N33 Mn1 2.213(5) 1_655
O2S C2S 1.429(10) .
O1S C1S 1.634(14) .
O3S C3S 1.446(12) .
O4S C4S 1.372(17) .
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
O22 Mn2 O23 N3 -159.3(4) .
N28 Mn2 O23 N3 17.8(4) .
N37 Mn2 O23 N3 -74.9(4) .
O21 Mn2 O23 N3 109.4(4) .
O33 Mn3 O32 N7 154.8(5) .
N46 Mn3 O32 N7 -12.8(5) .
N27 Mn3 O32 N7 -114.8(5) .
O31 Mn3 O32 N7 74.7(5) .
Mn6 O63 N1 C51 -100.8(6) 1_545
Mn6 O63 N1 C53 83.4(6) 1_545
Mn3 O32 N7 C65 -63.6(7) .
Mn3 O32 N7 C63 120.1(5) .
N46 Mn3 O33 N6 -113.6(8) .
O32 Mn3 O33 N6 155.1(4) .
N36 Mn3 O33 N6 -21.0(4) .
N27 Mn3 O33 N6 71.1(4) .
O31 Mn3 O33 N6 -114.2(4) .
C57 N4 O62 Mn6 59.1(8) .
C56 N4 O62 Mn6 -124.5(5) .
O63 Mn6 O62 N4 -155.2(5) 1_565
N26 Mn6 O62 N4 11.3(5) .
O61 Mn6 O62 N4 -76.2(5) .
N47 Mn6 O62 N4 117.2(5) .
C52 N2 O22 Mn2 68.5(6) .
C54 N2 O22 Mn2 -115.0(5) .
O23 Mn2 O22 N2 -158.2(5) .
N16 Mn2 O22 N2 13.1(5) .
N37 Mn2 O22 N2 112.5(5) .
O21 Mn2 O22 N2 -76.5(5) .
O33 Mn3 O31 C5 126.5(5) .
N46 Mn3 O31 C5 -53.4(5) .
O32 Mn3 O31 C5 -141.9(5) .
N36 Mn3 O31 C5 38.2(5) .
N27 Mn3 O31 C5 155.8(8) .
O22 Mn2 O21 C4 132.3(6) .
O23 Mn2 O21 C4 -135.9(6) .
N16 Mn2 O21 C4 44.7(6) .
N28 Mn2 O21 C4 -46.4(6) .
O52 Mn5 O51 C9 -111.1(7) .
N48 Mn5 O51 C9 70.7(7) 1_545
O53 Mn5 O51 C9 160.6(7) 1_545
N38 Mn5 O51 C9 -23.0(7) .
N17 Mn5 O51 C9 -171.3(7) .
O63 Mn6 O61 C10 -145.9(8) 1_565
O62 Mn6 O61 C10 125.6(8) .
N26 Mn6 O61 C10 36.4(8) .
N18 Mn6 O61 C10 -57.3(8) 1_565
N47 Mn6 O61 C10 -173.9(8) .
O41 Mn4 O42 C7 -119.8(10) .
O43 Mn4 O42 C7 61.4(10) .
N41 Mn4 O42 C7 152.5(10) .
N21 Mn4 O42 C7 -28.7(10) 1_655
O42 Mn4 O41 C6 100.7(11) .
N41 Mn4 O41 C6 -172.7(11) .
N34 Mn4 O41 C6 -76.5(11) .
N21 Mn4 O41 C6 16.6(11) 1_655
O42 Mn4 O43 C8 44.1(8) .
N41 Mn4 O43 C8 -42.3(8) .
N34 Mn4 O43 C8 -138.6(8) .
N21 Mn4 O43 C8 128.3(8) 1_655
N11 Mn1 O11 C1 41.2(11) .
N24 Mn1 O11 C1 135.6(11) .
O12 Mn1 O11 C1 -45.9(11) .
N33 Mn1 O11 C1 -130.7(11) 1_455
N11 Mn1 O13 C3 151.9(12) .
N24 Mn1 O13 C3 57.1(12) .
O12 Mn1 O13 C3 -120.7(12) .
N33 Mn1 O13 C3 -36.4(12) 1_455
O11 Mn1 O12 C2 -126.1(9) .
N11 Mn1 O12 C2 146.5(9) .
N24 Mn1 O12 C2 46.6(15) .
N33 Mn1 O12 C2 -36.5(9) 1_455
O13 Mn1 O12 C2 57.7(9) .
