#------------------------------------------------------------------------------
#$Date: 2016-03-24 17:18:11 +0200 (Thu, 24 Mar 2016) $
#$Revision: 179684 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/06/7000676.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_7000676
loop_
_publ_author_name
'Chomitz, Wayne A.'
'Arnold, John'
_publ_section_title
;
 Synthesis and characterization of manganese and iron complexes
 supported by multidentate [N2P2] ligands
;
_journal_issue                   10
_journal_name_full               'Dalton Transactions'
_journal_page_first              1714
_journal_page_last               1720
_journal_paper_doi               10.1039/b821954k
_journal_year                    2009
_chemical_formula_moiety         'C44 H104 Mn2 N4 P4 Si2'
_chemical_formula_sum            'C44 H104 Mn2 N4 P4 Si2'
_chemical_formula_weight         979.25
_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                 107.880(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   49.385(5)
_cell_length_b                   10.9384(11)
_cell_length_c                   22.807(2)
_cell_measurement_reflns_used    3749
_cell_measurement_temperature    160(2)
_cell_measurement_theta_max      20.3
_cell_measurement_theta_min      2.3
_cell_volume                     11725(2)
_computing_cell_refinement       'Bruker SAINT v7.07'
_computing_data_collection       'Bruker SMART v5.631'
_computing_data_reduction        'Bruker SAINT v7.07'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      160(2)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Bruker APEX'
_diffrn_measurement_method       'w\ 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  0.0722
_diffrn_reflns_av_sigmaI/netI    0.0919
_diffrn_reflns_limit_h_max       55
_diffrn_reflns_limit_h_min       -61
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       28
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            36872
_diffrn_reflns_theta_full        26.38
_diffrn_reflns_theta_max         26.38
_diffrn_reflns_theta_min         2.13
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    0.611
_exptl_absorpt_correction_T_max  1.00
_exptl_absorpt_correction_T_min  0.86
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   'Blessing, 1995'
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.109
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       blade-like
_exptl_crystal_F_000             4272
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.18
_exptl_crystal_size_min          0.06
_refine_diff_density_max         0.405
_refine_diff_density_min         -0.286
_refine_diff_density_rms         0.066
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.898
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     539
_refine_ls_number_reflns         11906
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.898
_refine_ls_R_factor_all          0.1032
_refine_ls_R_factor_gt           0.0479
_refine_ls_shift/su_max          0.010
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0600P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0996
_refine_ls_wR_factor_ref         0.1179
_reflns_number_gt                7019
_reflns_number_total             11906
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b821954k.txt
_cod_data_source_block           wac6161x
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               7000676
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
_atom_site_disorder_assembly
_atom_site_disorder_group
Mn1 Mn 0.095651(9) 0.53697(4) 0.47091(2) 0.02814(12) Uani 1 1 d . . .
Mn2 Mn 0.145641(9) 0.60408(4) 0.44614(2) 0.02916(13) Uani 1 1 d . . .
Si1 Si 0.07966(2) 0.47236(8) 0.58159(4) 0.0348(2) Uani 1 1 d . . .
Si2 Si 0.175646(18) 0.83709(8) 0.45658(4) 0.0343(2) Uani 1 1 d . . .
P1 P 0.052972(17) 0.66884(7) 0.40758(4) 0.02956(19) Uani 1 1 d . . .
P2 P 0.072513(18) 0.88526(8) 0.68373(4) 0.0349(2) Uani 1 1 d . . .
P3 P 0.186129(17) 0.44071(8) 0.48487(4) 0.0334(2) Uani 1 1 d . . .
P4 P 0.213310(19) 0.82399(9) 0.70316(4) 0.0414(2) Uani 1 1 d . . .
N1 N 0.08381(5) 0.4020(2) 0.51896(11) 0.0326(6) Uani 1 1 d . . .
N2 N 0.06597(5) 0.6159(2) 0.55128(11) 0.0313(6) Uani 1 1 d . . .
N3 N 0.15564(5) 0.7473(2) 0.39995(11) 0.0325(6) Uani 1 1 d . . .
N4 N 0.18974(5) 0.7285(2) 0.51564(11) 0.0307(6) Uani 1 1 d . . .
C1 C 0.08322(7) 0.2697(3) 0.50671(15) 0.0383(8) Uani 1 1 d . . .
C2 C 0.10046(8) 0.1967(3) 0.56282(16) 0.0503(9) Uani 1 1 d . . .
H2A H 0.1204 0.2222 0.5744 0.075 Uiso 1 1 calc R . .
H2B H 0.0991 0.1093 0.5528 0.075 Uiso 1 1 calc R . .
H2C H 0.0930 0.2117 0.5973 0.075 Uiso 1 1 calc R . .
C3 C 0.09587(8) 0.2471(3) 0.45478(17) 0.0531(10) Uani 1 1 d . . .
H3A H 0.1159 0.2719 0.4680 0.080 Uiso 1 1 calc R . .
H3B H 0.0854 0.2949 0.4186 0.080 Uiso 1 1 calc R . .
H3C H 0.0945 0.1600 0.4443 0.080 Uiso 1 1 calc R . .
C4 C 0.05237(7) 0.2229(3) 0.48567(16) 0.0494(9) Uani 1 1 d . . .
H4A H 0.0415 0.2667 0.4484 0.074 Uiso 1 1 calc R . .
H4B H 0.0437 0.2371 0.5184 0.074 Uiso 1 1 calc R . .
H4C H 0.0522 0.1352 0.4769 0.074 Uiso 1 1 calc R . .
C5 C 0.11351(7) 0.5014(3) 0.64502(14) 0.0457(9) Uani 1 1 d . . .
H5A H 0.1093 0.5451 0.6787 0.069 Uiso 1 1 calc R . .
H5B H 0.1263 0.5510 0.6293 0.069 Uiso 1 1 calc R . .
H5C H 0.1227 0.4233 0.6603 0.069 Uiso 1 1 calc R . .
C6 C 0.05426(8) 0.4005(3) 0.61869(17) 0.0562(10) Uani 1 1 d . . .
H6A H 0.0533 0.4510 0.6534 0.084 Uiso 1 1 calc R . .
H6B H 0.0610 0.3185 0.6335 0.084 Uiso 1 1 calc R . .
H6C H 0.0353 0.3946 0.5884 0.084 Uiso 1 1 calc R . .
C7 C 0.03641(6) 0.6147(3) 0.51120(14) 0.0355(8) Uani 1 1 d . . .
H7A H 0.0238 0.6360 0.5360 0.043 Uiso 1 1 calc R . .
H7B H 0.0315 0.5308 0.4952 0.043 Uiso 1 1 calc R . .
C8 C 0.03066(6) 0.7030(3) 0.45683(14) 0.0360(8) Uani 1 1 d . . .
H8A H 0.0344 0.7877 0.4726 0.043 Uiso 1 1 calc R . .
H8B H 0.0104 0.6976 0.4320 0.043 Uiso 1 1 calc R . .
C9 C 0.02849(6) 0.5958(3) 0.33883(13) 0.0341(7) Uani 1 1 d . . .
H9A H 0.0114 0.6493 0.3222 0.041 Uiso 1 1 calc R . .
C10 C 0.01892(7) 0.4722(3) 0.35669(15) 0.0431(9) Uani 1 1 d . . .
H10A H 0.0067 0.4314 0.3198 0.065 Uiso 1 1 calc R . .
H10B H 0.0083 0.4848 0.3860 0.065 Uiso 1 1 calc R . .
H10C H 0.0356 0.4213 0.3757 0.065 Uiso 1 1 calc R . .
C11 C 0.04339(7) 0.5799(3) 0.28956(14) 0.0446(9) Uani 1 1 d . . .
H11A H 0.0312 0.5323 0.2551 0.067 Uiso 1 1 calc R . .
H11B H 0.0615 0.5369 0.3073 0.067 Uiso 1 1 calc R . .
H11C H 0.0470 0.6604 0.2747 0.067 Uiso 1 1 calc R . .
C12 C 0.06031(7) 0.8207(3) 0.38051(15) 0.0380(8) Uani 1 1 d . . .
H12A H 0.0696 0.8068 0.3478 0.046 Uiso 1 1 calc R . .
C13 C 0.08173(8) 0.8874(3) 0.43295(18) 0.0562(10) Uani 1 1 d . . .
H13A H 0.0873 0.9640 0.4176 0.084 Uiso 1 1 calc R . .
H13B H 0.0986 0.8358 0.4497 0.084 Uiso 1 1 calc R . .
H13C H 0.0731 0.9054 0.4654 0.084 Uiso 1 1 calc R . .
C14 C 0.03409(7) 0.8997(3) 0.35227(16) 0.0495(9) Uani 1 1 d . . .
H14A H 0.0399 0.9782 0.3393 0.074 Uiso 1 1 calc R . .
H14B H 0.0242 0.9140 0.3829 0.074 Uiso 1 1 calc R . .
H14C H 0.0213 0.8577 0.3165 0.074 Uiso 1 1 calc R . .
C15 C 0.07389(6) 0.7273(3) 0.58795(13) 0.0314(7) Uani 1 1 d . . .
H15A H 0.0682 0.7985 0.5601 0.038 Uiso 1 1 calc R . .
H15B H 0.0949 0.7293 0.6057 0.038 Uiso 1 1 calc R . .
C16 C 0.06076(7) 0.7418(3) 0.64079(14) 0.0393(8) Uani 1 1 d . . .
H16A H 0.0664 0.6716 0.6693 0.047 Uiso 1 1 calc R . .
H16B H 0.0398 0.7417 0.6236 0.047 Uiso 1 1 calc R . .
C17 C 0.04002(7) 0.9794(3) 0.65766(14) 0.0419(8) Uani 1 1 d . . .
H17A H 0.0240 0.9361 0.6671 0.050 Uiso 1 1 calc R . .
C18 C 0.04584(9) 1.1012(3) 0.69281(18) 0.0622(11) Uani 1 1 d . . .
H18A H 0.0293 1.1551 0.6774 0.093 Uiso 1 1 calc R . .
H18B H 0.0626 1.1402 0.6866 0.093 Uiso 1 1 calc R . .
H18C H 0.0493 1.0859 0.7368 0.093 Uiso 1 1 calc R . .
C19 C 0.03212(9) 1.0017(4) 0.58816(16) 0.0599(11) Uani 1 1 d . . .
H19A H 0.0171 1.0635 0.5760 0.090 Uiso 1 1 calc R . .
H19B H 0.0254 0.9252 0.5661 0.090 Uiso 1 1 calc R . .
H19C H 0.0489 1.0306 0.5779 0.090 Uiso 1 1 calc R . .
C20 C 0.07316(7) 0.8404(3) 0.76289(14) 0.0419(9) Uani 1 1 d . . .
H20A H 0.0763 0.9173 0.7878 0.050 Uiso 1 1 calc R . .
C21 C 0.04607(8) 0.7829(3) 0.76888(15) 0.0499(10) Uani 1 1 d . . .
H21A H 0.0483 0.7672 0.8124 0.075 Uiso 1 1 calc R . .
H21B H 0.0424 0.7057 0.7460 0.075 Uiso 1 1 calc R . .
H21C H 0.0301 0.8388 0.7521 0.075 Uiso 1 1 calc R . .
C22 C 0.09926(9) 0.7608(5) 0.79037(17) 0.0745(14) Uani 1 1 d . . .
H22A H 0.1018 0.7473 0.8342 0.112 Uiso 1 1 calc R . .
H22B H 0.1161 0.8019 0.7857 0.112 Uiso 1 1 calc R . .
H22C H 0.0967 0.6820 0.7689 0.112 Uiso 1 1 calc R . .
C23 C 0.14491(7) 0.7752(3) 0.33332(14) 0.0394(8) Uani 1 1 d . . .
C24 C 0.13253(8) 0.9052(3) 0.32180(16) 0.0574(11) Uani 1 1 d . . .
H24A H 0.1475 0.9648 0.3406 0.086 Uiso 1 1 calc R . .
H24B H 0.1171 0.9135 0.3401 0.086 Uiso 1 1 calc R . .
H24C H 0.1251 0.9201 0.2774 0.086 Uiso 1 1 calc R . .
C25 C 0.12126(8) 0.6859(4) 0.30197(15) 0.0543(10) Uani 1 1 d . . .
H25A H 0.1290 0.6029 0.3051 0.081 Uiso 1 1 calc R . .
H25B H 0.1131 0.7081 0.2585 0.081 Uiso 1 1 calc R . .
H25C H 0.1064 0.6892 0.3222 0.081 Uiso 1 1 calc R . .
C26 C 0.16856(9) 0.7627(4) 0.30354(17) 0.0667(12) Uani 1 1 d . . .
H26A H 0.1766 0.6800 0.3107 0.100 Uiso 1 1 calc R . .
H26B H 0.1835 0.8226 0.3217 0.100 Uiso 1 1 calc R . .
H26C H 0.1608 0.7774 0.2591 0.100 Uiso 1 1 calc R . .
C27 C 0.15663(7) 0.9565(3) 0.48780(15) 0.0431(9) Uani 1 1 d . . .
H27A H 0.1705 1.0047 0.5193 0.065 Uiso 1 1 calc R . .
H27B H 0.1434 0.9169 0.5062 0.065 Uiso 1 1 calc R . .
H27C H 0.1460 1.0105 0.4543 0.065 Uiso 1 1 calc R . .
C28 C 0.20569(7) 0.9240(3) 0.44120(18) 0.0541(10) Uani 1 1 d . . .
H28A H 0.2181 0.9576 0.4800 0.081 Uiso 1 1 calc R . .
H28B H 0.1979 0.9909 0.4124 0.081 Uiso 1 1 calc R . .
H28C H 0.2166 0.8688 0.4233 0.081 Uiso 1 1 calc R . .
C29 C 0.21528(6) 0.6635(3) 0.51137(15) 0.0343(8) Uani 1 1 d . . .
H29A H 0.2324 0.7064 0.5375 0.041 Uiso 1 1 calc R . .
H29B H 0.2157 0.6679 0.4683 0.041 Uiso 1 1 calc R . .
C30 C 0.21693(6) 0.5291(3) 0.53096(14) 0.0352(8) Uani 1 1 d . . .
H30A H 0.2180 0.5243 0.5749 0.042 Uiso 1 1 calc R . .
H30B H 0.2345 0.4925 0.5266 0.042 Uiso 1 1 calc R . .
C31 C 0.18317(7) 0.3176(3) 0.53844(15) 0.0420(8) Uani 1 1 d . . .
H31A H 0.1681 0.2599 0.5144 0.050 Uiso 1 1 calc R . .
C32 C 0.17272(8) 0.3716(3) 0.58972(16) 0.0533(10) Uani 1 1 d . . .
H32A H 0.1698 0.3056 0.6163 0.080 Uiso 1 1 calc R . .
H32B H 0.1547 0.4147 0.5714 0.080 Uiso 1 1 calc R . .
H32C H 0.1869 0.4291 0.6143 0.080 Uiso 1 1 calc R . .
C33 C 0.21031(8) 0.2425(3) 0.56546(17) 0.0546(10) Uani 1 1 d . . .
H33A H 0.2068 0.1789 0.5926 0.082 Uiso 1 1 calc R . .
H33B H 0.2257 0.2962 0.5892 0.082 Uiso 1 1 calc R . .
H33C H 0.2158 0.2042 0.5320 0.082 Uiso 1 1 calc R . .
C34 C 0.19899(8) 0.3586(3) 0.42728(16) 0.0491(9) Uani 1 1 d . . .
H34A H 0.2151 0.3041 0.4499 0.059 Uiso 1 1 calc R . .
C35 C 0.17506(10) 0.2786(4) 0.38724(19) 0.0772(13) Uani 1 1 d . . .
H35A H 0.1819 0.2341 0.3572 0.116 Uiso 1 1 calc R . .
H35B H 0.1589 0.3303 0.3654 0.116 Uiso 1 1 calc R . .
H35C H 0.1691 0.2201 0.4134 0.116 Uiso 1 1 calc R . .
C36 C 0.20993(10) 0.4475(4) 0.38842(18) 0.0727(13) Uani 1 1 d . . .
H36A H 0.2157 0.4020 0.3572 0.109 Uiso 1 1 calc R . .
H36B H 0.2263 0.4923 0.4150 0.109 Uiso 1 1 calc R . .
H36C H 0.1948 0.5053 0.3681 0.109 Uiso 1 1 calc R . .
C37 C 0.18872(6) 0.7446(3) 0.57888(13) 0.0347(8) Uani 1 1 d . . .
H37A H 0.1906 0.6631 0.5986 0.042 Uiso 1 1 calc R . .
H37B H 0.1697 0.7766 0.5767 0.042 Uiso 1 1 calc R . .
C38 C 0.21116(7) 0.8291(3) 0.62067(13) 0.0370(8) Uani 1 1 d . . .
H38A H 0.2070 0.9141 0.6057 0.044 Uiso 1 1 calc R . .
H38B H 0.2300 0.8071 0.6169 0.044 Uiso 1 1 calc R . .
C39 C 0.24033(7) 0.9459(4) 0.73212(15) 0.0506(10) Uani 1 1 d . . .
H39A H 0.2362 1.0148 0.7018 0.061 Uiso 1 1 calc R . .
C40 C 0.26960(8) 0.8939(5) 0.73768(18) 0.0759(14) Uani 1 1 d . . .
H40A H 0.2839 0.9588 0.7505 0.114 Uiso 1 1 calc R . .
H40B H 0.2697 0.8612 0.6977 0.114 Uiso 1 1 calc R . .
H40C H 0.2741 0.8283 0.7684 0.114 Uiso 1 1 calc R . .
C41 C 0.24018(9) 0.9952(4) 0.79508(16) 0.0641(12) Uani 1 1 d . . .
H41A H 0.2568 1.0480 0.8121 0.096 Uiso 1 1 calc R . .
H41B H 0.2409 0.9266 0.8232 0.096 Uiso 1 1 calc R . .
H41C H 0.2228 1.0424 0.7901 0.096 Uiso 1 1 calc R . .
C42 C 0.17983(8) 0.8983(4) 0.70625(17) 0.0557(10) Uani 1 1 d . . .
H42A H 0.1835 0.9230 0.7502 0.067 Uiso 1 1 calc R . .
C43 C 0.17126(9) 1.0152(4) 0.66927(18) 0.0776(14) Uani 1 1 d . . .
H43A H 0.1552 1.0530 0.6793 0.116 Uiso 1 1 calc R . .
H43B H 0.1656 0.9961 0.6252 0.116 Uiso 1 1 calc R . .
H43C H 0.1874 1.0719 0.6795 0.116 Uiso 1 1 calc R . .
C44 C 0.15582(9) 0.8059(5) 0.6934(2) 0.0902(17) Uani 1 1 d . . .
H44A H 0.1394 0.8428 0.7021 0.135 Uiso 1 1 calc R . .
H44B H 0.1621 0.7341 0.7198 0.135 Uiso 1 1 calc R . .
H44C H 0.1504 0.7810 0.6501 0.135 Uiso 1 1 calc R . .
H100 H 0.1125(5) 0.495(2) 0.4008(10) 0.017(7) Uiso 1 1 d . . .
H101 H 0.1267(5) 0.642(2) 0.5118(11) 0.025(7) 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
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'
Si Si 0.0817 0.0704 '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'
Mn Mn 0.3368 0.7283 '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
_geom_angle_publ_flag
N1 Mn1 P1 112.68(8) . . ?
N1 Mn1 Mn2 136.00(7) . . ?
P1 Mn1 Mn2 111.00(3) . . ?
N1 Mn1 Si1 33.60(7) . . ?
P1 Mn1 Si1 102.95(3) . . ?
Mn2 Mn1 Si1 136.09(3) . . ?
N1 Mn1 H100 120.3(6) . . ?
P1 Mn1 H100 98.3(6) . . ?
Mn2 Mn1 H100 46.6(7) . . ?
Si1 Mn1 H100 152.1(6) . . ?
N1 Mn1 H101 119.5(7) . . ?
P1 Mn1 H101 109.3(7) . . ?
Mn2 Mn1 H101 46.8(7) . . ?
Si1 Mn1 H101 96.4(7) . . ?
H100 Mn1 H101 93.4(10) . . ?
N3 Mn2 P3 114.72(7) . . ?
N3 Mn2 Mn1 132.68(7) . . ?
P3 Mn2 Mn1 112.47(3) . . ?
N3 Mn2 Si2 34.05(7) . . ?
P3 Mn2 Si2 104.58(3) . . ?
Mn1 Mn2 Si2 132.09(3) . . ?
N3 Mn2 H100 118.4(6) . . ?
P3 Mn2 H100 100.5(7) . . ?
Mn1 Mn2 H100 47.6(6) . . ?
Si2 Mn2 H100 149.7(6) . . ?
N3 Mn2 H101 117.8(7) . . ?
P3 Mn2 H101 111.4(7) . . ?
Mn1 Mn2 H101 43.1(7) . . ?
Si2 Mn2 H101 95.8(7) . . ?
H100 Mn2 H101 90.7(9) . . ?
N1 Si1 N2 101.86(12) . . ?
N1 Si1 C5 114.79(14) . . ?
N2 Si1 C5 107.21(14) . . ?
N1 Si1 C6 117.34(15) . . ?
N2 Si1 C6 108.60(15) . . ?
C5 Si1 C6 106.44(17) . . ?
N1 Si1 Mn1 41.64(8) . . ?
N2 Si1 Mn1 67.84(8) . . ?
C5 Si1 Mn1 102.15(11) . . ?
C6 Si1 Mn1 150.73(13) . . ?
N3 Si2 N4 101.17(12) . . ?
N3 Si2 C27 117.05(14) . . ?
N4 Si2 C27 107.74(14) . . ?
N3 Si2 C28 117.55(16) . . ?
N4 Si2 C28 109.40(14) . . ?
C27 Si2 C28 103.55(17) . . ?
N3 Si2 Mn2 42.58(8) . . ?
N4 Si2 Mn2 63.11(8) . . ?
C27 Si2 Mn2 109.79(11) . . ?
C28 Si2 Mn2 146.53(13) . . ?
C8 P1 C9 104.38(14) . . ?
C8 P1 C12 103.74(15) . . ?
C9 P1 C12 104.51(15) . . ?
C8 P1 Mn1 108.05(10) . . ?
C9 P1 Mn1 116.17(11) . . ?
C12 P1 Mn1 118.47(11) . . ?
C17 P2 C16 101.71(16) . . ?
C17 P2 C20 102.35(15) . . ?
C16 P2 C20 101.49(15) . . ?
C30 P3 C31 102.96(14) . . ?
C30 P3 C34 104.87(16) . . ?
C31 P3 C34 103.18(17) . . ?
C30 P3 Mn2 104.22(10) . . ?
C31 P3 Mn2 120.69(11) . . ?
C34 P3 Mn2 118.83(12) . . ?
C38 P4 C39 98.63(15) . . ?
C38 P4 C42 104.50(16) . . ?
C39 P4 C42 102.82(18) . . ?
C1 N1 Si1 127.4(2) . . ?
C1 N1 Mn1 127.24(19) . . ?
Si1 N1 Mn1 104.76(13) . . ?
C15 N2 C7 113.9(2) . . ?
C15 N2 Si1 120.96(19) . . ?
C7 N2 Si1 115.2(2) . . ?
C23 N3 Si2 127.5(2) . . ?
C23 N3 Mn2 128.6(2) . . ?
Si2 N3 Mn2 103.37(12) . . ?
C37 N4 C29 114.2(2) . . ?
C37 N4 Si2 122.9(2) . . ?
C29 N4 Si2 114.64(19) . . ?
N1 C1 C3 108.6(3) . . ?
N1 C1 C2 112.4(3) . . ?
C3 C1 C2 108.1(3) . . ?
N1 C1 C4 110.3(3) . . ?
C3 C1 C4 107.9(3) . . ?
C2 C1 C4 109.4(3) . . ?
C1 C2 H2A 109.5 . . ?
C1 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
C1 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
C1 C3 H3A 109.5 . . ?
C1 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
C1 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C1 C4 H4A 109.5 . . ?
C1 C4 H4B 109.5 . . ?
H4A C4 H4B 109.5 . . ?
C1 C4 H4C 109.5 . . ?
H4A C4 H4C 109.5 . . ?
H4B C4 H4C 109.5 . . ?
Si1 C5 H5A 109.5 . . ?
Si1 C5 H5B 109.5 . . ?
H5A C5 H5B 109.5 . . ?
Si1 C5 H5C 109.5 . . ?
H5A C5 H5C 109.5 . . ?
H5B C5 H5C 109.5 . . ?
Si1 C6 H6A 109.5 . . ?
Si1 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
Si1 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
N2 C7 C8 113.7(3) . . ?
N2 C7 H7A 108.8 . . ?
C8 C7 H7A 108.8 . . ?
N2 C7 H7B 108.8 . . ?
C8 C7 H7B 108.8 . . ?
H7A C7 H7B 107.7 . . ?
C7 C8 P1 111.7(2) . . ?
C7 C8 H8A 109.3 . . ?
P1 C8 H8A 109.3 . . ?
C7 C8 H8B 109.3 . . ?
P1 C8 H8B 109.3 . . ?
H8A C8 H8B 107.9 . . ?
C10 C9 C11 110.7(3) . . ?
C10 C9 P1 109.4(2) . . ?
C11 C9 P1 109.6(2) . . ?
C10 C9 H9A 109.0 . . ?
C11 C9 H9A 109.0 . . ?
P1 C9 H9A 109.0 . . ?
C9 C10 H10A 109.5 . . ?
C9 C10 H10B 109.5 . . ?
H10A C10 H10B 109.5 . . ?
C9 C10 H10C 109.5 . . ?
H10A C10 H10C 109.5 . . ?
H10B C10 H10C 109.5 . . ?
C9 C11 H11A 109.5 . . ?
C9 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C9 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C13 C12 C14 110.9(3) . . ?
C13 C12 P1 109.2(2) . . ?
C14 C12 P1 115.0(2) . . ?
C13 C12 H12A 107.1 . . ?
C14 C12 H12A 107.1 . . ?
P1 C12 H12A 107.1 . . ?
C12 C13 H13A 109.5 . . ?
C12 C13 H13B 109.5 . . ?
H13A C13 H13B 109.5 . . ?
C12 C13 H13C 109.5 . . ?
H13A C13 H13C 109.5 . . ?
H13B C13 H13C 109.5 . . ?
C12 C14 H14A 109.5 . . ?
C12 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C12 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
N2 C15 C16 115.5(2) . . ?
N2 C15 H15A 108.4 . . ?
C16 C15 H15A 108.4 . . ?
N2 C15 H15B 108.4 . . ?
C16 C15 H15B 108.4 . . ?
H15A C15 H15B 107.5 . . ?
C15 C16 P2 111.3(2) . . ?
C15 C16 H16A 109.4 . . ?
P2 C16 H16A 109.4 . . ?
C15 C16 H16B 109.4 . . ?
P2 C16 H16B 109.4 . . ?
H16A C16 H16B 108.0 . . ?
C19 C17 C18 110.5(3) . . ?
C19 C17 P2 110.0(2) . . ?
C18 C17 P2 108.1(2) . . ?
C19 C17 H17A 109.4 . . ?
C18 C17 H17A 109.4 . . ?
P2 C17 H17A 109.4 . . ?
C17 C18 H18A 109.5 . . ?
C17 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C17 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C17 C19 H19A 109.5 . . ?
C17 C19 H19B 109.5 . . ?
H19A C19 H19B 109.5 . . ?
C17 C19 H19C 109.5 . . ?
H19A C19 H19C 109.5 . . ?
H19B C19 H19C 109.5 . . ?
C21 C20 C22 112.6(3) . . ?
C21 C20 P2 116.2(2) . . ?
C22 C20 P2 108.1(2) . . ?
C21 C20 H20A 106.5 . . ?
C22 C20 H20A 106.5 . . ?
P2 C20 H20A 106.5 . . ?
C20 C21 H21A 109.5 . . ?
C20 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C20 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C20 C22 H22A 109.5 . . ?
C20 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
C20 C22 H22C 109.5 . . ?
H22A C22 H22C 109.5 . . ?
H22B C22 H22C 109.5 . . ?
N3 C23 C25 109.3(3) . . ?
N3 C23 C26 110.9(3) . . ?
C25 C23 C26 108.4(3) . . ?
N3 C23 C24 111.4(3) . . ?
C25 C23 C24 107.8(3) . . ?
C26 C23 C24 109.0(3) . . ?
C23 C24 H24A 109.5 . . ?
C23 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C23 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C23 C25 H25A 109.5 . . ?
C23 C25 H25B 109.5 . . ?
H25A C25 H25B 109.5 . . ?
C23 C25 H25C 109.5 . . ?
H25A C25 H25C 109.5 . . ?
H25B C25 H25C 109.5 . . ?
C23 C26 H26A 109.5 . . ?
C23 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C23 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
Si2 C27 H27A 109.5 . . ?
Si2 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
Si2 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
Si2 C28 H28A 109.5 . . ?
Si2 C28 H28B 109.5 . . ?
H28A C28 H28B 109.5 . . ?
Si2 C28 H28C 109.5 . . ?
H28A C28 H28C 109.5 . . ?
H28B C28 H28C 109.5 . . ?
N4 C29 C30 114.4(2) . . ?
N4 C29 H29A 108.7 . . ?
C30 C29 H29A 108.7 . . ?
N4 C29 H29B 108.7 . . ?
C30 C29 H29B 108.7 . . ?
H29A C29 H29B 107.6 . . ?
C29 C30 P3 112.2(2) . . ?
C29 C30 H30A 109.2 . . ?
P3 C30 H30A 109.2 . . ?
C29 C30 H30B 109.2 . . ?
P3 C30 H30B 109.2 . . ?
H30A C30 H30B 107.9 . . ?
C33 C31 C32 111.0(3) . . ?
C33 C31 P3 114.8(2) . . ?
C32 C31 P3 109.6(2) . . ?
C33 C31 H31A 107.0 . . ?
C32 C31 H31A 107.0 . . ?
P3 C31 H31A 107.0 . . ?
C31 C32 H32A 109.5 . . ?
C31 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C31 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C31 C33 H33A 109.5 . . ?
C31 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
C31 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C36 C34 C35 111.4(3) . . ?
C36 C34 P3 111.3(3) . . ?
C35 C34 P3 109.3(3) . . ?
C36 C34 H34A 108.3 . . ?
C35 C34 H34A 108.3 . . ?
P3 C34 H34A 108.3 . . ?
C34 C35 H35A 109.5 . . ?
C34 C35 H35B 109.5 . . ?
H35A C35 H35B 109.5 . . ?
C34 C35 H35C 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C34 C36 H36A 109.5 . . ?
C34 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
C34 C36 H36C 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
N4 C37 C38 116.5(3) . . ?
N4 C37 H37A 108.2 . . ?
C38 C37 H37A 108.2 . . ?
N4 C37 H37B 108.2 . . ?
C38 C37 H37B 108.2 . . ?
H37A C37 H37B 107.3 . . ?
C37 C38 P4 114.7(2) . . ?
C37 C38 H38A 108.6 . . ?
P4 C38 H38A 108.6 . . ?
C37 C38 H38B 108.6 . . ?
P4 C38 H38B 108.6 . . ?
H38A C38 H38B 107.6 . . ?
C40 C39 C41 109.3(3) . . ?
C40 C39 P4 108.7(3) . . ?
C41 C39 P4 112.0(3) . . ?
C40 C39 H39A 108.9 . . ?
C41 C39 H39A 108.9 . . ?
P4 C39 H39A 108.9 . . ?
C39 C40 H40A 109.5 . . ?
C39 C40 H40B 109.5 . . ?
H40A C40 H40B 109.5 . . ?
C39 C40 H40C 109.5 . . ?
H40A C40 H40C 109.5 . . ?
H40B C40 H40C 109.5 . . ?
C39 C41 H41A 109.5 . . ?
C39 C41 H41B 109.5 . . ?
H41A C41 H41B 109.5 . . ?
C39 C41 H41C 109.5 . . ?
H41A C41 H41C 109.5 . . ?
H41B C41 H41C 109.5 . . ?
C44 C42 C43 112.7(4) . . ?
C44 C42 P4 110.6(3) . . ?
C43 C42 P4 116.5(3) . . ?
C44 C42 H42A 105.3 . . ?
C43 C42 H42A 105.3 . . ?
P4 C42 H42A 105.3 . . ?
C42 C43 H43A 109.5 . . ?
C42 C43 H43B 109.5 . . ?
H43A C43 H43B 109.5 . . ?
C42 C43 H43C 109.5 . . ?
H43A C43 H43C 109.5 . . ?
H43B C43 H43C 109.5 . . ?
C42 C44 H44A 109.5 . . ?
C42 C44 H44B 109.5 . . ?
H44A C44 H44B 109.5 . . ?
C42 C44 H44C 109.5 . . ?
H44A C44 H44C 109.5 . . ?
H44B C44 H44C 109.5 . . ?
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
Mn1 N1 2.029(2) . ?
Mn1 P1 2.5961(9) . ?
Mn1 Mn2 2.7945(7) . ?
Mn1 Si1 2.9528(10) . ?
Mn1 H100 2.07(2) . ?
Mn1 H101 1.91(2) . ?
Mn2 N3 2.032(2) . ?
Mn2 P3 2.6244(9) . ?
Mn2 Si2 2.9209(10) . ?
Mn2 H100 2.04(2) . ?
Mn2 H101 2.04(2) . ?
Si1 N1 1.690(2) . ?
Si1 N2 1.764(3) . ?
Si1 C5 1.871(3) . ?
Si1 C6 1.887(3) . ?
Si2 N3 1.681(3) . ?
Si2 N4 1.770(3) . ?
Si2 C27 1.872(3) . ?
Si2 C28 1.884(3) . ?
P1 C8 1.837(3) . ?
P1 C9 1.843(3) . ?
P1 C12 1.847(3) . ?
P2 C17 1.845(3) . ?
P2 C16 1.846(3) . ?
P2 C20 1.862(3) . ?
P3 C30 1.836(3) . ?
P3 C31 1.854(3) . ?
P3 C34 1.857(3) . ?
P4 C38 1.852(3) . ?
P4 C39 1.859(4) . ?
P4 C42 1.863(4) . ?
N1 C1 1.472(4) . ?
N2 C15 1.461(4) . ?
N2 C7 1.465(4) . ?
N3 C23 1.480(4) . ?
N4 C37 1.469(4) . ?
N4 C29 1.477(4) . ?
C1 C3 1.519(5) . ?
C1 C2 1.527(4) . ?
C1 C4 1.538(4) . ?
C2 H2A 0.9800 . ?
C2 H2B 0.9800 . ?
C2 H2C 0.9800 . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C4 H4A 0.9800 . ?
C4 H4B 0.9800 . ?
C4 H4C 0.9800 . ?
C5 H5A 0.9800 . ?
C5 H5B 0.9800 . ?
C5 H5C 0.9800 . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
C7 C8 1.528(4) . ?
C7 H7A 0.9900 . ?
C7 H7B 0.9900 . ?
C8 H8A 0.9900 . ?
C8 H8B 0.9900 . ?
C9 C10 1.528(4) . ?
C9 C11 1.531(4) . ?
C9 H9A 1.0000 . ?
C10 H10A 0.9800 . ?
C10 H10B 0.9800 . ?
C10 H10C 0.9800 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 C13 1.518(5) . ?
C12 C14 1.525(4) . ?
C12 H12A 1.0000 . ?
C13 H13A 0.9800 . ?
C13 H13B 0.9800 . ?
C13 H13C 0.9800 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 C16 1.542(4) . ?
C15 H15A 0.9900 . ?
C15 H15B 0.9900 . ?
C16 H16A 0.9900 . ?
C16 H16B 0.9900 . ?
C17 C19 1.531(4) . ?
C17 C18 1.535(5) . ?
C17 H17A 1.0000 . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 H19A 0.9800 . ?
C19 H19B 0.9800 . ?
C19 H19C 0.9800 . ?
C20 C21 1.522(5) . ?
C20 C22 1.522(5) . ?
C20 H20A 1.0000 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C22 H22C 0.9800 . ?
C23 C25 1.522(5) . ?
C23 C26 1.527(5) . ?
C23 C24 1.538(5) . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
C25 H25A 0.9800 . ?
C25 H25B 0.9800 . ?
C25 H25C 0.9800 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
C28 H28A 0.9800 . ?
C28 H28B 0.9800 . ?
C28 H28C 0.9800 . ?
C29 C30 1.531(4) . ?
C29 H29A 0.9900 . ?
C29 H29B 0.9900 . ?
C30 H30A 0.9900 . ?
C30 H30B 0.9900 . ?
C31 C33 1.531(4) . ?
C31 C32 1.534(5) . ?
C31 H31A 1.0000 . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
C33 H33A 0.9800 . ?
C33 H33B 0.9800 . ?
C33 H33C 0.9800 . ?
C34 C36 1.522(5) . ?
C34 C35 1.527(5) . ?
C34 H34A 1.0000 . ?
C35 H35A 0.9800 . ?
C35 H35B 0.9800 . ?
C35 H35C 0.9800 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
C37 C38 1.531(4) . ?
C37 H37A 0.9900 . ?
C37 H37B 0.9900 . ?
C38 H38A 0.9900 . ?
C38 H38B 0.9900 . ?
C39 C40 1.522(5) . ?
C39 C41 1.536(5) . ?
C39 H39A 1.0000 . ?
C40 H40A 0.9800 . ?
C40 H40B 0.9800 . ?
C40 H40C 0.9800 . ?
C41 H41A 0.9800 . ?
C41 H41B 0.9800 . ?
C41 H41C 0.9800 . ?
C42 C44 1.517(5) . ?
C42 C43 1.518(5) . ?
C42 H42A 1.0000 . ?
C43 H43A 0.9800 . ?
C43 H43B 0.9800 . ?
C43 H43C 0.9800 . ?
C44 H44A 0.9800 . ?
C44 H44B 0.9800 . ?
C44 H44C 0.9800 . ?
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 Mn1 Mn2 N3 -176.78(14) . . . . ?
P1 Mn1 Mn2 N3 10.56(10) . . . . ?
Si1 Mn1 Mn2 N3 -127.57(10) . . . . ?
N1 Mn1 Mn2 P3 7.69(11) . . . . ?
P1 Mn1 Mn2 P3 -164.96(3) . . . . ?
Si1 Mn1 Mn2 P3 56.91(5) . . . . ?
N1 Mn1 Mn2 Si2 -130.09(10) . . . . ?
P1 Mn1 Mn2 Si2 57.26(4) . . . . ?
Si1 Mn1 Mn2 Si2 -80.87(5) . . . . ?
P1 Mn1 Si1 N1 111.64(13) . . . . ?
Mn2 Mn1 Si1 N1 -108.10(13) . . . . ?
N1 Mn1 Si1 N2 -142.37(16) . . . . ?
P1 Mn1 Si1 N2 -30.73(9) . . . . ?
Mn2 Mn1 Si1 N2 109.53(9) . . . . ?
N1 Mn1 Si1 C5 113.80(18) . . . . ?
P1 Mn1 Si1 C5 -134.56(12) . . . . ?
Mn2 Mn1 Si1 C5 5.70(12) . . . . ?
N1 Mn1 Si1 C6 -53.6(3) . . . . ?
P1 Mn1 Si1 C6 58.0(3) . . . . ?
Mn2 Mn1 Si1 C6 -161.7(2) . . . . ?
P3 Mn2 Si2 N3 112.75(13) . . . . ?
Mn1 Mn2 Si2 N3 -107.16(13) . . . . ?
N3 Mn2 Si2 N4 -150.77(16) . . . . ?
P3 Mn2 Si2 N4 -38.02(9) . . . . ?
Mn1 Mn2 Si2 N4 102.07(9) . . . . ?
N3 Mn2 Si2 C27 108.83(17) . . . . ?
P3 Mn2 Si2 C27 -138.42(11) . . . . ?
Mn1 Mn2 Si2 C27 1.67(12) . . . . ?
N3 Mn2 Si2 C28 -66.0(3) . . . . ?
P3 Mn2 Si2 C28 46.7(2) . . . . ?
Mn1 Mn2 Si2 C28 -173.2(2) . . . . ?
N1 Mn1 P1 C8 44.30(14) . . . . ?
Mn2 Mn1 P1 C8 -141.22(11) . . . . ?
Si1 Mn1 P1 C8 10.42(11) . . . . ?
N1 Mn1 P1 C9 -72.52(14) . . . . ?
Mn2 Mn1 P1 C9 101.95(12) . . . . ?
Si1 Mn1 P1 C9 -106.40(12) . . . . ?
N1 Mn1 P1 C12 161.74(14) . . . . ?
Mn2 Mn1 P1 C12 -23.78(12) . . . . ?
Si1 Mn1 P1 C12 127.86(12) . . . . ?
N3 Mn2 P3 C30 55.21(13) . . . . ?
Mn1 Mn2 P3 C30 -128.42(11) . . . . ?
Si2 Mn2 P3 C30 20.57(11) . . . . ?
N3 Mn2 P3 C31 170.00(15) . . . . ?
Mn1 Mn2 P3 C31 -13.62(13) . . . . ?
Si2 Mn2 P3 C31 135.37(13) . . . . ?
N3 Mn2 P3 C34 -61.00(16) . . . . ?
Mn1 Mn2 P3 C34 115.38(14) . . . . ?
Si2 Mn2 P3 C34 -95.64(14) . . . . ?
N2 Si1 N1 C1 -153.0(3) . . . . ?
C5 Si1 N1 C1 91.6(3) . . . . ?
C6 Si1 N1 C1 -34.6(3) . . . . ?
Mn1 Si1 N1 C1 171.7(3) . . . . ?
N2 Si1 N1 Mn1 35.30(15) . . . . ?
C5 Si1 N1 Mn1 -80.17(17) . . . . ?
C6 Si1 N1 Mn1 153.68(15) . . . . ?
P1 Mn1 N1 C1 109.2(2) . . . . ?
Mn2 Mn1 N1 C1 -63.4(3) . . . . ?
Si1 Mn1 N1 C1 -171.8(3) . . . . ?
P1 Mn1 N1 Si1 -79.04(12) . . . . ?
Mn2 Mn1 N1 Si1 108.39(12) . . . . ?
N1 Si1 N2 C15 -143.8(2) . . . . ?
C5 Si1 N2 C15 -22.9(3) . . . . ?
C6 Si1 N2 C15 91.7(2) . . . . ?
Mn1 Si1 N2 C15 -119.3(2) . . . . ?
N1 Si1 N2 C7 72.8(2) . . . . ?
C5 Si1 N2 C7 -166.3(2) . . . . ?
C6 Si1 N2 C7 -51.7(2) . . . . ?
Mn1 Si1 N2 C7 97.2(2) . . . . ?
N4 Si2 N3 C23 -160.9(2) . . . . ?
C27 Si2 N3 C23 82.4(3) . . . . ?
C28 Si2 N3 C23 -41.9(3) . . . . ?
Mn2 Si2 N3 C23 172.7(3) . . . . ?
N4 Si2 N3 Mn2 26.36(14) . . . . ?
C27 Si2 N3 Mn2 -90.36(16) . . . . ?
C28 Si2 N3 Mn2 145.37(15) . . . . ?
P3 Mn2 N3 C23 108.1(2) . . . . ?
Mn1 Mn2 N3 C23 -67.3(3) . . . . ?
Si2 Mn2 N3 C23 -172.6(3) . . . . ?
P3 Mn2 N3 Si2 -79.26(12) . . . . ?
Mn1 Mn2 N3 Si2 105.29(11) . . . . ?
N3 Si2 N4 C37 -130.0(2) . . . . ?
C27 Si2 N4 C37 -6.7(3) . . . . ?
C28 Si2 N4 C37 105.3(3) . . . . ?
Mn2 Si2 N4 C37 -110.3(2) . . . . ?
N3 Si2 N4 C29 83.5(2) . . . . ?
C27 Si2 N4 C29 -153.1(2) . . . . ?
C28 Si2 N4 C29 -41.2(3) . . . . ?
Mn2 Si2 N4 C29 103.2(2) . . . . ?
Si1 N1 C1 C3 -164.4(2) . . . . ?
Mn1 N1 C1 C3 5.5(4) . . . . ?
Si1 N1 C1 C2 -44.8(4) . . . . ?
Mn1 N1 C1 C2 125.1(3) . . . . ?
Si1 N1 C1 C4 77.5(3) . . . . ?
Mn1 N1 C1 C4 -112.5(3) . . . . ?
C15 N2 C7 C8 70.8(3) . . . . ?
Si1 N2 C7 C8 -143.1(2) . . . . ?
N2 C7 C8 P1 59.2(3) . . . . ?
C9 P1 C8 C7 105.1(2) . . . . ?
C12 P1 C8 C7 -145.7(2) . . . . ?
Mn1 P1 C8 C7 -19.1(2) . . . . ?
C8 P1 C9 C10 -66.9(3) . . . . ?
C12 P1 C9 C10 -175.5(2) . . . . ?
Mn1 P1 C9 C10 51.9(2) . . . . ?
C8 P1 C9 C11 171.5(2) . . . . ?
C12 P1 C9 C11 62.9(2) . . . . ?
Mn1 P1 C9 C11 -69.6(2) . . . . ?
C8 P1 C12 C13 73.9(3) . . . . ?
C9 P1 C12 C13 -177.0(2) . . . . ?
Mn1 P1 C12 C13 -45.8(3) . . . . ?
C8 P1 C12 C14 -51.5(3) . . . . ?
C9 P1 C12 C14 57.6(3) . . . . ?
Mn1 P1 C12 C14 -171.2(2) . . . . ?
C7 N2 C15 C16 71.4(3) . . . . ?
Si1 N2 C15 C16 -72.5(3) . . . . ?
N2 C15 C16 P2 179.7(2) . . . . ?
C17 P2 C16 C15 106.9(2) . . . . ?
C20 P2 C16 C15 -147.7(2) . . . . ?
C16 P2 C17 C19 -62.7(3) . . . . ?
C20 P2 C17 C19 -167.4(3) . . . . ?
C16 P2 C17 C18 176.6(2) . . . . ?
C20 P2 C17 C18 71.9(3) . . . . ?
C17 P2 C20 C21 52.2(3) . . . . ?
C16 P2 C20 C21 -52.6(3) . . . . ?
C17 P2 C20 C22 179.9(3) . . . . ?
C16 P2 C20 C22 75.0(3) . . . . ?
Si2 N3 C23 C25 -164.0(2) . . . . ?
Mn2 N3 C23 C25 6.9(4) . . . . ?
Si2 N3 C23 C26 76.5(4) . . . . ?
Mn2 N3 C23 C26 -112.6(3) . . . . ?
Si2 N3 C23 C24 -45.0(4) . . . . ?
Mn2 N3 C23 C24 125.9(3) . . . . ?
C37 N4 C29 C30 66.9(3) . . . . ?
Si2 N4 C29 C30 -143.7(2) . . . . ?
N4 C29 C30 P3 58.6(3) . . . . ?
C31 P3 C30 C29 -152.0(2) . . . . ?
C34 P3 C30 C29 100.3(2) . . . . ?
Mn2 P3 C30 C29 -25.3(2) . . . . ?
C30 P3 C31 C33 -54.8(3) . . . . ?
C34 P3 C31 C33 54.2(3) . . . . ?
Mn2 P3 C31 C33 -170.2(2) . . . . ?
C30 P3 C31 C32 70.8(3) . . . . ?
C34 P3 C31 C32 179.8(2) . . . . ?
Mn2 P3 C31 C32 -44.6(3) . . . . ?
C30 P3 C34 C36 -58.1(3) . . . . ?
C31 P3 C34 C36 -165.6(3) . . . . ?
Mn2 P3 C34 C36 57.7(3) . . . . ?
C30 P3 C34 C35 178.4(3) . . . . ?
C31 P3 C34 C35 70.9(3) . . . . ?
Mn2 P3 C34 C35 -65.7(3) . . . . ?
C29 N4 C37 C38 66.9(3) . . . . ?
Si2 N4 C37 C38 -79.7(3) . . . . ?
N4 C37 C38 P4 -169.1(2) . . . . ?
C39 P4 C38 C37 -175.9(2) . . . . ?
C42 P4 C38 C37 -70.1(3) . . . . ?
C38 P4 C39 C40 -78.0(3) . . . . ?
C42 P4 C39 C40 174.9(3) . . . . ?
C38 P4 C39 C41 161.2(3) . . . . ?
C42 P4 C39 C41 54.0(3) . . . . ?
C38 P4 C42 C44 86.1(3) . . . . ?
C39 P4 C42 C44 -171.3(3) . . . . ?
C38 P4 C42 C43 -44.3(3) . . . . ?
C39 P4 C42 C43 58.3(3) . . . . ?
