# Electronic Supplementary Material (ESI) for RSC Advances.
# This journal is © The Royal Society of Chemistry 2014

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#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
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#  fide research purposes only. It may contain copyright material
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#  data retrieval see:
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data_complex-2a
_database_code_depnum_ccdc_archive 'CCDC 990556'

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C37 H44 Mo O3 Si'
_chemical_formula_sum            'C37 H44 Mo O3 Si'
_chemical_formula_weight         660.75

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.2541 0.3302 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Mo Mo -0.0483 2.7339 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_Int_Tables_number      2

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   8.6566(3)
_cell_length_b                   10.9696(4)
_cell_length_c                   35.7255(11)
_cell_angle_alpha                95.4889(13)
_cell_angle_beta                 92.2032(14)
_cell_angle_gamma                97.1362(15)
_cell_volume                     3346.4(2)
_cell_formula_units_Z            4
_cell_measurement_temperature    90(2)
_cell_measurement_reflns_used    9816
_cell_measurement_theta_min      3.73
_cell_measurement_theta_max      69.61

_exptl_crystal_description       plate
_exptl_crystal_colour            orange
_exptl_crystal_size_max          0.11
_exptl_crystal_size_mid          0.06
_exptl_crystal_size_min          0.04
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.312
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1384
_exptl_absorpt_coefficient_mu    3.806
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.8611
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_process_details   
; 
 SADABS (Sheldrick, 1996) 
;

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      90(2)
_diffrn_radiation_wavelength     1.54178
_diffrn_radiation_type           CuK\a
_diffrn_radiation_source         'Bruker TXS fine-focus rotating anode'
_diffrn_radiation_monochromator  'Bruker Helios multilayered confocal mirror'
_diffrn_measurement_device_type  'Bruker D8 goniometer with CCD area detector'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_detector_area_resol_mean 8.333
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            31297
_diffrn_reflns_av_R_equivalents  0.0239
_diffrn_reflns_av_sigmaI/netI    0.0265
_diffrn_reflns_limit_h_min       -9
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_l_min       -42
_diffrn_reflns_limit_l_max       43
_diffrn_reflns_theta_min         1.24
_diffrn_reflns_theta_max         69.71
_diffrn_measured_fraction_theta_max 0.880
_diffrn_reflns_theta_full        69.71
_diffrn_measured_fraction_theta_full 0.880

_reflns_number_total             11121
_reflns_number_gt                10971
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       'Bruker APEX2'
_computing_cell_refinement       'Bruker SAINT'
_computing_data_reduction        'Bruker SAINT'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    
;
'ORTEP-3', 'Yadokari-XG 2009 (Wakita, Nemoto, et al., 2009)'
;
_computing_publication_material  
;
'Yadokari-XG 2009 (Wakita, Nemoto, et al., 2009)'
;

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0000P)²+29.4019P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_number_reflns         11121
_refine_ls_number_parameters     777
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0740
_refine_ls_R_factor_gt           0.0732
_refine_ls_wR_factor_ref         0.1674
_refine_ls_wR_factor_gt          0.1671
_refine_ls_goodness_of_fit_ref   1.361
_refine_ls_restrained_S_all      1.361
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_diff_density_max         1.863
_refine_diff_density_min         -1.573
_refine_diff_density_rms         0.116

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
Mo1 Mo 0.67601(6) 0.25737(5) 0.394371(14) 0.01593(14) Uani 1 1 d . . .
Si1 Si 0.52326(19) 0.51912(16) 0.35483(4) 0.0146(3) Uani 1 1 d . . .
O1 O 0.5902(5) 0.4314(4) 0.38595(11) 0.0189(9) Uani 1 1 d . . .
O2 O 0.9053(6) 0.2846(5) 0.32944(14) 0.0358(13) Uani 1 1 d . . .
O3 O 1.0057(6) 0.3102(5) 0.43329(15) 0.0320(12) Uani 1 1 d . . .
C1 C 0.8174(8) 0.2768(6) 0.35248(19) 0.0222(14) Uani 1 1 d . . .
C2 C 0.8810(8) 0.2954(6) 0.41879(19) 0.0237(15) Uani 1 1 d . . .
C3 C 0.6157(8) 0.4228(6) 0.42545(18) 0.0196(14) Uani 1 1 d . . .
H1 H 0.5151 0.4062 0.4380 0.023 Uiso 1 1 calc R . .
C4 C 0.7249(8) 0.5243(6) 0.44762(18) 0.0201(14) Uani 1 1 d . . .
H2 H 0.8268 0.5318 0.4352 0.024 Uiso 1 1 calc R . .
C5 C 0.7525(9) 0.4875(7) 0.48699(18) 0.0283(16) Uani 1 1 d . . .
H3 H 0.6541 0.4812 0.4998 0.042 Uiso 1 1 calc R . .
H4 H 0.8288 0.5500 0.5012 0.042 Uiso 1 1 calc R . .
H5 H 0.7924 0.4075 0.4853 0.042 Uiso 1 1 calc R . .
C6 C 0.6644(8) 0.6514(6) 0.44991(19) 0.0246(15) Uani 1 1 d . . .
H6 H 0.6692 0.6832 0.4252 0.037 Uiso 1 1 calc R . .
H7 H 0.7292 0.7091 0.4685 0.037 Uiso 1 1 calc R . .
H8 H 0.5562 0.6424 0.4575 0.037 Uiso 1 1 calc R . .
C7 C 0.4338(7) 0.4121(6) 0.31414(17) 0.0181(13) Uani 1 1 d . . .
C8 C 0.2763(8) 0.3666(7) 0.30971(18) 0.0234(15) Uani 1 1 d . . .
H9 H 0.2082 0.3897 0.3286 0.028 Uiso 1 1 calc R . .
C9 C 0.2156(8) 0.2879(7) 0.2781(2) 0.0309(17) Uani 1 1 d . . .
H10 H 0.1079 0.2565 0.2765 0.037 Uiso 1 1 calc R . .
C10 C 0.3085(9) 0.2543(7) 0.24921(19) 0.0292(17) Uani 1 1 d . . .
C11 C 0.4671(8) 0.2978(6) 0.25370(18) 0.0214(14) Uani 1 1 d . . .
H11 H 0.5341 0.2746 0.2346 0.026 Uiso 1 1 calc R . .
C12 C 0.5300(8) 0.3739(6) 0.28520(17) 0.0199(14) Uani 1 1 d . . .
H12 H 0.6389 0.4008 0.2874 0.024 Uiso 1 1 calc R . .
C13 C 0.2416(10) 0.1783(9) 0.2137(2) 0.044(2) Uani 1 1 d . . .
H13 H 0.1819 0.1019 0.2201 0.066 Uiso 1 1 calc R . .
H14 H 0.3264 0.1581 0.1978 0.066 Uiso 1 1 calc R . .
H15 H 0.1727 0.2253 0.2001 0.066 Uiso 1 1 calc R . .
C14 C 0.6880(7) 0.6214(6) 0.33749(17) 0.0171(13) Uani 1 1 d . . .
C15 C 0.6598(8) 0.6952(6) 0.30859(18) 0.0221(14) Uani 1 1 d . . .
H16 H 0.5558 0.6949 0.2990 0.026 Uiso 1 1 calc R . .
C16 C 0.7789(8) 0.7681(6) 0.29369(18) 0.0237(15) Uani 1 1 d . . .
H17 H 0.7563 0.8160 0.2739 0.028 Uiso 1 1 calc R . .
C17 C 0.9323(8) 0.7717(6) 0.30756(19) 0.0251(15) Uani 1 1 d . . .
C18 C 0.9623(8) 0.6990(7) 0.33578(19) 0.0257(15) Uani 1 1 d . . .
H18 H 1.0666 0.6999 0.3453 0.031 Uiso 1 1 calc R . .
C19 C 0.8424(7) 0.6246(6) 0.35061(17) 0.0205(14) Uani 1 1 d . . .
H19 H 0.8662 0.5752 0.3700 0.025 Uiso 1 1 calc R . .
C20 C 1.0634(9) 0.8532(8) 0.2912(2) 0.0392(19) Uani 1 1 d . . .
H20 H 1.0494 0.9402 0.2970 0.059 Uiso 1 1 calc R . .
H21 H 1.0611 0.8333 0.2639 0.059 Uiso 1 1 calc R . .
H22 H 1.1639 0.8386 0.3023 0.059 Uiso 1 1 calc R . .
C21 C 0.3824(7) 0.6086(6) 0.37957(16) 0.0152(13) Uani 1 1 d . . .
C22 C 0.3951(7) 0.7377(6) 0.38190(18) 0.0183(13) Uani 1 1 d . . .
H23 H 0.4719 0.7812 0.3682 0.022 Uiso 1 1 calc R . .
C23 C 0.2985(8) 0.8037(6) 0.40373(19) 0.0226(14) Uani 1 1 d . . .
H24 H 0.3109 0.8912 0.4048 0.027 Uiso 1 1 calc R . .
C24 C 0.1842(7) 0.7437(6) 0.42399(17) 0.0185(13) Uani 1 1 d . . .
C25 C 0.1715(7) 0.6155(6) 0.42214(17) 0.0184(13) Uani 1 1 d . . .
H25 H 0.0955 0.5728 0.4363 0.022 Uiso 1 1 calc R . .
C26 C 0.2664(7) 0.5482(6) 0.40028(16) 0.0145(12) Uani 1 1 d . . .
H26 H 0.2531 0.4607 0.3993 0.017 Uiso 1 1 calc R . .
C27 C 0.0751(8) 0.8145(7) 0.4466(2) 0.0275(16) Uani 1 1 d . . .
H27 H 0.1219 0.9007 0.4522 0.041 Uiso 1 1 calc R . .
H28 H 0.0565 0.7776 0.4702 0.041 Uiso 1 1 calc R . .
H29 H -0.0240 0.8113 0.4321 0.041 Uiso 1 1 calc R . .
C28 C 0.6627(8) 0.0457(6) 0.38981(18) 0.0211(14) Uani 1 1 d . . .
C29 C 0.5402(8) 0.0715(6) 0.36504(18) 0.0180(13) Uani 1 1 d . . .
C30 C 0.4277(8) 0.1246(6) 0.38706(19) 0.0209(14) Uani 1 1 d . . .
C31 C 0.4806(9) 0.1346(6) 0.42534(19) 0.0246(15) Uani 1 1 d . . .
C32 C 0.6244(9) 0.0868(6) 0.42750(19) 0.0246(15) Uani 1 1 d . . .
C33 C 0.7980(8) -0.0216(6) 0.3795(2) 0.0302(17) Uani 1 1 d . . .
H30 H 0.7695 -0.1101 0.3810 0.045 Uiso 1 1 calc R . .
H31 H 0.8876 0.0092 0.3969 0.045 Uiso 1 1 calc R . .
H32 H 0.8254 -0.0077 0.3537 0.045 Uiso 1 1 calc R . .
C34 C 0.5230(9) 0.0348(7) 0.32330(19) 0.0266(15) Uani 1 1 d . . .
H33 H 0.6257 0.0261 0.3135 0.040 Uiso 1 1 calc R . .
H34 H 0.4768 0.0984 0.3109 0.040 Uiso 1 1 calc R . .
H35 H 0.4553 -0.0441 0.3183 0.040 Uiso 1 1 calc R . .
C35 C 0.2715(8) 0.1543(7) 0.3728(2) 0.0324(17) Uani 1 1 d . . .
H36 H 0.2771 0.1706 0.3463 0.049 Uiso 1 1 calc R . .
H37 H 0.2444 0.2274 0.3878 0.049 Uiso 1 1 calc R . .
H38 H 0.1916 0.0840 0.3749 0.049 Uiso 1 1 calc R . .
C36 C 0.3881(11) 0.1773(8) 0.4579(2) 0.044(2) Uani 1 1 d . . .
H39 H 0.3218 0.1064 0.4659 0.066 Uiso 1 1 calc R . .
H40 H 0.3227 0.2380 0.4500 0.066 Uiso 1 1 calc R . .
H41 H 0.4596 0.2152 0.4789 0.066 Uiso 1 1 calc R . .
C37 C 0.7107(11) 0.0659(8) 0.4630(2) 0.043(2) Uani 1 1 d . . .
H42 H 0.6959 0.1307 0.4830 0.064 Uiso 1 1 calc R . .
H43 H 0.8220 0.0682 0.4586 0.064 Uiso 1 1 calc R . .
H44 H 0.6705 -0.0149 0.4708 0.064 Uiso 1 1 calc R . .
Mo2 Mo 0.28946(7) 0.80203(6) 0.078142(15) 0.02433(16) Uani 1 1 d . . .
Si2 Si 0.4664(2) 0.64486(17) 0.15170(5) 0.0204(4) Uani 1 1 d . . .
O4 O 0.3993(5) 0.6734(4) 0.10951(12) 0.0240(10) Uani 1 1 d . . .
O5 O 0.1059(8) 0.8995(6) 0.14601(17) 0.0553(18) Uani 1 1 d . . .
O6 O -0.0561(6) 0.6994(5) 0.05698(16) 0.0390(13) Uani 1 1 d . . .
C38 C 0.1784(9) 0.8617(8) 0.1220(2) 0.0335(18) Uani 1 1 d . . .
C39 C 0.0746(9) 0.7341(7) 0.0654(2) 0.0290(17) Uani 1 1 d . . .
C40 C 0.3463(9) 0.6151(7) 0.07234(18) 0.0263(16) Uani 1 1 d . . .
H45 H 0.4361 0.6079 0.0558 0.032 Uiso 1 1 calc R . .
C41 C 0.2369(9) 0.4985(7) 0.0684(2) 0.0318(17) Uani 1 1 d . . .
H46 H 0.1421 0.5141 0.0823 0.038 Uiso 1 1 calc R . .
C42 C 0.2997(10) 0.3868(7) 0.0833(2) 0.0381(19) Uani 1 1 d . . .
H47 H 0.3994 0.3755 0.0723 0.057 Uiso 1 1 calc R . .
H48 H 0.2248 0.3126 0.0765 0.057 Uiso 1 1 calc R . .
H49 H 0.3148 0.4007 0.1108 0.057 Uiso 1 1 calc R . .
C43 C 0.1879(11) 0.4704(8) 0.0266(2) 0.044(2) Uani 1 1 d . . .
H50 H 0.1319 0.5364 0.0185 0.066 Uiso 1 1 calc R . .
H51 H 0.1197 0.3916 0.0226 0.066 Uiso 1 1 calc R . .
H52 H 0.2807 0.4653 0.0120 0.066 Uiso 1 1 calc R . .
C44 C 0.5727(8) 0.7895(7) 0.17596(18) 0.0228(15) Uani 1 1 d . . .
C45 C 0.4934(8) 0.8729(7) 0.1970(2) 0.0274(16) Uani 1 1 d . . .
H53 H 0.3830 0.8571 0.1971 0.033 Uiso 1 1 calc R . .
C46 C 0.5690(8) 0.9782(7) 0.2178(2) 0.0285(16) Uani 1 1 d . . .
H54 H 0.5098 1.0327 0.2316 0.034 Uiso 1 1 calc R . .
C47 C 0.7309(8) 1.0050(7) 0.21852(18) 0.0265(16) Uani 1 1 d . . .
C48 C 0.8123(8) 0.9224(7) 0.19744(19) 0.0283(16) Uani 1 1 d . . .
H55 H 0.9228 0.9382 0.1975 0.034 Uiso 1 1 calc R . .
C49 C 0.7367(8) 0.8195(7) 0.17682(19) 0.0268(16) Uani 1 1 d . . .
H56 H 0.7962 0.7662 0.1626 0.032 Uiso 1 1 calc R . .
C50 C 0.8145(9) 1.1150(8) 0.2417(2) 0.0363(18) Uani 1 1 d . . .
H57 H 0.8653 1.1723 0.2251 0.054 Uiso 1 1 calc R . .
H58 H 0.8934 1.0890 0.2586 0.054 Uiso 1 1 calc R . .
H59 H 0.7399 1.1563 0.2567 0.054 Uiso 1 1 calc R . .
C51 C 0.5982(8) 0.5228(7) 0.14299(18) 0.0227(15) Uani 1 1 d . . .
C52 C 0.6996(8) 0.5272(7) 0.11375(19) 0.0265(15) Uani 1 1 d . . .
H60 H 0.7035 0.5937 0.0985 0.032 Uiso 1 1 calc R . .
C53 C 0.7950(9) 0.4361(7) 0.1066(2) 0.0303(17) Uani 1 1 d . . .
H61 H 0.8624 0.4408 0.0862 0.036 Uiso 1 1 calc R . .
C54 C 0.7943(9) 0.3388(7) 0.1282(2) 0.0312(17) Uani 1 1 d . . .
C55 C 0.6919(9) 0.3334(7) 0.1577(2) 0.0324(17) Uani 1 1 d . . .
H62 H 0.6891 0.2674 0.1732 0.039 Uiso 1 1 calc R . .
C56 C 0.5948(8) 0.4236(7) 0.16443(19) 0.0275(16) Uani 1 1 d . . .
H63 H 0.5244 0.4173 0.1841 0.033 Uiso 1 1 calc R . .
C57 C 0.9047(10) 0.2444(9) 0.1223(3) 0.049(2) Uani 1 1 d . . .
H64 H 0.9183 0.2269 0.0953 0.073 Uiso 1 1 calc R . .
H65 H 0.8622 0.1683 0.1326 0.073 Uiso 1 1 calc R . .
H66 H 1.0057 0.2763 0.1351 0.073 Uiso 1 1 calc R . .
C58 C 0.2991(8) 0.5990(6) 0.18074(18) 0.0225(15) Uani 1 1 d . . .
C59 C 0.3237(9) 0.5855(7) 0.2186(2) 0.0297(16) Uani 1 1 d . . .
H67 H 0.4273 0.5981 0.2294 0.036 Uiso 1 1 calc R . .
C60 C 0.2028(9) 0.5547(7) 0.24101(19) 0.0312(17) Uani 1 1 d . . .
H68 H 0.2246 0.5464 0.2668 0.037 Uiso 1 1 calc R . .
C61 C 0.0492(9) 0.5353(6) 0.22685(19) 0.0263(15) Uani 1 1 d . . .
C62 C 0.0223(9) 0.5542(7) 0.1892(2) 0.0296(16) Uani 1 1 d . . .
H69 H -0.0818 0.5458 0.1789 0.036 Uiso 1 1 calc R . .
C63 C 0.1445(9) 0.5849(7) 0.16657(19) 0.0289(16) Uani 1 1 d . . .
H70 H 0.1229 0.5966 0.1410 0.035 Uiso 1 1 calc R . .
C64 C -0.0852(10) 0.4914(8) 0.2499(2) 0.0364(19) Uani 1 1 d . . .
H71 H -0.1659 0.5461 0.2484 0.055 Uiso 1 1 calc R . .
H72 H -0.0482 0.4925 0.2762 0.055 Uiso 1 1 calc R . .
H73 H -0.1286 0.4071 0.2402 0.055 Uiso 1 1 calc R . .
C65 C 0.2845(8) 0.9751(7) 0.0482(2) 0.0302(17) Uani 1 1 d . . .
C66 C 0.3184(9) 0.8798(8) 0.0211(2) 0.0333(18) Uani 1 1 d . . .
C67 C 0.4694(9) 0.8493(7) 0.0312(2) 0.0326(18) Uani 1 1 d . . .
C68 C 0.5275(9) 0.9220(7) 0.0642(2) 0.0315(17) Uani 1 1 d . . .
C69 C 0.4147(9) 1.0017(7) 0.0754(2) 0.0332(17) Uani 1 1 d . . .
C70 C 0.1440(10) 1.0410(8) 0.0465(3) 0.041(2) Uani 1 1 d . . .
H74 H 0.1651 1.1119 0.0319 0.062 Uiso 1 1 calc R . .
H75 H 0.1190 1.0699 0.0721 0.062 Uiso 1 1 calc R . .
H76 H 0.0556 0.9845 0.0345 0.062 Uiso 1 1 calc R . .
C71 C 0.2245(12) 0.8299(8) -0.0147(2) 0.047(2) Uani 1 1 d . . .
H77 H 0.1142 0.8379 -0.0113 0.070 Uiso 1 1 calc R . .
H78 H 0.2366 0.7426 -0.0207 0.070 Uiso 1 1 calc R . .
H79 H 0.2615 0.8767 -0.0354 0.070 Uiso 1 1 calc R . .
C72 C 0.5538(12) 0.7588(9) 0.0078(3) 0.053(3) Uani 1 1 d . . .
H80 H 0.5961 0.7974 -0.0139 0.080 Uiso 1 1 calc R . .
H81 H 0.4808 0.6852 -0.0011 0.080 Uiso 1 1 calc R . .
H82 H 0.6391 0.7350 0.0232 0.080 Uiso 1 1 calc R . .
C73 C 0.6830(10) 0.9179(9) 0.0843(3) 0.047(2) Uani 1 1 d . . .
H83 H 0.7033 0.8319 0.0841 0.071 Uiso 1 1 calc R . .
H84 H 0.6813 0.9545 0.1104 0.071 Uiso 1 1 calc R . .
H85 H 0.7654 0.9646 0.0715 0.071 Uiso 1 1 calc R . .
C74 C 0.4350(10) 1.1009(8) 0.1070(2) 0.043(2) Uani 1 1 d . . .
H86 H 0.4945 1.0743 0.1280 0.065 Uiso 1 1 calc R . .
H87 H 0.3326 1.1181 0.1153 0.065 Uiso 1 1 calc R . .
H88 H 0.4915 1.1758 0.0987 0.065 Uiso 1 1 calc R . .


_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

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
Mo1 C2 1.926(7) . ?
Mo1 C1 1.980(7) . ?
Mo1 C3 2.167(6) . ?
Mo1 O1 2.175(4) . ?
Mo1 C28 2.300(6) . ?
Mo1 C32 2.315(7) . ?
Mo1 C29 2.353(6) . ?
Mo1 C31 2.401(7) . ?
Mo1 C30 2.432(7) . ?
Si1 O1 1.671(4) . ?
Si1 C21 1.856(6) . ?
Si1 C7 1.858(6) . ?
Si1 C14 1.865(7) . ?
O1 C3 1.434(7) . ?
O2 C1 1.144(8) . ?
O3 C2 1.165(8) . ?
C3 C4 1.508(9) . ?
C3 H1 1.0000 . ?
C4 C5 1.518(9) . ?
C4 C6 1.545(9) . ?
C4 H2 1.0000 . ?
C5 H3 0.9800 . ?
C5 H4 0.9800 . ?
C5 H5 0.9800 . ?
C6 H6 0.9800 . ?
C6 H7 0.9800 . ?
C6 H8 0.9800 . ?
C7 C8 1.391(9) . ?
C7 C12 1.417(9) . ?
C8 C9 1.396(9) . ?
C8 H9 0.9500 . ?
C9 C10 1.384(10) . ?
C9 H10 0.9500 . ?
C10 C11 1.394(10) . ?
C10 C13 1.503(10) . ?
C11 C12 1.386(9) . ?
C11 H11 0.9500 . ?
C12 H12 0.9500 . ?
C13 H13 0.9800 . ?
C13 H14 0.9800 . ?
C13 H15 0.9800 . ?
C14 C19 1.395(9) . ?
C14 C15 1.404(9) . ?
C15 C16 1.380(10) . ?
C15 H16 0.9500 . ?
C16 C17 1.394(10) . ?
C16 H17 0.9500 . ?
C17 C18 1.380(10) . ?
C17 C20 1.525(10) . ?
C18 C19 1.393(10) . ?
C18 H18 0.9500 . ?
C19 H19 0.9500 . ?
C20 H20 0.9800 . ?
C20 H21 0.9800 . ?
C20 H22 0.9800 . ?
C21 C22 1.401(9) . ?
C21 C26 1.407(9) . ?
C22 C23 1.387(9) . ?
C22 H23 0.9500 . ?
C23 C24 1.386(10) . ?
C23 H24 0.9500 . ?
C24 C25 1.393(9) . ?
C24 C27 1.506(9) . ?
C25 C26 1.385(9) . ?
C25 H25 0.9500 . ?
C26 H26 0.9500 . ?
C27 H27 0.9800 . ?
C27 H28 0.9800 . ?
C27 H29 0.9800 . ?
C28 C29 1.428(9) . ?
C28 C32 1.443(9) . ?
C28 C33 1.499(10) . ?
C29 C30 1.421(9) . ?
C29 C34 1.504(9) . ?
C30 C31 1.415(10) . ?
C30 C35 1.511(9) . ?
C31 C32 1.411(11) . ?
C31 C36 1.508(10) . ?
C32 C37 1.499(10) . ?
C33 H30 0.9800 . ?
C33 H31 0.9800 . ?
C33 H32 0.9800 . ?
C34 H33 0.9800 . ?
C34 H34 0.9800 . ?
C34 H35 0.9800 . ?
C35 H36 0.9800 . ?
C35 H37 0.9800 . ?
C35 H38 0.9800 . ?
C36 H39 0.9800 . ?
C36 H40 0.9800 . ?
C36 H41 0.9800 . ?
C37 H42 0.9800 . ?
C37 H43 0.9800 . ?
C37 H44 0.9800 . ?
Mo2 C39 1.936(8) . ?
Mo2 C38 1.971(7) . ?
Mo2 C40 2.160(7) . ?
Mo2 O4 2.169(4) . ?
Mo2 C65 2.271(7) . ?
Mo2 C66 2.295(7) . ?
Mo2 C69 2.333(8) . ?
Mo2 C67 2.383(7) . ?
Mo2 C68 2.399(8) . ?
Si2 O4 1.666(4) . ?
Si2 C44 1.852(7) . ?
Si2 C58 1.860(7) . ?
Si2 C51 1.876(7) . ?
O4 C40 1.450(8) . ?
O5 C38 1.158(9) . ?
O6 C39 1.166(9) . ?
C40 C41 1.485(11) . ?
C40 H45 1.0000 . ?
C41 C43 1.529(10) . ?
C41 C42 1.533(11) . ?
C41 H46 1.0000 . ?
C42 H47 0.9800 . ?
C42 H48 0.9800 . ?
C42 H49 0.9800 . ?
C43 H50 0.9800 . ?
C43 H51 0.9800 . ?
C43 H52 0.9800 . ?
C44 C45 1.391(10) . ?
C44 C49 1.416(10) . ?
C45 C46 1.388(10) . ?
C45 H53 0.9500 . ?
C46 C47 1.395(10) . ?
C46 H54 0.9500 . ?
C47 C48 1.398(10) . ?
C47 C50 1.488(10) . ?
C48 C49 1.366(10) . ?
C48 H55 0.9500 . ?
C49 H56 0.9500 . ?
C50 H57 0.9800 . ?
C50 H58 0.9800 . ?
C50 H59 0.9800 . ?
C51 C56 1.388(10) . ?
C51 C52 1.390(9) . ?
C52 C53 1.386(10) . ?
C52 H60 0.9500 . ?
C53 C54 1.376(11) . ?
C53 H61 0.9500 . ?
C54 C55 1.404(11) . ?
C54 C57 1.499(11) . ?
C55 C56 1.385(10) . ?
C55 H62 0.9500 . ?
C56 H63 0.9500 . ?
C57 H64 0.9800 . ?
C57 H65 0.9800 . ?
C57 H66 0.9800 . ?
C58 C59 1.387(9) . ?
C58 C63 1.397(10) . ?
C59 C60 1.370(10) . ?
C59 H67 0.9500 . ?
C60 C61 1.388(10) . ?
C60 H68 0.9500 . ?
C61 C62 1.397(10) . ?
C61 C64 1.508(10) . ?
C62 C63 1.383(10) . ?
C62 H69 0.9500 . ?
C63 H70 0.9500 . ?
C64 H71 0.9800 . ?
C64 H72 0.9800 . ?
C64 H73 0.9800 . ?
C65 C66 1.422(11) . ?
C65 C69 1.442(10) . ?
C65 C70 1.492(10) . ?
C66 C67 1.430(11) . ?
C66 C71 1.506(11) . ?
C67 C68 1.399(11) . ?
C67 C72 1.512(11) . ?
C68 C69 1.433(11) . ?
C68 C73 1.509(11) . ?
C69 C74 1.481(11) . ?
C70 H74 0.9800 . ?
C70 H75 0.9800 . ?
C70 H76 0.9800 . ?
C71 H77 0.9800 . ?
C71 H78 0.9800 . ?
C71 H79 0.9800 . ?
C72 H80 0.9800 . ?
C72 H81 0.9800 . ?
C72 H82 0.9800 . ?
C73 H83 0.9800 . ?
C73 H84 0.9800 . ?
C73 H85 0.9800 . ?
C74 H86 0.9800 . ?
C74 H87 0.9800 . ?
C74 H88 0.9800 . ?

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
C2 Mo1 C1 75.6(3) . . ?
C2 Mo1 C3 87.6(3) . . ?
C1 Mo1 C3 118.1(3) . . ?
C2 Mo1 O1 107.6(2) . . ?
C1 Mo1 O1 90.9(2) . . ?
C3 Mo1 O1 38.56(19) . . ?
C2 Mo1 C28 97.5(3) . . ?
C1 Mo1 C28 94.6(3) . . ?
C3 Mo1 C28 147.1(2) . . ?
O1 Mo1 C28 154.8(2) . . ?
C2 Mo1 C32 90.8(3) . . ?
C1 Mo1 C32 127.6(3) . . ?
C3 Mo1 C32 111.4(2) . . ?
O1 Mo1 C32 140.8(2) . . ?
C28 Mo1 C32 36.4(2) . . ?
C2 Mo1 C29 131.7(3) . . ?
C1 Mo1 C29 93.1(3) . . ?
C3 Mo1 C29 136.4(2) . . ?
O1 Mo1 C29 119.5(2) . . ?
C28 Mo1 C29 35.7(2) . . ?
C32 Mo1 C29 59.2(2) . . ?
C2 Mo1 C31 117.9(3) . . ?
C1 Mo1 C31 150.3(3) . . ?
C3 Mo1 C31 89.9(2) . . ?
O1 Mo1 C31 107.8(2) . . ?
C28 Mo1 C31 58.9(2) . . ?
C32 Mo1 C31 34.8(3) . . ?
C29 Mo1 C31 57.8(2) . . ?
C2 Mo1 C30 148.5(3) . . ?
C1 Mo1 C30 122.5(3) . . ?
C3 Mo1 C30 102.4(2) . . ?
O1 Mo1 C30 98.2(2) . . ?
C28 Mo1 C30 58.4(2) . . ?
C32 Mo1 C30 57.7(2) . . ?
C29 Mo1 C30 34.5(2) . . ?
C31 Mo1 C30 34.0(2) . . ?
O1 Si1 C21 106.4(2) . . ?
O1 Si1 C7 106.6(3) . . ?
C21 Si1 C7 113.6(3) . . ?
O1 Si1 C14 110.2(3) . . ?
C21 Si1 C14 112.1(3) . . ?
C7 Si1 C14 107.8(3) . . ?
C3 O1 Si1 143.3(4) . . ?
C3 O1 Mo1 70.4(3) . . ?
Si1 O1 Mo1 146.2(2) . . ?
O2 C1 Mo1 175.9(6) . . ?
O3 C2 Mo1 175.5(6) . . ?
O1 C3 C4 117.6(5) . . ?
O1 C3 Mo1 71.0(3) . . ?
C4 C3 Mo1 127.4(5) . . ?
O1 C3 H1 111.5 . . ?
C4 C3 H1 111.5 . . ?
Mo1 C3 H1 111.5 . . ?
C3 C4 C5 108.5(6) . . ?
C3 C4 C6 113.5(5) . . ?
C5 C4 C6 109.9(5) . . ?
C3 C4 H2 108.3 . . ?
C5 C4 H2 108.3 . . ?
C6 C4 H2 108.3 . . ?
C4 C5 H3 109.5 . . ?
C4 C5 H4 109.5 . . ?
H3 C5 H4 109.5 . . ?
C4 C5 H5 109.5 . . ?
H3 C5 H5 109.5 . . ?
H4 C5 H5 109.5 . . ?
C4 C6 H6 109.5 . . ?
C4 C6 H7 109.5 . . ?
H6 C6 H7 109.5 . . ?
C4 C6 H8 109.5 . . ?
H6 C6 H8 109.5 . . ?
H7 C6 H8 109.5 . . ?
C8 C7 C12 116.7(6) . . ?
C8 C7 Si1 124.3(5) . . ?
C12 C7 Si1 118.9(5) . . ?
C7 C8 C9 121.6(6) . . ?
C7 C8 H9 119.2 . . ?
C9 C8 H9 119.2 . . ?
C10 C9 C8 121.6(7) . . ?
C10 C9 H10 119.2 . . ?
C8 C9 H10 119.2 . . ?
C9 C10 C11 117.1(6) . . ?
C9 C10 C13 121.8(7) . . ?
C11 C10 C13 121.0(6) . . ?
C12 C11 C10 122.1(6) . . ?
C12 C11 H11 119.0 . . ?
C10 C11 H11 119.0 . . ?
C11 C12 C7 120.8(6) . . ?
C11 C12 H12 119.6 . . ?
C7 C12 H12 119.6 . . ?
C10 C13 H13 109.5 . . ?
C10 C13 H14 109.5 . . ?
H13 C13 H14 109.5 . . ?
C10 C13 H15 109.5 . . ?
H13 C13 H15 109.5 . . ?
H14 C13 H15 109.5 . . ?
C19 C14 C15 117.1(6) . . ?
C19 C14 Si1 123.1(5) . . ?
C15 C14 Si1 119.7(5) . . ?
C16 C15 C14 121.8(6) . . ?
C16 C15 H16 119.1 . . ?
C14 C15 H16 119.1 . . ?
C15 C16 C17 120.3(6) . . ?
C15 C16 H17 119.8 . . ?
C17 C16 H17 119.8 . . ?
C18 C17 C16 118.6(6) . . ?
C18 C17 C20 121.2(7) . . ?
C16 C17 C20 120.2(7) . . ?
C17 C18 C19 121.1(6) . . ?
C17 C18 H18 119.4 . . ?
C19 C18 H18 119.4 . . ?
C18 C19 C14 121.0(6) . . ?
C18 C19 H19 119.5 . . ?
C14 C19 H19 119.5 . . ?
C17 C20 H20 109.5 . . ?
C17 C20 H21 109.5 . . ?
H20 C20 H21 109.5 . . ?
C17 C20 H22 109.5 . . ?
H20 C20 H22 109.5 . . ?
H21 C20 H22 109.5 . . ?
C22 C21 C26 117.0(6) . . ?
C22 C21 Si1 122.7(5) . . ?
C26 C21 Si1 120.0(5) . . ?
C23 C22 C21 121.8(6) . . ?
C23 C22 H23 119.1 . . ?
C21 C22 H23 119.1 . . ?
C24 C23 C22 121.0(6) . . ?
C24 C23 H24 119.5 . . ?
C22 C23 H24 119.5 . . ?
C23 C24 C25 117.7(6) . . ?
C23 C24 C27 121.2(6) . . ?
C25 C24 C27 121.0(6) . . ?
C26 C25 C24 122.0(6) . . ?
C26 C25 H25 119.0 . . ?
C24 C25 H25 119.0 . . ?
C25 C26 C21 120.5(6) . . ?
C25 C26 H26 119.7 . . ?
C21 C26 H26 119.7 . . ?
C24 C27 H27 109.5 . . ?
C24 C27 H28 109.5 . . ?
H27 C27 H28 109.5 . . ?
C24 C27 H29 109.5 . . ?
H27 C27 H29 109.5 . . ?
H28 C27 H29 109.5 . . ?
C29 C28 C32 106.8(6) . . ?
C29 C28 C33 127.1(6) . . ?
C32 C28 C33 125.9(6) . . ?
C29 C28 Mo1 74.2(4) . . ?
C32 C28 Mo1 72.3(4) . . ?
C33 C28 Mo1 123.0(5) . . ?
C30 C29 C28 108.4(6) . . ?
C30 C29 C34 125.4(6) . . ?
C28 C29 C34 125.8(6) . . ?
C30 C29 Mo1 75.8(4) . . ?
C28 C29 Mo1 70.1(4) . . ?
C34 C29 Mo1 125.6(4) . . ?
C31 C30 C29 108.1(6) . . ?
C31 C30 C35 125.4(6) . . ?
C29 C30 C35 126.2(6) . . ?
C31 C30 Mo1 71.7(4) . . ?
C29 C30 Mo1 69.7(4) . . ?
C35 C30 Mo1 128.5(5) . . ?
C32 C31 C30 108.5(6) . . ?
C32 C31 C36 126.8(7) . . ?
C30 C31 C36 124.5(7) . . ?
C32 C31 Mo1 69.3(4) . . ?
C30 C31 Mo1 74.2(4) . . ?
C36 C31 Mo1 127.1(5) . . ?
C31 C32 C28 108.2(6) . . ?
C31 C32 C37 125.7(7) . . ?
C28 C32 C37 125.6(7) . . ?
C31 C32 Mo1 76.0(4) . . ?
C28 C32 Mo1 71.2(4) . . ?
C37 C32 Mo1 125.2(5) . . ?
C28 C33 H30 109.5 . . ?
C28 C33 H31 109.5 . . ?
H30 C33 H31 109.5 . . ?
C28 C33 H32 109.5 . . ?
H30 C33 H32 109.5 . . ?
H31 C33 H32 109.5 . . ?
C29 C34 H33 109.5 . . ?
C29 C34 H34 109.5 . . ?
H33 C34 H34 109.5 . . ?
C29 C34 H35 109.5 . . ?
H33 C34 H35 109.5 . . ?
H34 C34 H35 109.5 . . ?
C30 C35 H36 109.5 . . ?
C30 C35 H37 109.5 . . ?
H36 C35 H37 109.5 . . ?
C30 C35 H38 109.5 . . ?
H36 C35 H38 109.5 . . ?
H37 C35 H38 109.5 . . ?
C31 C36 H39 109.5 . . ?
C31 C36 H40 109.5 . . ?
H39 C36 H40 109.5 . . ?
C31 C36 H41 109.5 . . ?
H39 C36 H41 109.5 . . ?
H40 C36 H41 109.5 . . ?
C32 C37 H42 109.5 . . ?
C32 C37 H43 109.5 . . ?
H42 C37 H43 109.5 . . ?
C32 C37 H44 109.5 . . ?
H42 C37 H44 109.5 . . ?
H43 C37 H44 109.5 . . ?
C39 Mo2 C38 76.6(3) . . ?
C39 Mo2 C40 87.7(3) . . ?
C38 Mo2 C40 120.2(3) . . ?
C39 Mo2 O4 108.7(2) . . ?
C38 Mo2 O4 92.7(3) . . ?
C40 Mo2 O4 39.1(2) . . ?
C39 Mo2 C65 96.3(3) . . ?
C38 Mo2 C65 95.3(3) . . ?
C40 Mo2 C65 144.1(3) . . ?
O4 Mo2 C65 154.8(2) . . ?
C39 Mo2 C66 92.7(3) . . ?
C38 Mo2 C66 129.6(3) . . ?
C40 Mo2 C66 108.0(3) . . ?
O4 Mo2 C66 136.5(2) . . ?
C65 Mo2 C66 36.3(3) . . ?
C39 Mo2 C69 129.9(3) . . ?
C38 Mo2 C69 89.7(3) . . ?
C40 Mo2 C69 138.3(3) . . ?
O4 Mo2 C69 120.0(2) . . ?
C65 Mo2 C69 36.5(3) . . ?
C66 Mo2 C69 60.0(3) . . ?
C39 Mo2 C67 122.0(3) . . ?
C38 Mo2 C67 148.0(3) . . ?
C40 Mo2 C67 88.4(3) . . ?
O4 Mo2 C67 103.5(2) . . ?
C65 Mo2 C67 59.2(3) . . ?
C66 Mo2 C67 35.5(3) . . ?
C69 Mo2 C67 58.2(3) . . ?
C39 Mo2 C68 151.2(3) . . ?
C38 Mo2 C68 118.0(3) . . ?
C40 Mo2 C68 103.2(3) . . ?
O4 Mo2 C68 95.8(2) . . ?
C65 Mo2 C68 59.4(3) . . ?
C66 Mo2 C68 58.7(3) . . ?
C69 Mo2 C68 35.2(3) . . ?
C67 Mo2 C68 34.0(3) . . ?
O4 Si2 C44 108.7(3) . . ?
O4 Si2 C58 109.3(3) . . ?
C44 Si2 C58 106.7(3) . . ?
O4 Si2 C51 106.3(3) . . ?
C44 Si2 C51 111.7(3) . . ?
C58 Si2 C51 114.0(3) . . ?
C40 O4 Si2 143.1(4) . . ?
C40 O4 Mo2 70.1(3) . . ?
Si2 O4 Mo2 145.5(3) . . ?
O5 C38 Mo2 175.2(7) . . ?
O6 C39 Mo2 176.1(6) . . ?
O4 C40 C41 119.8(6) . . ?
O4 C40 Mo2 70.8(3) . . ?
C41 C40 Mo2 127.8(5) . . ?
O4 C40 H45 110.9 . . ?
C41 C40 H45 110.9 . . ?
Mo2 C40 H45 110.9 . . ?
C40 C41 C43 106.8(7) . . ?
C40 C41 C42 115.8(6) . . ?
C43 C41 C42 110.3(6) . . ?
C40 C41 H46 107.9 . . ?
C43 C41 H46 107.9 . . ?
C42 C41 H46 107.9 . . ?
C41 C42 H47 109.5 . . ?
C41 C42 H48 109.5 . . ?
H47 C42 H48 109.5 . . ?
C41 C42 H49 109.5 . . ?
H47 C42 H49 109.5 . . ?
H48 C42 H49 109.5 . . ?
C41 C43 H50 109.5 . . ?
C41 C43 H51 109.5 . . ?
H50 C43 H51 109.5 . . ?
C41 C43 H52 109.5 . . ?
H50 C43 H52 109.5 . . ?
H51 C43 H52 109.5 . . ?
C45 C44 C49 115.6(6) . . ?
C45 C44 Si2 120.5(5) . . ?
C49 C44 Si2 123.8(5) . . ?
C46 C45 C44 122.7(7) . . ?
C46 C45 H53 118.7 . . ?
C44 C45 H53 118.7 . . ?
C45 C46 C47 120.6(7) . . ?
C45 C46 H54 119.7 . . ?
C47 C46 H54 119.7 . . ?
C46 C47 C48 117.4(7) . . ?
C46 C47 C50 121.5(7) . . ?
C48 C47 C50 121.1(7) . . ?
C49 C48 C47 121.5(7) . . ?
C49 C48 H55 119.3 . . ?
C47 C48 H55 119.3 . . ?
C48 C49 C44 122.2(7) . . ?
C48 C49 H56 118.9 . . ?
C44 C49 H56 118.9 . . ?
C47 C50 H57 109.5 . . ?
C47 C50 H58 109.5 . . ?
H57 C50 H58 109.5 . . ?
C47 C50 H59 109.5 . . ?
H57 C50 H59 109.5 . . ?
H58 C50 H59 109.5 . . ?
C56 C51 C52 117.8(6) . . ?
C56 C51 Si2 121.7(5) . . ?
C52 C51 Si2 120.5(5) . . ?
C53 C52 C51 121.0(7) . . ?
C53 C52 H60 119.5 . . ?
C51 C52 H60 119.5 . . ?
C54 C53 C52 121.4(7) . . ?
C54 C53 H61 119.3 . . ?
C52 C53 H61 119.3 . . ?
C53 C54 C55 117.9(7) . . ?
C53 C54 C57 121.8(8) . . ?
C55 C54 C57 120.2(7) . . ?
C56 C55 C54 120.5(7) . . ?
C56 C55 H62 119.7 . . ?
C54 C55 H62 119.7 . . ?
C55 C56 C51 121.3(7) . . ?
C55 C56 H63 119.3 . . ?
C51 C56 H63 119.3 . . ?
C54 C57 H64 109.5 . . ?
C54 C57 H65 109.5 . . ?
H64 C57 H65 109.5 . . ?
C54 C57 H66 109.5 . . ?
H64 C57 H66 109.5 . . ?
H65 C57 H66 109.5 . . ?
C59 C58 C63 117.1(6) . . ?
C59 C58 Si2 120.3(5) . . ?
C63 C58 Si2 122.5(5) . . ?
C60 C59 C58 121.8(7) . . ?
C60 C59 H67 119.1 . . ?
C58 C59 H67 119.1 . . ?
C59 C60 C61 121.6(7) . . ?
C59 C60 H68 119.2 . . ?
C61 C60 H68 119.2 . . ?
C60 C61 C62 117.1(7) . . ?
C60 C61 C64 122.8(7) . . ?
C62 C61 C64 120.0(7) . . ?
C63 C62 C61 121.1(7) . . ?
C63 C62 H69 119.4 . . ?
C61 C62 H69 119.4 . . ?
C62 C63 C58 121.2(6) . . ?
C62 C63 H70 119.4 . . ?
C58 C63 H70 119.4 . . ?
C61 C64 H71 109.5 . . ?
C61 C64 H72 109.5 . . ?
H71 C64 H72 109.5 . . ?
C61 C64 H73 109.5 . . ?
H71 C64 H73 109.5 . . ?
H72 C64 H73 109.5 . . ?
C66 C65 C69 107.7(7) . . ?
C66 C65 C70 125.3(7) . . ?
C69 C65 C70 126.9(7) . . ?
C66 C65 Mo2 72.8(4) . . ?
C69 C65 Mo2 74.1(4) . . ?
C70 C65 Mo2 122.3(5) . . ?
C65 C66 C67 107.6(7) . . ?
C65 C66 C71 127.1(7) . . ?
C67 C66 C71 124.8(7) . . ?
C65 C66 Mo2 70.9(4) . . ?
C67 C66 Mo2 75.6(4) . . ?
C71 C66 Mo2 125.0(6) . . ?
C68 C67 C66 109.0(7) . . ?
C68 C67 C72 126.6(8) . . ?
C66 C67 C72 124.3(8) . . ?
C68 C67 Mo2 73.6(4) . . ?
C66 C67 Mo2 68.9(4) . . ?
C72 C67 Mo2 126.6(6) . . ?
C67 C68 C69 108.2(7) . . ?
C67 C68 C73 125.8(8) . . ?
C69 C68 C73 126.0(8) . . ?
C67 C68 Mo2 72.4(4) . . ?
C69 C68 Mo2 69.8(4) . . ?
C73 C68 Mo2 124.0(5) . . ?
C68 C69 C65 107.4(7) . . ?
C68 C69 C74 126.0(7) . . ?
C65 C69 C74 126.4(7) . . ?
C68 C69 Mo2 74.9(5) . . ?
C65 C69 Mo2 69.4(4) . . ?
C74 C69 Mo2 125.3(6) . . ?
C65 C70 H74 109.5 . . ?
C65 C70 H75 109.5 . . ?
H74 C70 H75 109.5 . . ?
C65 C70 H76 109.5 . . ?
H74 C70 H76 109.5 . . ?
H75 C70 H76 109.5 . . ?
C66 C71 H77 109.5 . . ?
C66 C71 H78 109.5 . . ?
H77 C71 H78 109.5 . . ?
C66 C71 H79 109.5 . . ?
H77 C71 H79 109.5 . . ?
H78 C71 H79 109.5 . . ?
C67 C72 H80 109.5 . . ?
C67 C72 H81 109.5 . . ?
H80 C72 H81 109.5 . . ?
C67 C72 H82 109.5 . . ?
H80 C72 H82 109.5 . . ?
H81 C72 H82 109.5 . . ?
C68 C73 H83 109.5 . . ?
C68 C73 H84 109.5 . . ?
H83 C73 H84 109.5 . . ?
C68 C73 H85 109.5 . . ?
H83 C73 H85 109.5 . . ?
H84 C73 H85 109.5 . . ?
C69 C74 H86 109.5 . . ?
C69 C74 H87 109.5 . . ?
H86 C74 H87 109.5 . . ?
C69 C74 H88 109.5 . . ?
H86 C74 H88 109.5 . . ?
H87 C74 H88 109.5 . . ?

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
C21 Si1 O1 C3 -25.3(8) . . . . ?
C7 Si1 O1 C3 -146.9(7) . . . . ?
C14 Si1 O1 C3 96.4(7) . . . . ?
C21 Si1 O1 Mo1 147.9(5) . . . . ?
C7 Si1 O1 Mo1 26.3(6) . . . . ?
C14 Si1 O1 Mo1 -90.4(5) . . . . ?
C2 Mo1 O1 C3 -62.1(4) . . . . ?
C1 Mo1 O1 C3 -137.3(4) . . . . ?
C28 Mo1 O1 C3 119.8(5) . . . . ?
C32 Mo1 O1 C3 52.3(5) . . . . ?
C29 Mo1 O1 C3 128.6(4) . . . . ?
C31 Mo1 O1 C3 66.1(4) . . . . ?
C30 Mo1 O1 C3 99.7(4) . . . . ?
C2 Mo1 O1 Si1 122.2(5) . . . . ?
C1 Mo1 O1 Si1 47.0(5) . . . . ?
C3 Mo1 O1 Si1 -175.7(7) . . . . ?
C28 Mo1 O1 Si1 -55.9(8) . . . . ?
C32 Mo1 O1 Si1 -123.4(5) . . . . ?
C29 Mo1 O1 Si1 -47.1(5) . . . . ?
C31 Mo1 O1 Si1 -109.6(5) . . . . ?
C30 Mo1 O1 Si1 -76.0(5) . . . . ?
Si1 O1 C3 C4 -60.9(9) . . . . ?
Mo1 O1 C3 C4 123.1(6) . . . . ?
Si1 O1 C3 Mo1 176.0(6) . . . . ?
C2 Mo1 C3 O1 122.5(4) . . . . ?
C1 Mo1 C3 O1 50.2(4) . . . . ?
C28 Mo1 C3 O1 -137.2(4) . . . . ?
C32 Mo1 C3 O1 -147.5(3) . . . . ?
C29 Mo1 C3 O1 -80.2(4) . . . . ?
C31 Mo1 C3 O1 -119.5(3) . . . . ?
C30 Mo1 C3 O1 -87.6(3) . . . . ?
C2 Mo1 C3 C4 11.8(6) . . . . ?
C1 Mo1 C3 C4 -60.5(6) . . . . ?
O1 Mo1 C3 C4 -110.7(7) . . . . ?
C28 Mo1 C3 C4 112.1(6) . . . . ?
C32 Mo1 C3 C4 101.7(6) . . . . ?
C29 Mo1 C3 C4 169.0(5) . . . . ?
C31 Mo1 C3 C4 129.8(6) . . . . ?
C30 Mo1 C3 C4 161.7(5) . . . . ?
O1 C3 C4 C5 -172.0(5) . . . . ?
Mo1 C3 C4 C5 -85.5(6) . . . . ?
O1 C3 C4 C6 65.6(7) . . . . ?
Mo1 C3 C4 C6 152.1(5) . . . . ?
O1 Si1 C7 C8 94.3(6) . . . . ?
C21 Si1 C7 C8 -22.6(7) . . . . ?
C14 Si1 C7 C8 -147.4(6) . . . . ?
O1 Si1 C7 C12 -86.3(5) . . . . ?
C21 Si1 C7 C12 156.9(5) . . . . ?
C14 Si1 C7 C12 32.0(6) . . . . ?
C12 C7 C8 C9 -0.5(10) . . . . ?
Si1 C7 C8 C9 179.0(6) . . . . ?
C7 C8 C9 C10 -2.0(12) . . . . ?
C8 C9 C10 C11 3.0(12) . . . . ?
C8 C9 C10 C13 -174.8(8) . . . . ?
C9 C10 C11 C12 -1.5(11) . . . . ?
C13 C10 C11 C12 176.2(7) . . . . ?
C10 C11 C12 C7 -0.9(11) . . . . ?
C8 C7 C12 C11 1.9(10) . . . . ?
Si1 C7 C12 C11 -177.6(5) . . . . ?
O1 Si1 C14 C19 -2.4(6) . . . . ?
C21 Si1 C14 C19 115.9(5) . . . . ?
C7 Si1 C14 C19 -118.4(5) . . . . ?
O1 Si1 C14 C15 174.4(5) . . . . ?
C21 Si1 C14 C15 -67.3(6) . . . . ?
C7 Si1 C14 C15 58.4(6) . . . . ?
C19 C14 C15 C16 -0.1(10) . . . . ?
Si1 C14 C15 C16 -177.1(5) . . . . ?
C14 C15 C16 C17 -0.9(10) . . . . ?
C15 C16 C17 C18 1.4(10) . . . . ?
C15 C16 C17 C20 -179.5(7) . . . . ?
C16 C17 C18 C19 -0.8(10) . . . . ?
C20 C17 C18 C19 -180.0(7) . . . . ?
C17 C18 C19 C14 -0.2(10) . . . . ?
C15 C14 C19 C18 0.7(9) . . . . ?
Si1 C14 C19 C18 177.5(5) . . . . ?
O1 Si1 C21 C22 125.1(5) . . . . ?
C7 Si1 C21 C22 -117.9(5) . . . . ?
C14 Si1 C21 C22 4.6(6) . . . . ?
O1 Si1 C21 C26 -48.2(5) . . . . ?
C7 Si1 C21 C26 68.8(5) . . . . ?
C14 Si1 C21 C26 -168.7(4) . . . . ?
C26 C21 C22 C23 0.3(9) . . . . ?
Si1 C21 C22 C23 -173.2(5) . . . . ?
C21 C22 C23 C24 -0.5(10) . . . . ?
C22 C23 C24 C25 1.0(9) . . . . ?
C22 C23 C24 C27 -177.8(6) . . . . ?
C23 C24 C25 C26 -1.5(9) . . . . ?
C27 C24 C25 C26 177.3(6) . . . . ?
C24 C25 C26 C21 1.3(9) . . . . ?
C22 C21 C26 C25 -0.7(8) . . . . ?
Si1 C21 C26 C25 173.0(4) . . . . ?
C2 Mo1 C28 C29 -165.0(4) . . . . ?
C1 Mo1 C28 C29 -89.0(4) . . . . ?
C3 Mo1 C28 C29 97.6(5) . . . . ?
O1 Mo1 C28 C29 13.2(7) . . . . ?
C32 Mo1 C28 C29 113.9(6) . . . . ?
C31 Mo1 C28 C29 76.8(4) . . . . ?
C30 Mo1 C28 C29 36.7(4) . . . . ?
C2 Mo1 C28 C32 81.0(4) . . . . ?
C1 Mo1 C28 C32 157.1(4) . . . . ?
C3 Mo1 C28 C32 -16.3(7) . . . . ?
O1 Mo1 C28 C32 -100.8(6) . . . . ?
C29 Mo1 C28 C32 -113.9(6) . . . . ?
C31 Mo1 C28 C32 -37.1(4) . . . . ?
C30 Mo1 C28 C32 -77.2(4) . . . . ?
C2 Mo1 C28 C33 -40.8(6) . . . . ?
C1 Mo1 C28 C33 35.3(6) . . . . ?
C3 Mo1 C28 C33 -138.1(6) . . . . ?
O1 Mo1 C28 C33 137.4(5) . . . . ?
C32 Mo1 C28 C33 -121.8(7) . . . . ?
C29 Mo1 C28 C33 124.3(7) . . . . ?
C31 Mo1 C28 C33 -158.9(7) . . . . ?
C30 Mo1 C28 C33 161.0(7) . . . . ?
C32 C28 C29 C30 -1.3(7) . . . . ?
C33 C28 C29 C30 173.6(6) . . . . ?
Mo1 C28 C29 C30 -66.7(4) . . . . ?
C32 C28 C29 C34 -174.4(6) . . . . ?
C33 C28 C29 C34 0.5(11) . . . . ?
Mo1 C28 C29 C34 120.1(6) . . . . ?
C32 C28 C29 Mo1 65.5(4) . . . . ?
C33 C28 C29 Mo1 -119.7(7) . . . . ?
C2 Mo1 C29 C30 136.0(4) . . . . ?
C1 Mo1 C29 C30 -150.5(4) . . . . ?
C3 Mo1 C29 C30 -12.8(5) . . . . ?
O1 Mo1 C29 C30 -57.7(4) . . . . ?
C28 Mo1 C29 C30 115.9(6) . . . . ?
C32 Mo1 C29 C30 76.7(4) . . . . ?
C31 Mo1 C29 C30 35.7(4) . . . . ?
C2 Mo1 C29 C28 20.1(5) . . . . ?
C1 Mo1 C29 C28 93.5(4) . . . . ?
C3 Mo1 C29 C28 -128.7(4) . . . . ?
O1 Mo1 C29 C28 -173.6(3) . . . . ?
C32 Mo1 C29 C28 -39.2(4) . . . . ?
C31 Mo1 C29 C28 -80.2(4) . . . . ?
C30 Mo1 C29 C28 -115.9(6) . . . . ?
C2 Mo1 C29 C34 -100.3(6) . . . . ?
C1 Mo1 C29 C34 -26.9(6) . . . . ?
C3 Mo1 C29 C34 110.9(6) . . . . ?
O1 Mo1 C29 C34 66.0(6) . . . . ?
C28 Mo1 C29 C34 -120.4(7) . . . . ?
C32 Mo1 C29 C34 -159.6(7) . . . . ?
C31 Mo1 C29 C34 159.3(7) . . . . ?
C30 Mo1 C29 C34 123.6(7) . . . . ?
C28 C29 C30 C31 1.2(7) . . . . ?
C34 C29 C30 C31 174.4(6) . . . . ?
Mo1 C29 C30 C31 -61.8(5) . . . . ?
C28 C29 C30 C35 -173.5(6) . . . . ?
C34 C29 C30 C35 -0.3(10) . . . . ?
Mo1 C29 C30 C35 123.5(7) . . . . ?
C28 C29 C30 Mo1 63.0(4) . . . . ?
C34 C29 C30 Mo1 -123.8(6) . . . . ?
C2 Mo1 C30 C31 35.3(7) . . . . ?
C1 Mo1 C30 C31 153.8(4) . . . . ?
C3 Mo1 C30 C31 -70.8(4) . . . . ?
O1 Mo1 C30 C31 -109.8(4) . . . . ?
C28 Mo1 C30 C31 80.1(4) . . . . ?
C32 Mo1 C30 C31 36.8(4) . . . . ?
C29 Mo1 C30 C31 118.1(6) . . . . ?
C2 Mo1 C30 C29 -82.8(6) . . . . ?
C1 Mo1 C30 C29 35.6(5) . . . . ?
C3 Mo1 C30 C29 171.0(4) . . . . ?
O1 Mo1 C30 C29 132.0(4) . . . . ?
C28 Mo1 C30 C29 -38.1(4) . . . . ?
C32 Mo1 C30 C29 -81.3(4) . . . . ?
C31 Mo1 C30 C29 -118.1(6) . . . . ?
C2 Mo1 C30 C35 156.5(6) . . . . ?
C1 Mo1 C30 C35 -85.1(7) . . . . ?
C3 Mo1 C30 C35 50.3(7) . . . . ?
O1 Mo1 C30 C35 11.4(6) . . . . ?
C28 Mo1 C30 C35 -158.7(7) . . . . ?
C32 Mo1 C30 C35 158.0(7) . . . . ?
C29 Mo1 C30 C35 -120.7(8) . . . . ?
C31 Mo1 C30 C35 121.2(8) . . . . ?
C29 C30 C31 C32 -0.7(7) . . . . ?
C35 C30 C31 C32 174.1(6) . . . . ?
Mo1 C30 C31 C32 -61.2(5) . . . . ?
C29 C30 C31 C36 -175.0(6) . . . . ?
C35 C30 C31 C36 -0.2(11) . . . . ?
Mo1 C30 C31 C36 124.5(7) . . . . ?
C29 C30 C31 Mo1 60.5(4) . . . . ?
C35 C30 C31 Mo1 -124.8(7) . . . . ?
C2 Mo1 C31 C32 -42.7(5) . . . . ?
C1 Mo1 C31 C32 68.5(7) . . . . ?
C3 Mo1 C31 C32 -130.0(4) . . . . ?
O1 Mo1 C31 C32 -164.7(4) . . . . ?
C28 Mo1 C31 C32 38.9(4) . . . . ?
C29 Mo1 C31 C32 81.1(4) . . . . ?
C30 Mo1 C31 C32 117.3(6) . . . . ?
C2 Mo1 C31 C30 -160.0(4) . . . . ?
C1 Mo1 C31 C30 -48.8(7) . . . . ?
C3 Mo1 C31 C30 112.7(4) . . . . ?
O1 Mo1 C31 C30 78.0(4) . . . . ?
C28 Mo1 C31 C30 -78.4(4) . . . . ?
C32 Mo1 C31 C30 -117.3(6) . . . . ?
C29 Mo1 C31 C30 -36.2(4) . . . . ?
C2 Mo1 C31 C36 78.4(8) . . . . ?
C1 Mo1 C31 C36 -170.4(6) . . . . ?
C3 Mo1 C31 C36 -8.8(7) . . . . ?
O1 Mo1 C31 C36 -43.6(7) . . . . ?
C28 Mo1 C31 C36 160.0(8) . . . . ?
C32 Mo1 C31 C36 121.1(9) . . . . ?
C29 Mo1 C31 C36 -157.7(8) . . . . ?
C30 Mo1 C31 C36 -121.6(9) . . . . ?
C30 C31 C32 C28 -0.1(8) . . . . ?
C36 C31 C32 C28 174.0(7) . . . . ?
Mo1 C31 C32 C28 -64.5(5) . . . . ?
C30 C31 C32 C37 -172.2(7) . . . . ?
C36 C31 C32 C37 2.0(12) . . . . ?
Mo1 C31 C32 C37 123.5(7) . . . . ?
C30 C31 C32 Mo1 64.3(5) . . . . ?
C36 C31 C32 Mo1 -121.5(7) . . . . ?
C29 C28 C32 C31 0.9(7) . . . . ?
C33 C28 C32 C31 -174.1(6) . . . . ?
Mo1 C28 C32 C31 67.6(5) . . . . ?
C29 C28 C32 C37 172.9(7) . . . . ?
C33 C28 C32 C37 -2.0(11) . . . . ?
Mo1 C28 C32 C37 -120.4(7) . . . . ?
C29 C28 C32 Mo1 -66.7(4) . . . . ?
C33 C28 C32 Mo1 118.3(7) . . . . ?
C2 Mo1 C32 C31 143.2(4) . . . . ?
C1 Mo1 C32 C31 -144.4(4) . . . . ?
C3 Mo1 C32 C31 55.4(4) . . . . ?
O1 Mo1 C32 C31 23.4(5) . . . . ?
C28 Mo1 C32 C31 -115.2(6) . . . . ?
C29 Mo1 C32 C31 -76.7(4) . . . . ?
C30 Mo1 C32 C31 -36.0(4) . . . . ?
C2 Mo1 C32 C28 -101.7(4) . . . . ?
C1 Mo1 C32 C28 -29.3(5) . . . . ?
C3 Mo1 C32 C28 170.6(4) . . . . ?
O1 Mo1 C32 C28 138.6(4) . . . . ?
C29 Mo1 C32 C28 38.4(4) . . . . ?
C31 Mo1 C32 C28 115.2(6) . . . . ?
C30 Mo1 C32 C28 79.1(4) . . . . ?
C2 Mo1 C32 C37 19.2(7) . . . . ?
C1 Mo1 C32 C37 91.5(7) . . . . ?
C3 Mo1 C32 C37 -68.6(7) . . . . ?
O1 Mo1 C32 C37 -100.6(7) . . . . ?
C28 Mo1 C32 C37 120.8(9) . . . . ?
C29 Mo1 C32 C37 159.2(8) . . . . ?
C31 Mo1 C32 C37 -124.0(8) . . . . ?
C30 Mo1 C32 C37 -160.1(8) . . . . ?
C44 Si2 O4 C40 158.4(7) . . . . ?
C58 Si2 O4 C40 -85.4(8) . . . . ?
C51 Si2 O4 C40 38.0(8) . . . . ?
C44 Si2 O4 Mo2 -41.8(6) . . . . ?
C58 Si2 O4 Mo2 74.4(6) . . . . ?
C51 Si2 O4 Mo2 -162.2(5) . . . . ?
C39 Mo2 O4 C40 61.0(4) . . . . ?
C38 Mo2 O4 C40 137.7(4) . . . . ?
C65 Mo2 O4 C40 -113.6(6) . . . . ?
C66 Mo2 O4 C40 -54.4(5) . . . . ?
C69 Mo2 O4 C40 -131.0(4) . . . . ?
C67 Mo2 O4 C40 -70.1(4) . . . . ?
C68 Mo2 O4 C40 -103.8(4) . . . . ?
C39 Mo2 O4 Si2 -106.2(5) . . . . ?
C38 Mo2 O4 Si2 -29.5(6) . . . . ?
C40 Mo2 O4 Si2 -167.2(7) . . . . ?
C65 Mo2 O4 Si2 79.1(7) . . . . ?
C66 Mo2 O4 Si2 138.4(5) . . . . ?
C69 Mo2 O4 Si2 61.7(6) . . . . ?
C67 Mo2 O4 Si2 122.6(5) . . . . ?
C68 Mo2 O4 Si2 89.0(5) . . . . ?
Si2 O4 C40 C41 44.8(11) . . . . ?
Mo2 O4 C40 C41 -123.2(7) . . . . ?
Si2 O4 C40 Mo2 168.0(7) . . . . ?
C39 Mo2 C40 O4 -124.0(4) . . . . ?
C38 Mo2 C40 O4 -51.0(5) . . . . ?
C65 Mo2 C40 O4 138.4(4) . . . . ?
C66 Mo2 C40 O4 144.0(4) . . . . ?
C69 Mo2 C40 O4 79.1(5) . . . . ?
C67 Mo2 C40 O4 113.8(4) . . . . ?
C68 Mo2 C40 O4 82.9(4) . . . . ?
C39 Mo2 C40 C41 -10.8(6) . . . . ?
C38 Mo2 C40 C41 62.2(7) . . . . ?
O4 Mo2 C40 C41 113.3(7) . . . . ?
C65 Mo2 C40 C41 -108.3(7) . . . . ?
C66 Mo2 C40 C41 -102.8(6) . . . . ?
C69 Mo2 C40 C41 -167.6(5) . . . . ?
C67 Mo2 C40 C41 -132.9(6) . . . . ?
C68 Mo2 C40 C41 -163.8(6) . . . . ?
O4 C40 C41 C43 172.9(6) . . . . ?
Mo2 C40 C41 C43 85.0(8) . . . . ?
O4 C40 C41 C42 -63.8(9) . . . . ?
Mo2 C40 C41 C42 -151.7(6) . . . . ?
O4 Si2 C44 C45 86.7(6) . . . . ?
C58 Si2 C44 C45 -31.2(6) . . . . ?
C51 Si2 C44 C45 -156.3(6) . . . . ?
O4 Si2 C44 C49 -97.7(6) . . . . ?
C58 Si2 C44 C49 144.5(6) . . . . ?
C51 Si2 C44 C49 19.3(7) . . . . ?
C49 C44 C45 C46 -0.5(10) . . . . ?
Si2 C44 C45 C46 175.4(6) . . . . ?
C44 C45 C46 C47 -0.2(11) . . . . ?
C45 C46 C47 C48 0.5(11) . . . . ?
C45 C46 C47 C50 -177.8(7) . . . . ?
C46 C47 C48 C49 0.1(11) . . . . ?
C50 C47 C48 C49 178.4(7) . . . . ?
C47 C48 C49 C44 -0.9(11) . . . . ?
C45 C44 C49 C48 1.1(11) . . . . ?
Si2 C44 C49 C48 -174.8(6) . . . . ?
O4 Si2 C51 C56 -136.9(5) . . . . ?
C44 Si2 C51 C56 104.6(6) . . . . ?
C58 Si2 C51 C56 -16.4(7) . . . . ?
O4 Si2 C51 C52 41.0(6) . . . . ?
C44 Si2 C51 C52 -77.5(6) . . . . ?
C58 Si2 C51 C52 161.4(5) . . . . ?
C56 C51 C52 C53 -0.6(10) . . . . ?
Si2 C51 C52 C53 -178.6(5) . . . . ?
C51 C52 C53 C54 -0.7(11) . . . . ?
C52 C53 C54 C55 0.9(11) . . . . ?
C52 C53 C54 C57 -175.8(7) . . . . ?
C53 C54 C55 C56 0.2(11) . . . . ?
C57 C54 C55 C56 176.9(7) . . . . ?
C54 C55 C56 C51 -1.5(11) . . . . ?
C52 C51 C56 C55 1.7(10) . . . . ?
Si2 C51 C56 C55 179.6(5) . . . . ?
O4 Si2 C58 C59 -171.8(6) . . . . ?
C44 Si2 C58 C59 -54.4(7) . . . . ?
C51 Si2 C58 C59 69.4(6) . . . . ?
O4 Si2 C58 C63 3.7(7) . . . . ?
C44 Si2 C58 C63 121.2(6) . . . . ?
C51 Si2 C58 C63 -115.0(6) . . . . ?
C63 C58 C59 C60 2.7(11) . . . . ?
Si2 C58 C59 C60 178.5(6) . . . . ?
C58 C59 C60 C61 0.0(12) . . . . ?
C59 C60 C61 C62 -2.9(11) . . . . ?
C59 C60 C61 C64 175.0(7) . . . . ?
C60 C61 C62 C63 3.1(11) . . . . ?
C64 C61 C62 C63 -174.8(7) . . . . ?
C61 C62 C63 C58 -0.5(12) . . . . ?
C59 C58 C63 C62 -2.4(11) . . . . ?
Si2 C58 C63 C62 -178.1(6) . . . . ?
C39 Mo2 C65 C66 -85.8(5) . . . . ?
C38 Mo2 C65 C66 -162.9(5) . . . . ?
C40 Mo2 C65 C66 9.0(7) . . . . ?
O4 Mo2 C65 C66 89.0(7) . . . . ?
C69 Mo2 C65 C66 114.8(6) . . . . ?
C67 Mo2 C65 C66 37.9(5) . . . . ?
C68 Mo2 C65 C66 77.6(5) . . . . ?
C39 Mo2 C65 C69 159.3(5) . . . . ?
C38 Mo2 C65 C69 82.3(5) . . . . ?
C40 Mo2 C65 C69 -105.9(6) . . . . ?
O4 Mo2 C65 C69 -25.8(8) . . . . ?
C66 Mo2 C65 C69 -114.8(6) . . . . ?
C67 Mo2 C65 C69 -77.0(5) . . . . ?
C68 Mo2 C65 C69 -37.2(4) . . . . ?
C39 Mo2 C65 C70 35.4(7) . . . . ?
C38 Mo2 C65 C70 -41.6(7) . . . . ?
C40 Mo2 C65 C70 130.2(7) . . . . ?
O4 Mo2 C65 C70 -149.7(6) . . . . ?
C66 Mo2 C65 C70 121.3(9) . . . . ?
C69 Mo2 C65 C70 -123.9(9) . . . . ?
C67 Mo2 C65 C70 159.1(8) . . . . ?
C68 Mo2 C65 C70 -161.1(8) . . . . ?
C69 C65 C66 C67 -0.9(9) . . . . ?
C70 C65 C66 C67 174.9(7) . . . . ?
Mo2 C65 C66 C67 -67.3(5) . . . . ?
C69 C65 C66 C71 -173.6(8) . . . . ?
C70 C65 C66 C71 2.2(13) . . . . ?
Mo2 C65 C66 C71 120.0(8) . . . . ?
C69 C65 C66 Mo2 66.4(5) . . . . ?
C70 C65 C66 Mo2 -117.8(8) . . . . ?
C39 Mo2 C66 C65 97.1(5) . . . . ?
C38 Mo2 C66 C65 22.4(6) . . . . ?
C40 Mo2 C66 C65 -174.5(4) . . . . ?
O4 Mo2 C66 C65 -141.8(4) . . . . ?
C69 Mo2 C66 C65 -38.5(4) . . . . ?
C67 Mo2 C66 C65 -114.8(7) . . . . ?
C68 Mo2 C66 C65 -79.7(5) . . . . ?
C39 Mo2 C66 C67 -148.1(5) . . . . ?
C38 Mo2 C66 C67 137.2(5) . . . . ?
C40 Mo2 C66 C67 -59.7(5) . . . . ?
O4 Mo2 C66 C67 -27.0(6) . . . . ?
C65 Mo2 C66 C67 114.8(7) . . . . ?
C69 Mo2 C66 C67 76.3(5) . . . . ?
C68 Mo2 C66 C67 35.1(5) . . . . ?
C39 Mo2 C66 C71 -25.4(7) . . . . ?
C38 Mo2 C66 C71 -100.1(7) . . . . ?
C40 Mo2 C66 C71 63.0(7) . . . . ?
O4 Mo2 C66 C71 95.7(7) . . . . ?
C65 Mo2 C66 C71 -122.5(9) . . . . ?
C69 Mo2 C66 C71 -161.0(8) . . . . ?
C67 Mo2 C66 C71 122.7(9) . . . . ?
C68 Mo2 C66 C71 157.8(8) . . . . ?
C65 C66 C67 C68 1.1(9) . . . . ?
C71 C66 C67 C68 174.0(7) . . . . ?
Mo2 C66 C67 C68 -63.1(5) . . . . ?
C65 C66 C67 C72 -175.1(7) . . . . ?
C71 C66 C67 C72 -2.2(12) . . . . ?
Mo2 C66 C67 C72 120.7(7) . . . . ?
C65 C66 C67 Mo2 64.2(5) . . . . ?
C71 C66 C67 Mo2 -122.9(8) . . . . ?
C39 Mo2 C67 C68 157.1(4) . . . . ?
C38 Mo2 C67 C68 38.2(8) . . . . ?
C40 Mo2 C67 C68 -116.7(5) . . . . ?
O4 Mo2 C67 C68 -80.2(4) . . . . ?
C65 Mo2 C67 C68 79.8(5) . . . . ?
C66 Mo2 C67 C68 118.5(7) . . . . ?
C69 Mo2 C67 C68 36.9(4) . . . . ?
C39 Mo2 C67 C66 38.5(6) . . . . ?
C38 Mo2 C67 C66 -80.3(7) . . . . ?
C40 Mo2 C67 C66 124.8(5) . . . . ?
O4 Mo2 C67 C66 161.2(5) . . . . ?
C65 Mo2 C67 C66 -38.7(5) . . . . ?
C69 Mo2 C67 C66 -81.6(5) . . . . ?
C68 Mo2 C67 C66 -118.5(7) . . . . ?
C39 Mo2 C67 C72 -79.1(8) . . . . ?
C38 Mo2 C67 C72 162.0(7) . . . . ?
C40 Mo2 C67 C72 7.1(8) . . . . ?
O4 Mo2 C67 C72 43.5(8) . . . . ?
C65 Mo2 C67 C72 -156.4(9) . . . . ?
C66 Mo2 C67 C72 -117.7(10) . . . . ?
C69 Mo2 C67 C72 160.7(9) . . . . ?
C68 Mo2 C67 C72 123.8(9) . . . . ?
C66 C67 C68 C69 -0.9(9) . . . . ?
C72 C67 C68 C69 175.3(7) . . . . ?
Mo2 C67 C68 C69 -61.0(5) . . . . ?
C66 C67 C68 C73 179.7(7) . . . . ?
C72 C67 C68 C73 -4.2(13) . . . . ?
Mo2 C67 C68 C73 119.6(8) . . . . ?
C66 C67 C68 Mo2 60.1(5) . . . . ?
C72 C67 C68 Mo2 -123.8(8) . . . . ?
C39 Mo2 C68 C67 -43.3(8) . . . . ?
C38 Mo2 C68 C67 -158.2(5) . . . . ?
C40 Mo2 C68 C67 66.6(5) . . . . ?
O4 Mo2 C68 C67 105.6(4) . . . . ?
C65 Mo2 C68 C67 -79.3(5) . . . . ?
C66 Mo2 C68 C67 -36.7(4) . . . . ?
C69 Mo2 C68 C67 -117.8(6) . . . . ?
C39 Mo2 C68 C69 74.5(8) . . . . ?
C38 Mo2 C68 C69 -40.4(5) . . . . ?
C40 Mo2 C68 C69 -175.6(4) . . . . ?
O4 Mo2 C68 C69 -136.6(4) . . . . ?
C65 Mo2 C68 C69 38.6(4) . . . . ?
C66 Mo2 C68 C69 81.1(5) . . . . ?
C67 Mo2 C68 C69 117.8(6) . . . . ?
C39 Mo2 C68 C73 -165.0(7) . . . . ?
C38 Mo2 C68 C73 80.1(8) . . . . ?
C40 Mo2 C68 C73 -55.2(7) . . . . ?
O4 Mo2 C68 C73 -16.1(7) . . . . ?
C65 Mo2 C68 C73 159.0(8) . . . . ?
C66 Mo2 C68 C73 -158.4(8) . . . . ?
C69 Mo2 C68 C73 120.5(9) . . . . ?
C67 Mo2 C68 C73 -121.7(9) . . . . ?
C67 C68 C69 C65 0.3(9) . . . . ?
C73 C68 C69 C65 179.7(7) . . . . ?
Mo2 C68 C69 C65 -62.3(5) . . . . ?
C67 C68 C69 C74 -174.5(8) . . . . ?
C73 C68 C69 C74 5.0(13) . . . . ?
Mo2 C68 C69 C74 122.9(8) . . . . ?
C67 C68 C69 Mo2 62.6(5) . . . . ?
C73 C68 C69 Mo2 -118.0(8) . . . . ?
C66 C65 C69 C68 0.4(9) . . . . ?
C70 C65 C69 C68 -175.3(8) . . . . ?
Mo2 C65 C69 C68 65.9(5) . . . . ?
C66 C65 C69 C74 175.2(8) . . . . ?
C70 C65 C69 C74 -0.6(14) . . . . ?
Mo2 C65 C69 C74 -119.3(8) . . . . ?
C66 C65 C69 Mo2 -65.5(5) . . . . ?
C70 C65 C69 Mo2 118.8(8) . . . . ?
C39 Mo2 C69 C68 -142.8(4) . . . . ?
C38 Mo2 C69 C68 145.1(5) . . . . ?
C40 Mo2 C69 C68 6.4(6) . . . . ?
O4 Mo2 C69 C68 52.1(5) . . . . ?
C65 Mo2 C69 C68 -115.5(7) . . . . ?
C66 Mo2 C69 C68 -77.2(5) . . . . ?
C67 Mo2 C69 C68 -35.6(4) . . . . ?
C39 Mo2 C69 C65 -27.2(6) . . . . ?
C38 Mo2 C69 C65 -99.4(5) . . . . ?
C40 Mo2 C69 C65 122.0(5) . . . . ?
O4 Mo2 C69 C65 167.6(4) . . . . ?
C66 Mo2 C69 C65 38.3(4) . . . . ?
C67 Mo2 C69 C65 79.9(5) . . . . ?
C68 Mo2 C69 C65 115.5(7) . . . . ?
C39 Mo2 C69 C74 93.5(7) . . . . ?
C38 Mo2 C69 C74 21.4(7) . . . . ?
C40 Mo2 C69 C74 -117.3(7) . . . . ?
O4 Mo2 C69 C74 -71.6(7) . . . . ?
C65 Mo2 C69 C74 120.8(9) . . . . ?
C66 Mo2 C69 C74 159.1(8) . . . . ?
C67 Mo2 C69 C74 -159.3(8) . . . . ?
C68 Mo2 C69 C74 -123.7(8) . . . . ?
#######################################################################
#
#                 Cambridge Crystallographic Data Centre
#                                CCDC 
# 
#######################################################################
# 
#  This CIF contains data from an original supplementary publication
#  deposited with the CCDC, and may include chemical, crystal,
#  experimental, refinement, atomic coordinates,
#  anisotropic displacement parameters and molecular geometry data,
#  as required by the journal to which it was submitted.
#
#  This CIF is provided on the understanding that it is used for bona
#  fide research purposes only. It may contain copyright material
#  of the CCDC or of third parties, and may not be copied or further
#  disseminated in any form, whether machine-readable or not,
#  except for the purpose of generating routine backup copies
#  on your local computer system.
# 
#  For further information on the CCDC, data deposition and
#  data retrieval see:
#                         www.ccdc.cam.ac.uk
#
#  Bona fide researchers may freely download Mercury and enCIFer
#  from this site to visualise CIF-encoded structures and 
#  to carry out CIF format checking respectively.
#
data_complex-4
_database_code_depnum_ccdc_archive 'CCDC 990557'

_audit_creation_method           SHELXL-97
_chemical_name_systematic        
; 
 ? 
;
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C39 H46 Mo O4 Si'
_chemical_formula_sum            'C39 H46 Mo O4 Si'
_chemical_formula_weight         702.79

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'
O O 0.0106 0.0060 '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'
Mo Mo -1.6832 0.6857 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'P 21'
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_Int_Tables_number      4

loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z'

_cell_length_a                   12.8069(3)
_cell_length_b                   13.1036(4)
_cell_length_c                   21.5568(7)
_cell_angle_alpha                90.00
_cell_angle_beta                 90.7174(4)
_cell_angle_gamma                90.00
_cell_volume                     3617.30(18)
_cell_formula_units_Z            4
_cell_measurement_temperature    150(2)
_cell_measurement_reflns_used    74134
_cell_measurement_theta_min      0.95
_cell_measurement_theta_max      27.48

_exptl_crystal_description       block
_exptl_crystal_colour            red
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.08
_exptl_crystal_density_meas      ?
_exptl_crystal_density_diffrn    1.290
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1472
_exptl_absorpt_coefficient_mu    0.433
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_correction_T_min  0.9184
_exptl_absorpt_correction_T_max  0.9662
_exptl_absorpt_process_details   
; 
HIGASHI, T. (1999). Shape - Program to obtain Crystal Shape using CCD camera.
Rigaku Corporation, Tokyo, Japan. 
HIGASHI, T. (1999). Numabs - Numerical Absorption Correction,
Rigaku Corporation, Tokyo, Japan. 
;

_exptl_special_details           
; 
 ? 
;

_diffrn_ambient_temperature      150(2)
_diffrn_radiation_wavelength     0.71069
_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'rotating-anode X-ray tube'
_diffrn_radiation_monochromator  graphite
_diffrn_measurement_device_type  'Rigaku RAXIS-RAPID Imaging Plate'
_diffrn_measurement_method       ω
_diffrn_detector_area_resol_mean 10.00
_diffrn_standards_number         ?
_diffrn_standards_interval_count ?
_diffrn_standards_interval_time  ?
_diffrn_standards_decay_%        ?
_diffrn_reflns_number            51709
_diffrn_reflns_av_R_equivalents  0.1025
_diffrn_reflns_av_sigmaI/netI    0.0821
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_h_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -27
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_theta_min         0.94
_diffrn_reflns_theta_max         27.48
_diffrn_measured_fraction_theta_max 0.998
_diffrn_reflns_theta_full        27.48
_diffrn_measured_fraction_theta_full 0.998

_reflns_number_total             15836
_reflns_number_gt                13573
_reflns_threshold_expression     >2σ(I)

_computing_data_collection       PROCESS-AUTO
_computing_cell_refinement       PROCESS-AUTO
_computing_data_reduction        'teXsan Ver.1.11'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_molecular_graphics    
;
'ORTEP-3', 'Yadokari-XG 2009 (Wakita, Nemoto, et al., 2009)'
;
_computing_publication_material  
;
'Yadokari-XG 2009 (Wakita, Nemoto, et al., 2009)'
;

_refine_special_details          
; 
 Refinement of F² against ALL reflections.  The weighted R-factor wR and 
 goodness of fit S are based on F², conventional R-factors R are based 
 on F, with F set to zero for negative F². The threshold expression of 
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is 
 not relevant to the choice of reflections for refinement.  R-factors based 
 on F² are statistically about twice as large as those based on F, and R- 
 factors based on ALL data will be even larger. 
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'calc w=1/[σ²(Fo²)+(0.0529P)²+4.3908P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?
_refine_ls_abs_structure_details 'Flack H D (1983), Acta Cryst. A39, 876-881'
_refine_ls_abs_structure_Flack   0.00(6)
_refine_ls_number_reflns         15836
_refine_ls_number_parameters     834
_refine_ls_number_restraints     1
_refine_ls_R_factor_all          0.0853
_refine_ls_R_factor_gt           0.0681
_refine_ls_wR_factor_ref         0.1365
_refine_ls_wR_factor_gt          0.1278
_refine_ls_goodness_of_fit_ref   1.149
_refine_ls_restrained_S_all      1.149
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_diff_density_max         0.709
_refine_diff_density_min         -0.985
_refine_diff_density_rms         0.132

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
Mo1 Mo 0.33650(4) 0.07512(3) 0.06334(2) 0.02095(11) Uani 1 1 d . . .
Mo2 Mo 0.78226(3) -0.16777(3) 0.57176(2) 0.02097(11) Uani 1 1 d . . .
Si1 Si 0.49529(13) -0.12530(12) 0.20959(7) 0.0202(3) Uani 1 1 d . . .
Si2 Si 0.94923(12) 0.03332(12) 0.71166(7) 0.0197(3) Uani 1 1 d . . .
O1 O 0.5731(4) 0.0596(4) 0.0358(2) 0.0515(14) Uani 1 1 d . . .
O2 O 0.3612(6) -0.0563(4) -0.0549(2) 0.0654(17) Uani 1 1 d . . .
O3 O 0.3648(3) 0.0380(3) 0.16097(19) 0.0245(9) Uani 1 1 d . . .
O4 O 0.3964(3) -0.1314(3) 0.15712(18) 0.0232(9) Uani 1 1 d . . .
O5 O 0.7427(6) -0.0369(4) 0.4537(2) 0.0658(18) Uani 1 1 d . . .
O6 O 1.0008(4) -0.1112(4) 0.5232(2) 0.0465(13) Uani 1 1 d . . .
O7 O 0.8261(3) -0.1365(3) 0.66818(18) 0.0249(9) Uani 1 1 d . . .
O8 O 0.8399(3) 0.0346(3) 0.66724(18) 0.0219(9) Uani 1 1 d . . .
C1 C 0.4865(6) 0.0618(5) 0.0495(3) 0.0361(15) Uani 1 1 d . . .
C2 C 0.3479(6) -0.0088(5) -0.0101(3) 0.0376(16) Uani 1 1 d . . .
C3 C 0.3336(5) -0.0509(4) 0.1438(2) 0.0206(12) Uani 1 1 d . . .
C4 C 0.2419(5) -0.0586(5) 0.1079(3) 0.0282(14) Uani 1 1 d . . .
H79 H 0.1863 -0.0250 0.1329 0.034 Uiso 1 1 calc R . .
C5 C 0.1944(5) -0.1608(5) 0.0860(3) 0.0362(15) Uani 1 1 d . . .
C6 C 0.1023(7) -0.1337(6) 0.0413(5) 0.081(4) Uani 1 1 d . . .
H6 H 0.1288 -0.0956 0.0057 0.122 Uiso 1 1 calc R . .
H6A H 0.0512 -0.0919 0.0632 0.122 Uiso 1 1 calc R . .
H6B H 0.0687 -0.1967 0.0267 0.122 Uiso 1 1 calc R . .
C7 C 0.2691(6) -0.2295(5) 0.0519(3) 0.0403(17) Uani 1 1 d . . .
H7 H 0.3000 -0.1919 0.0173 0.060 Uiso 1 1 calc R . .
H7A H 0.2312 -0.2890 0.0357 0.060 Uiso 1 1 calc R . .
H7B H 0.3246 -0.2522 0.0804 0.060 Uiso 1 1 calc R . .
C8 C 0.1518(7) -0.2157(6) 0.1421(5) 0.063(3) Uani 1 1 d . . .
H8 H 0.1073 -0.2724 0.1284 0.094 Uiso 1 1 calc R . .
H8A H 0.1107 -0.1680 0.1668 0.094 Uiso 1 1 calc R . .
H8B H 0.2099 -0.2423 0.1673 0.094 Uiso 1 1 calc R . .
C9 C 0.6000(4) -0.0318(4) 0.1924(3) 0.0211(11) Uani 1 1 d . . .
C10 C 0.6892(5) -0.0576(5) 0.1587(3) 0.0266(13) Uani 1 1 d . . .
H10 H 0.6977 -0.1260 0.1449 0.032 Uiso 1 1 calc R . .
C11 C 0.7642(5) 0.0130(5) 0.1451(3) 0.0291(14) Uani 1 1 d . . .
H11 H 0.8238 -0.0073 0.1224 0.035 Uiso 1 1 calc R . .
C12 C 0.7547(5) 0.1145(5) 0.1641(3) 0.0314(14) Uani 1 1 d . . .
C13 C 0.6688(5) 0.1405(5) 0.1989(3) 0.0318(14) Uani 1 1 d . . .
H13 H 0.6621 0.2085 0.2135 0.038 Uiso 1 1 calc R . .
C14 C 0.5927(5) 0.0701(5) 0.2129(3) 0.0283(12) Uani 1 1 d . . .
H14 H 0.5344 0.0906 0.2366 0.034 Uiso 1 1 calc R . .
C15 C 0.8358(6) 0.1926(6) 0.1469(4) 0.0490(19) Uani 1 1 d . . .
H15 H 0.8220 0.2170 0.1046 0.074 Uiso 1 1 calc R . .
H15A H 0.9053 0.1614 0.1490 0.074 Uiso 1 1 calc R . .
H15B H 0.8329 0.2501 0.1758 0.074 Uiso 1 1 calc R . .
C16 C 0.4357(5) -0.1003(4) 0.2866(2) 0.0234(12) Uani 1 1 d . . .
C17 C 0.3298(5) -0.1199(5) 0.2972(3) 0.0259(13) Uani 1 1 d . . .
H17 H 0.2859 -0.1400 0.2635 0.031 Uiso 1 1 calc R . .
C18 C 0.2883(5) -0.1106(5) 0.3556(3) 0.0328(14) Uani 1 1 d . . .
H18 H 0.2162 -0.1238 0.3616 0.039 Uiso 1 1 calc R . .
C19 C 0.3505(5) -0.0822(5) 0.4054(3) 0.0315(14) Uani 1 1 d . . .
C20 C 0.4547(6) -0.0617(5) 0.3954(3) 0.0357(15) Uani 1 1 d . . .
H20 H 0.4976 -0.0401 0.4291 0.043 Uiso 1 1 calc R . .
C21 C 0.4973(5) -0.0718(5) 0.3376(3) 0.0301(13) Uani 1 1 d . . .
H21 H 0.5697 -0.0593 0.3323 0.036 Uiso 1 1 calc R . .
C22 C 0.3034(6) -0.0765(6) 0.4700(3) 0.0412(16) Uani 1 1 d . . .
H22 H 0.3367 -0.1274 0.4970 0.062 Uiso 1 1 calc R . .
H22A H 0.2282 -0.0900 0.4671 0.062 Uiso 1 1 calc R . .
H22B H 0.3149 -0.0082 0.4873 0.062 Uiso 1 1 calc R . .
C23 C 0.5482(4) -0.2576(4) 0.2068(3) 0.0217(12) Uani 1 1 d . . .
C24 C 0.4997(5) -0.3359(5) 0.1745(3) 0.0292(13) Uani 1 1 d . . .
H24 H 0.4378 -0.3222 0.1512 0.035 Uiso 1 1 calc R . .
C25 C 0.5404(5) -0.4350(5) 0.1755(3) 0.0313(13) Uani 1 1 d . . .
H25 H 0.5068 -0.4874 0.1523 0.038 Uiso 1 1 calc R . .
C26 C 0.6295(5) -0.4574(5) 0.2102(3) 0.0293(14) Uani 1 1 d . . .
C27 C 0.6764(5) -0.3802(5) 0.2430(3) 0.0331(14) Uani 1 1 d . . .
H27 H 0.7371 -0.3949 0.2671 0.040 Uiso 1 1 calc R . .
C28 C 0.6387(5) -0.2819(5) 0.2421(3) 0.0301(14) Uani 1 1 d . . .
H28 H 0.6735 -0.2302 0.2653 0.036 Uiso 1 1 calc R . .
C29 C 0.6698(6) -0.5667(5) 0.2122(4) 0.0429(17) Uani 1 1 d . . .
H29 H 0.6800 -0.5915 0.1698 0.064 Uiso 1 1 calc R . .
H29A H 0.6189 -0.6102 0.2332 0.064 Uiso 1 1 calc R . .
H29B H 0.7365 -0.5688 0.2350 0.064 Uiso 1 1 calc R . .
C30 C 0.3433(5) 0.2362(5) 0.0210(3) 0.0294(14) Uani 1 1 d . . .
C31 C 0.2493(5) 0.1914(4) -0.0010(3) 0.0263(13) Uani 1 1 d . . .
C32 C 0.1804(5) 0.1771(5) 0.0500(3) 0.0282(13) Uani 1 1 d . . .
C33 C 0.2361(6) 0.2122(5) 0.1049(3) 0.0316(16) Uani 1 1 d . . .
C34 C 0.3372(6) 0.2468(5) 0.0862(3) 0.0349(16) Uani 1 1 d . . .
C35 C 0.4314(5) 0.2751(5) -0.0187(3) 0.0419(16) Uani 1 1 d . . .
H35 H 0.4392 0.2304 -0.0548 0.063 Uiso 1 1 calc R . .
H35A H 0.4965 0.2754 0.0057 0.063 Uiso 1 1 calc R . .
H35B H 0.4155 0.3446 -0.0327 0.063 Uiso 1 1 calc R . .
C36 C 0.2188(6) 0.1761(5) -0.0678(3) 0.0396(16) Uani 1 1 d . . .
H36 H 0.1822 0.2369 -0.0832 0.059 Uiso 1 1 calc R . .
H36A H 0.1726 0.1167 -0.0714 0.059 Uiso 1 1 calc R . .
H36B H 0.2815 0.1646 -0.0924 0.059 Uiso 1 1 calc R . .
C37 C 0.0690(5) 0.1451(6) 0.0467(4) 0.0423(17) Uani 1 1 d . . .
H37 H 0.0241 0.2055 0.0488 0.063 Uiso 1 1 calc R . .
H37A H 0.0539 0.0997 0.0816 0.063 Uiso 1 1 calc R . .
H37B H 0.0557 0.1090 0.0076 0.063 Uiso 1 1 calc R . .
C38 C 0.1934(6) 0.2143(6) 0.1694(3) 0.0454(18) Uani 1 1 d . . .
H38 H 0.2425 0.1803 0.1979 0.068 Uiso 1 1 calc R . .
H38A H 0.1262 0.1787 0.1700 0.068 Uiso 1 1 calc R . .
H38B H 0.1837 0.2853 0.1825 0.068 Uiso 1 1 calc R . .
C39 C 0.4180(6) 0.2933(6) 0.1296(4) 0.048(2) Uani 1 1 d . . .
H39 H 0.4860 0.2944 0.1093 0.071 Uiso 1 1 calc R . .
H39A H 0.4229 0.2524 0.1676 0.071 Uiso 1 1 calc R . .
H39B H 0.3973 0.3631 0.1401 0.071 Uiso 1 1 calc R . .
C40 C 0.7537(6) -0.0826(5) 0.4986(3) 0.0402(17) Uani 1 1 d . . .
C41 C 0.9215(5) -0.1261(5) 0.5444(3) 0.0282(13) Uani 1 1 d . . .
C42 C 0.7842(4) -0.0498(5) 0.6570(2) 0.0221(12) Uani 1 1 d . . .
C43 C 0.6841(5) -0.0465(4) 0.6281(3) 0.0234(12) Uani 1 1 d . . .
H43 H 0.6366 -0.0867 0.6553 0.028 Uiso 1 1 calc R . .
C44 C 0.6249(5) 0.0513(4) 0.6112(3) 0.0277(13) Uani 1 1 d . . .
C45 C 0.6873(5) 0.1271(5) 0.5730(3) 0.0364(15) Uani 1 1 d . . .
H45 H 0.7024 0.0973 0.5324 0.055 Uiso 1 1 calc R . .
H45A H 0.7530 0.1430 0.5947 0.055 Uiso 1 1 calc R . .
H45B H 0.6467 0.1899 0.5673 0.055 Uiso 1 1 calc R . .
C46 C 0.5951(6) 0.1044(5) 0.6724(3) 0.0443(18) Uani 1 1 d . . .
H46 H 0.5525 0.1648 0.6632 0.066 Uiso 1 1 calc R . .
H46A H 0.6587 0.1251 0.6949 0.066 Uiso 1 1 calc R . .
H46B H 0.5552 0.0570 0.6981 0.066 Uiso 1 1 calc R . .
C47 C 0.5252(6) 0.0211(6) 0.5770(3) 0.0425(17) Uani 1 1 d . . .
H47 H 0.4826 0.0819 0.5693 0.064 Uiso 1 1 calc R . .
H47A H 0.4859 -0.0274 0.6024 0.064 Uiso 1 1 calc R . .
H47B H 0.5429 -0.0109 0.5374 0.064 Uiso 1 1 calc R . .
C48 C 1.0528(4) -0.0582(5) 0.6859(3) 0.0236(12) Uani 1 1 d . . .
C49 C 1.0541(4) -0.1591(5) 0.7047(3) 0.0257(12) Uani 1 1 d . . .
H49 H 1.0013 -0.1829 0.7316 0.031 Uiso 1 1 calc R . .
C50 C 1.1295(5) -0.2259(5) 0.6854(3) 0.0288(13) Uani 1 1 d . . .
H50 H 1.1279 -0.2947 0.6991 0.035 Uiso 1 1 calc R . .
C51 C 1.2076(5) -0.1945(5) 0.6465(3) 0.0313(14) Uani 1 1 d . . .
C52 C 1.2087(5) -0.0927(5) 0.6282(3) 0.0324(14) Uani 1 1 d . . .
H52 H 1.2620 -0.0694 0.6014 0.039 Uiso 1 1 calc R . .
C53 C 1.1332(4) -0.0246(5) 0.6483(2) 0.0235(12) Uani 1 1 d . . .
H53 H 1.1366 0.0451 0.6364 0.028 Uiso 1 1 calc R . .
C54 C 1.2904(6) -0.2683(6) 0.6249(4) 0.0504(19) Uani 1 1 d . . .
H54 H 1.3379 -0.2843 0.6596 0.076 Uiso 1 1 calc R . .
H54A H 1.3300 -0.2372 0.5912 0.076 Uiso 1 1 calc R . .
H54B H 1.2571 -0.3311 0.6100 0.076 Uiso 1 1 calc R . .
C55 C 0.9095(4) 0.0034(4) 0.7925(3) 0.0207(12) Uani 1 1 d . . .
C56 C 0.9807(5) -0.0289(5) 0.8375(3) 0.0269(13) Uani 1 1 d . . .
H56 H 1.0508 -0.0419 0.8259 0.032 Uiso 1 1 calc R . .
C57 C 0.9530(5) -0.0426(5) 0.8977(3) 0.0311(14) Uani 1 1 d . . .
H57 H 1.0041 -0.0648 0.9271 0.037 Uiso 1 1 calc R . .
C58 C 0.8524(5) -0.0248(4) 0.9170(3) 0.0275(13) Uani 1 1 d . . .
C59 C 0.7789(5) 0.0068(4) 0.8727(3) 0.0260(12) Uani 1 1 d . . .
H59 H 0.7089 0.0187 0.8848 0.031 Uiso 1 1 calc R . .
C60 C 0.8066(5) 0.0208(5) 0.8117(3) 0.0257(12) Uani 1 1 d . . .
H60 H 0.7554 0.0425 0.7823 0.031 Uiso 1 1 calc R . .
C61 C 0.8214(6) -0.0373(5) 0.9840(3) 0.0376(16) Uani 1 1 d . . .
H61 H 0.8436 -0.1046 0.9990 0.056 Uiso 1 1 calc R . .
H61A H 0.7454 -0.0312 0.9873 0.056 Uiso 1 1 calc R . .
H61B H 0.8551 0.0158 1.0092 0.056 Uiso 1 1 calc R . .
C62 C 0.9964(4) 0.1671(4) 0.7043(3) 0.0219(12) Uani 1 1 d . . .
C63 C 1.0540(5) 0.2123(5) 0.7523(3) 0.0303(14) Uani 1 1 d . . .
H63 H 1.0658 0.1751 0.7896 0.036 Uiso 1 1 calc R . .
C64 C 1.0940(5) 0.3089(5) 0.7470(3) 0.0369(16) Uani 1 1 d . . .
H64 H 1.1326 0.3373 0.7807 0.044 Uiso 1 1 calc R . .
C65 C 1.0792(5) 0.3661(5) 0.6933(3) 0.0301(14) Uani 1 1 d . . .
C66 C 1.0210(5) 0.3223(5) 0.6450(3) 0.0352(14) Uani 1 1 d . . .
H66 H 1.0094 0.3596 0.6077 0.042 Uiso 1 1 calc R . .
C67 C 0.9800(5) 0.2249(5) 0.6509(3) 0.0322(14) Uani 1 1 d . . .
H67 H 0.9397 0.1970 0.6177 0.039 Uiso 1 1 calc R . .
C68 C 1.1254(6) 0.4709(5) 0.6868(4) 0.0473(18) Uani 1 1 d . . .
H68 H 1.0885 0.5185 0.7139 0.071 Uiso 1 1 calc R . .
H68A H 1.1182 0.4935 0.6436 0.071 Uiso 1 1 calc R . .
H68B H 1.1995 0.4690 0.6986 0.071 Uiso 1 1 calc R . .
C69 C 0.8217(5) -0.3359(4) 0.5413(3) 0.0318(15) Uani 1 1 d . . .
C70 C 0.7939(5) -0.3395(5) 0.6044(3) 0.0307(15) Uani 1 1 d . . .
C71 C 0.6870(5) -0.3091(5) 0.6093(3) 0.0286(14) Uani 1 1 d . . .
C72 C 0.6492(5) -0.2850(4) 0.5495(3) 0.0269(13) Uani 1 1 d . . .
C73 C 0.7337(5) -0.2998(4) 0.5071(3) 0.0287(14) Uani 1 1 d . . .
C74 C 0.9242(6) -0.3663(6) 0.5146(4) 0.055(2) Uani 1 1 d . . .
H74 H 0.9159 -0.4303 0.4915 0.082 Uiso 1 1 calc R . .
H74A H 0.9755 -0.3760 0.5482 0.082 Uiso 1 1 calc R . .
H74B H 0.9485 -0.3127 0.4866 0.082 Uiso 1 1 calc R . .
C75 C 0.8632(6) -0.3725(6) 0.6570(4) 0.049(2) Uani 1 1 d . . .
H75 H 0.8495 -0.3302 0.6935 0.073 Uiso 1 1 calc R . .
H75A H 0.9364 -0.3648 0.6451 0.073 Uiso 1 1 calc R . .
H75B H 0.8492 -0.4442 0.6669 0.073 Uiso 1 1 calc R . .
C76 C 0.6264(6) -0.3090(5) 0.6691(3) 0.0384(16) Uani 1 1 d . . .
H76 H 0.5564 -0.2812 0.6613 0.058 Uiso 1 1 calc R . .
H76A H 0.6628 -0.2668 0.6999 0.058 Uiso 1 1 calc R . .
H76B H 0.6206 -0.3790 0.6847 0.058 Uiso 1 1 calc R . .
C77 C 0.5382(5) -0.2570(5) 0.5322(3) 0.0334(14) Uani 1 1 d . . .
H77 H 0.4963 -0.3192 0.5282 0.050 Uiso 1 1 calc R . .
H77A H 0.5374 -0.2201 0.4927 0.050 Uiso 1 1 calc R . .
H77B H 0.5089 -0.2134 0.5646 0.050 Uiso 1 1 calc R . .
C78 C 0.7249(6) -0.2956(6) 0.4376(3) 0.0410(17) Uani 1 1 d . . .
H78 H 0.7907 -0.2710 0.4204 0.061 Uiso 1 1 calc R . .
H78A H 0.6682 -0.2491 0.4255 0.061 Uiso 1 1 calc R . .
H78B H 0.7098 -0.3640 0.4214 0.061 Uiso 1 1 calc R . .


_geom_special_details            
; 
 All esds (except the esd in the dihedral angle between two l.s. planes) 
 are estimated using the full covariance matrix.  The cell esds are taken 
 into account individually in the estimation of esds in distances, angles 
 and torsion angles; correlations between esds in cell parameters are only 
 used when they are defined by crystal symmetry.  An approximate (isotropic) 
 treatment of cell esds is used for estimating esds involving l.s. planes. 
;

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
Mo1 C2 1.934(6) . ?
Mo1 C1 1.955(7) . ?
Mo1 O3 2.186(4) . ?
Mo1 C30 2.303(6) . ?
Mo1 C34 2.303(6) . ?
Mo1 C31 2.336(6) . ?
Mo1 C4 2.343(6) . ?
Mo1 C33 2.390(6) . ?
Mo1 C3 2.396(5) . ?
Mo1 C32 2.419(6) . ?
Mo2 C40 1.962(7) . ?
Mo2 C41 1.963(6) . ?
Mo2 O7 2.185(4) . ?
Mo2 C73 2.302(6) . ?
Mo2 C72 2.339(6) . ?
Mo2 C69 2.356(6) . ?
Mo2 C70 2.362(6) . ?
Mo2 C71 2.366(6) . ?
Mo2 C43 2.370(6) . ?
Mo2 C42 2.402(5) . ?
Si1 O4 1.690(4) . ?
Si1 C9 1.857(6) . ?
Si1 C23 1.862(6) . ?
Si1 C16 1.864(6) . ?
Si2 O8 1.687(4) . ?
Si2 C62 1.862(6) . ?
Si2 C55 1.864(6) . ?
Si2 C48 1.878(6) . ?
O1 C1 1.152(8) . ?
O2 C2 1.163(8) . ?
O3 C3 1.284(7) . ?
O4 C3 1.355(7) . ?
O5 C40 1.145(8) . ?
O6 C41 1.136(7) . ?
O7 C42 1.278(7) . ?
O8 C42 1.333(7) . ?
C3 C4 1.403(9) . ?
C4 C5 1.543(9) . ?
C4 H79 1.0000 . ?
C5 C7 1.512(10) . ?
C5 C8 1.514(11) . ?
C5 C6 1.556(9) . ?
C6 H6 0.9800 . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C7 H7 0.9800 . ?
C7 H7A 0.9800 . ?
C7 H7B 0.9800 . ?
C8 H8 0.9800 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C9 C10 1.403(8) . ?
C9 C14 1.409(8) . ?
C10 C11 1.368(9) . ?
C10 H10 0.9500 . ?
C11 C12 1.397(9) . ?
C11 H11 0.9500 . ?
C12 C13 1.381(9) . ?
C12 C15 1.508(9) . ?
C13 C14 1.378(9) . ?
C13 H13 0.9500 . ?
C14 H14 0.9500 . ?
C15 H15 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C16 C21 1.397(8) . ?
C16 C17 1.402(8) . ?
C17 C18 1.378(9) . ?
C17 H17 0.9500 . ?
C18 C19 1.379(9) . ?
C18 H18 0.9500 . ?
C19 C20 1.380(9) . ?
C19 C22 1.527(8) . ?
C20 C21 1.372(9) . ?
C20 H20 0.9500 . ?
C21 H21 0.9500 . ?
C22 H22 0.9800 . ?
C22 H22A 0.9800 . ?
C22 H22B 0.9800 . ?
C23 C24 1.383(8) . ?
C23 C28 1.415(8) . ?
C24 C25 1.400(9) . ?
C24 H24 0.9500 . ?
C25 C26 1.387(9) . ?
C25 H25 0.9500 . ?
C26 C27 1.369(9) . ?
C26 C29 1.524(9) . ?
C27 C28 1.375(9) . ?
C27 H27 0.9500 . ?
C28 H28 0.9500 . ?
C29 H29 0.9800 . ?
C29 H29A 0.9800 . ?
C29 H29B 0.9800 . ?
C30 C34 1.416(10) . ?
C30 C31 1.416(9) . ?
C30 C35 1.512(9) . ?
C31 C32 1.432(8) . ?
C31 C36 1.500(8) . ?
C32 C33 1.449(10) . ?
C32 C37 1.488(9) . ?
C33 C34 1.434(10) . ?
C33 C38 1.500(10) . ?
C34 C39 1.515(10) . ?
C35 H35 0.9800 . ?
C35 H35A 0.9800 . ?
C35 H35B 0.9800 . ?
C36 H36 0.9800 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C37 H37 0.9800 . ?
C37 H37A 0.9800 . ?
C37 H37B 0.9800 . ?
C38 H38 0.9800 . ?
C38 H38A 0.9800 . ?
C38 H38B 0.9800 . ?
C39 H39 0.9800 . ?
C39 H39A 0.9800 . ?
C39 H39B 0.9800 . ?
C42 C43 1.420(8) . ?
C43 C44 1.530(8) . ?
C43 H43 1.0000 . ?
C44 C47 1.519(9) . ?
C44 C45 1.524(9) . ?
C44 C46 1.543(9) . ?
C45 H45 0.9800 . ?
C45 H45A 0.9800 . ?
C45 H45B 0.9800 . ?
C46 H46 0.9800 . ?
C46 H46A 0.9800 . ?
C46 H46B 0.9800 . ?
C47 H47 0.9800 . ?
C47 H47A 0.9800 . ?
C47 H47B 0.9800 . ?
C48 C49 1.383(9) . ?
C48 C53 1.390(8) . ?
C49 C50 1.371(8) . ?
C49 H49 0.9500 . ?
C50 C51 1.375(9) . ?
C50 H50 0.9500 . ?
C51 C52 1.392(10) . ?
C51 C54 1.512(9) . ?
C52 C53 1.389(8) . ?
C52 H52 0.9500 . ?
C53 H53 0.9500 . ?
C54 H54 0.9800 . ?
C54 H54A 0.9800 . ?
C54 H54B 0.9800 . ?
C55 C56 1.387(8) . ?
C55 C60 1.406(8) . ?
C56 C57 1.363(8) . ?
C56 H56 0.9500 . ?
C57 C58 1.378(9) . ?
C57 H57 0.9500 . ?
C58 C59 1.394(9) . ?
C58 C61 1.513(8) . ?
C59 C60 1.379(8) . ?
C59 H59 0.9500 . ?
C60 H60 0.9500 . ?
C61 H61 0.9800 . ?
C61 H61A 0.9800 . ?
C61 H61B 0.9800 . ?
C62 C67 1.392(8) . ?
C62 C63 1.395(8) . ?
C63 C64 1.371(9) . ?
C63 H63 0.9500 . ?
C64 C65 1.390(9) . ?
C64 H64 0.9500 . ?
C65 C66 1.398(9) . ?
C65 C68 1.501(9) . ?
C66 C67 1.387(9) . ?
C66 H66 0.9500 . ?
C67 H67 0.9500 . ?
C68 H68 0.9800 . ?
C68 H68A 0.9800 . ?
C68 H68B 0.9800 . ?
C69 C70 1.412(10) . ?
C69 C73 1.419(9) . ?
C69 C74 1.494(9) . ?
C70 C71 1.431(9) . ?
C70 C75 1.496(10) . ?
C71 C72 1.408(9) . ?
C71 C76 1.512(9) . ?
C72 C73 1.438(8) . ?
C72 C77 1.510(9) . ?
C73 C78 1.503(9) . ?
C74 H74 0.9800 . ?
C74 H74A 0.9800 . ?
C74 H74B 0.9800 . ?
C75 H75 0.9800 . ?
C75 H75A 0.9800 . ?
C75 H75B 0.9800 . ?
C76 H76 0.9800 . ?
C76 H76A 0.9800 . ?
C76 H76B 0.9800 . ?
C77 H77 0.9800 . ?
C77 H77A 0.9800 . ?
C77 H77B 0.9800 . ?
C78 H78 0.9800 . ?
C78 H78A 0.9800 . ?
C78 H78B 0.9800 . ?

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
C2 Mo1 C1 74.9(3) . . ?
C2 Mo1 O3 130.4(2) . . ?
C1 Mo1 O3 88.6(2) . . ?
C2 Mo1 C30 101.1(3) . . ?
C1 Mo1 C30 88.8(2) . . ?
O3 Mo1 C30 125.4(2) . . ?
C2 Mo1 C34 136.9(3) . . ?
C1 Mo1 C34 96.8(3) . . ?
O3 Mo1 C34 90.6(2) . . ?
C30 Mo1 C34 35.8(2) . . ?
C2 Mo1 C31 85.7(3) . . ?
C1 Mo1 C31 115.5(2) . . ?
O3 Mo1 C31 142.13(18) . . ?
C30 Mo1 C31 35.5(2) . . ?
C34 Mo1 C31 59.3(2) . . ?
C2 Mo1 C4 87.4(3) . . ?
C1 Mo1 C4 120.7(2) . . ?
O3 Mo1 C4 61.26(18) . . ?
C30 Mo1 C4 150.5(2) . . ?
C34 Mo1 C4 130.0(3) . . ?
C31 Mo1 C4 119.0(2) . . ?
C2 Mo1 C33 141.3(3) . . ?
C1 Mo1 C33 131.2(3) . . ?
O3 Mo1 C33 83.67(19) . . ?
C30 Mo1 C33 58.8(2) . . ?
C34 Mo1 C33 35.5(3) . . ?
C31 Mo1 C33 58.5(2) . . ?
C4 Mo1 C33 97.2(2) . . ?
C2 Mo1 C3 101.7(2) . . ?
C1 Mo1 C3 94.2(2) . . ?
O3 Mo1 C3 32.14(17) . . ?
C30 Mo1 C3 157.0(2) . . ?
C34 Mo1 C3 121.2(2) . . ?
C31 Mo1 C3 150.3(2) . . ?
C4 Mo1 C3 34.4(2) . . ?
C33 Mo1 C3 103.5(2) . . ?
C2 Mo1 C32 106.7(3) . . ?
C1 Mo1 C32 147.5(2) . . ?
O3 Mo1 C32 111.35(19) . . ?
C30 Mo1 C32 58.8(2) . . ?
C34 Mo1 C32 59.1(2) . . ?
C31 Mo1 C32 35.0(2) . . ?
C4 Mo1 C32 91.8(2) . . ?
C33 Mo1 C32 35.1(2) . . ?
C3 Mo1 C32 116.5(2) . . ?
C40 Mo2 C41 76.2(3) . . ?
C40 Mo2 O7 134.5(2) . . ?
C41 Mo2 O7 90.6(2) . . ?
C40 Mo2 C73 83.9(3) . . ?
C41 Mo2 C73 105.5(2) . . ?
O7 Mo2 C73 141.35(19) . . ?
C40 Mo2 C72 94.6(3) . . ?
C41 Mo2 C72 141.6(2) . . ?
O7 Mo2 C72 119.75(19) . . ?
C73 Mo2 C72 36.1(2) . . ?
C40 Mo2 C69 110.2(3) . . ?
C41 Mo2 C69 88.7(2) . . ?
O7 Mo2 C69 112.8(2) . . ?
C73 Mo2 C69 35.5(2) . . ?
C72 Mo2 C69 59.2(2) . . ?
C40 Mo2 C70 142.3(3) . . ?
C41 Mo2 C70 107.5(2) . . ?
O7 Mo2 C70 83.2(2) . . ?
C73 Mo2 C70 58.7(2) . . ?
C72 Mo2 C70 58.6(2) . . ?
C69 Mo2 C70 34.8(2) . . ?
C40 Mo2 C71 128.9(3) . . ?
C41 Mo2 C71 142.6(2) . . ?
O7 Mo2 C71 87.06(18) . . ?
C73 Mo2 C71 58.8(2) . . ?
C72 Mo2 C71 34.8(2) . . ?
C69 Mo2 C71 58.5(2) . . ?
C70 Mo2 C71 35.2(2) . . ?
C40 Mo2 C43 86.3(2) . . ?
C41 Mo2 C43 117.2(2) . . ?
O7 Mo2 C43 61.23(17) . . ?
C73 Mo2 C43 132.3(2) . . ?
C72 Mo2 C43 98.9(2) . . ?
C69 Mo2 C43 152.5(2) . . ?
C70 Mo2 C43 121.2(2) . . ?
C71 Mo2 C43 94.0(2) . . ?
C40 Mo2 C42 104.4(3) . . ?
C41 Mo2 C42 92.9(2) . . ?
O7 Mo2 C42 31.90(17) . . ?
C73 Mo2 C42 161.3(2) . . ?
C72 Mo2 C42 125.5(2) . . ?
C69 Mo2 C42 144.6(2) . . ?
C70 Mo2 C42 112.7(2) . . ?
C71 Mo2 C42 104.0(2) . . ?
C43 Mo2 C42 34.6(2) . . ?
O4 Si1 C9 115.8(2) . . ?
O4 Si1 C23 101.8(2) . . ?
C9 Si1 C23 110.1(3) . . ?
O4 Si1 C16 107.0(2) . . ?
C9 Si1 C16 111.5(3) . . ?
C23 Si1 C16 110.2(3) . . ?
O8 Si2 C62 102.1(2) . . ?
O8 Si2 C55 107.4(2) . . ?
C62 Si2 C55 111.7(3) . . ?
O8 Si2 C48 115.0(2) . . ?
C62 Si2 C48 110.2(3) . . ?
C55 Si2 C48 110.1(3) . . ?
C3 O3 Mo1 83.0(3) . . ?
C3 O4 Si1 122.8(4) . . ?
C42 O7 Mo2 83.4(3) . . ?
C42 O8 Si2 121.6(4) . . ?
O1 C1 Mo1 173.0(6) . . ?
O2 C2 Mo1 175.5(7) . . ?
O3 C3 O4 117.7(5) . . ?
O3 C3 C4 118.6(5) . . ?
O4 C3 C4 123.5(5) . . ?
O3 C3 Mo1 64.9(3) . . ?
O4 C3 Mo1 132.5(4) . . ?
C4 C3 Mo1 70.7(3) . . ?
C3 C4 C5 123.7(6) . . ?
C3 C4 Mo1 74.8(3) . . ?
C5 C4 Mo1 136.7(4) . . ?
C3 C4 H79 105.5 . . ?
C5 C4 H79 105.5 . . ?
Mo1 C4 H79 105.5 . . ?
C7 C5 C8 110.0(6) . . ?
C7 C5 C4 114.7(5) . . ?
C8 C5 C4 108.2(6) . . ?
C7 C5 C6 108.3(6) . . ?
C8 C5 C6 109.0(7) . . ?
C4 C5 C6 106.5(6) . . ?
C5 C6 H6 109.5 . . ?
C5 C6 H6A 109.5 . . ?
H6 C6 H6A 109.5 . . ?
C5 C6 H6B 109.5 . . ?
H6 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
C5 C7 H7 109.5 . . ?
C5 C7 H7A 109.5 . . ?
H7 C7 H7A 109.5 . . ?
C5 C7 H7B 109.5 . . ?
H7 C7 H7B 109.5 . . ?
H7A C7 H7B 109.5 . . ?
C5 C8 H8 109.5 . . ?
C5 C8 H8A 109.5 . . ?
H8 C8 H8A 109.5 . . ?
C5 C8 H8B 109.5 . . ?
H8 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C10 C9 C14 116.6(5) . . ?
C10 C9 Si1 122.5(4) . . ?
C14 C9 Si1 120.8(4) . . ?
C11 C10 C9 121.7(5) . . ?
C11 C10 H10 119.2 . . ?
C9 C10 H10 119.2 . . ?
C10 C11 C12 121.2(5) . . ?
C10 C11 H11 119.4 . . ?
C12 C11 H11 119.4 . . ?
C13 C12 C11 117.8(5) . . ?
C13 C12 C15 121.4(6) . . ?
C11 C12 C15 120.8(6) . . ?
C14 C13 C12 121.6(6) . . ?
C14 C13 H13 119.2 . . ?
C12 C13 H13 119.2 . . ?
C13 C14 C9 121.1(5) . . ?
C13 C14 H14 119.5 . . ?
C9 C14 H14 119.5 . . ?
C12 C15 H15 109.5 . . ?
C12 C15 H15A 109.5 . . ?
H15 C15 H15A 109.5 . . ?
C12 C15 H15B 109.5 . . ?
H15 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C21 C16 C17 117.2(5) . . ?
C21 C16 Si1 121.0(5) . . ?
C17 C16 Si1 121.4(4) . . ?
C18 C17 C16 121.2(6) . . ?
C18 C17 H17 119.4 . . ?
C16 C17 H17 119.4 . . ?
C17 C18 C19 120.6(6) . . ?
C17 C18 H18 119.7 . . ?
C19 C18 H18 119.7 . . ?
C18 C19 C20 118.8(6) . . ?
C18 C19 C22 119.4(6) . . ?
C20 C19 C22 121.8(6) . . ?
C21 C20 C19 121.2(6) . . ?
C21 C20 H20 119.4 . . ?
C19 C20 H20 119.4 . . ?
C20 C21 C16 120.9(6) . . ?
C20 C21 H21 119.5 . . ?
C16 C21 H21 119.5 . . ?
C19 C22 H22 109.5 . . ?
C19 C22 H22A 109.5 . . ?
H22 C22 H22A 109.5 . . ?
C19 C22 H22B 109.5 . . ?
H22 C22 H22B 109.5 . . ?
H22A C22 H22B 109.5 . . ?
C24 C23 C28 117.6(5) . . ?
C24 C23 Si1 123.0(4) . . ?
C28 C23 Si1 119.2(5) . . ?
C23 C24 C25 121.0(5) . . ?
C23 C24 H24 119.5 . . ?
C25 C24 H24 119.5 . . ?
C26 C25 C24 120.6(6) . . ?
C26 C25 H25 119.7 . . ?
C24 C25 H25 119.7 . . ?
C27 C26 C25 118.4(6) . . ?
C27 C26 C29 122.3(6) . . ?
C25 C26 C29 119.4(6) . . ?
C26 C27 C28 122.2(6) . . ?
C26 C27 H27 118.9 . . ?
C28 C27 H27 118.9 . . ?
C27 C28 C23 120.3(6) . . ?
C27 C28 H28 119.9 . . ?
C23 C28 H28 119.9 . . ?
C26 C29 H29 109.5 . . ?
C26 C29 H29A 109.5 . . ?
H29 C29 H29A 109.5 . . ?
C26 C29 H29B 109.5 . . ?
H29 C29 H29B 109.5 . . ?
H29A C29 H29B 109.5 . . ?
C34 C30 C31 108.4(6) . . ?
C34 C30 C35 125.4(6) . . ?
C31 C30 C35 125.9(6) . . ?
C34 C30 Mo1 72.1(4) . . ?
C31 C30 Mo1 73.5(3) . . ?
C35 C30 Mo1 124.4(4) . . ?
C30 C31 C32 109.0(5) . . ?
C30 C31 C36 126.0(6) . . ?
C32 C31 C36 124.4(6) . . ?
C30 C31 Mo1 70.9(3) . . ?
C32 C31 Mo1 75.7(3) . . ?
C36 C31 Mo1 126.8(4) . . ?
C31 C32 C33 106.5(5) . . ?
C31 C32 C37 126.9(6) . . ?
C33 C32 C37 126.2(6) . . ?
C31 C32 Mo1 69.4(3) . . ?
C33 C32 Mo1 71.4(3) . . ?
C37 C32 Mo1 129.8(4) . . ?
C34 C33 C32 107.9(6) . . ?
C34 C33 C38 126.6(7) . . ?
C32 C33 C38 125.5(7) . . ?
C34 C33 Mo1 68.9(4) . . ?
C32 C33 Mo1 73.5(3) . . ?
C38 C33 Mo1 124.4(5) . . ?
C30 C34 C33 108.1(6) . . ?
C30 C34 C39 127.4(7) . . ?
C33 C34 C39 124.4(7) . . ?
C30 C34 Mo1 72.1(4) . . ?
C33 C34 Mo1 75.6(4) . . ?
C39 C34 Mo1 121.7(5) . . ?
C30 C35 H35 109.5 . . ?
C30 C35 H35A 109.5 . . ?
H35 C35 H35A 109.5 . . ?
C30 C35 H35B 109.5 . . ?
H35 C35 H35B 109.5 . . ?
H35A C35 H35B 109.5 . . ?
C31 C36 H36 109.5 . . ?
C31 C36 H36A 109.5 . . ?
H36 C36 H36A 109.5 . . ?
C31 C36 H36B 109.5 . . ?
H36 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
C32 C37 H37 109.5 . . ?
C32 C37 H37A 109.5 . . ?
H37 C37 H37A 109.5 . . ?
C32 C37 H37B 109.5 . . ?
H37 C37 H37B 109.5 . . ?
H37A C37 H37B 109.5 . . ?
C33 C38 H38 109.5 . . ?
C33 C38 H38A 109.5 . . ?
H38 C38 H38A 109.5 . . ?
C33 C38 H38B 109.5 . . ?
H38 C38 H38B 109.5 . . ?
H38A C38 H38B 109.5 . . ?
C34 C39 H39 109.5 . . ?
C34 C39 H39A 109.5 . . ?
H39 C39 H39A 109.5 . . ?
C34 C39 H39B 109.5 . . ?
H39 C39 H39B 109.5 . . ?
H39A C39 H39B 109.5 . . ?
O5 C40 Mo2 174.9(7) . . ?
O6 C41 Mo2 171.5(5) . . ?
O7 C42 O8 119.0(5) . . ?
O7 C42 C43 119.0(5) . . ?
O8 C42 C43 121.7(5) . . ?
O7 C42 Mo2 64.7(3) . . ?
O8 C42 Mo2 131.4(4) . . ?
C43 C42 Mo2 71.5(3) . . ?
C42 C43 C44 124.8(5) . . ?
C42 C43 Mo2 73.9(3) . . ?
C44 C43 Mo2 134.8(4) . . ?
C42 C43 H43 106.1 . . ?
C44 C43 H43 106.1 . . ?
Mo2 C43 H43 106.1 . . ?
C47 C44 C45 110.6(5) . . ?
C47 C44 C43 107.9(5) . . ?
C45 C44 C43 114.4(5) . . ?
C47 C44 C46 108.5(6) . . ?
C45 C44 C46 107.8(5) . . ?
C43 C44 C46 107.6(5) . . ?
C44 C45 H45 109.5 . . ?
C44 C45 H45A 109.5 . . ?
H45 C45 H45A 109.5 . . ?
C44 C45 H45B 109.5 . . ?
H45 C45 H45B 109.5 . . ?
H45A C45 H45B 109.5 . . ?
C44 C46 H46 109.5 . . ?
C44 C46 H46A 109.5 . . ?
H46 C46 H46A 109.5 . . ?
C44 C46 H46B 109.5 . . ?
H46 C46 H46B 109.5 . . ?
H46A C46 H46B 109.5 . . ?
C44 C47 H47 109.5 . . ?
C44 C47 H47A 109.5 . . ?
H47 C47 H47A 109.5 . . ?
C44 C47 H47B 109.5 . . ?
H47 C47 H47B 109.5 . . ?
H47A C47 H47B 109.5 . . ?
C49 C48 C53 117.9(5) . . ?
C49 C48 Si2 122.0(4) . . ?
C53 C48 Si2 120.1(5) . . ?
C50 C49 C48 121.8(5) . . ?
C50 C49 H49 119.1 . . ?
C48 C49 H49 119.1 . . ?
C49 C50 C51 121.0(6) . . ?
C49 C50 H50 119.5 . . ?
C51 C50 H50 119.5 . . ?
C50 C51 C52 118.0(5) . . ?
C50 C51 C54 121.0(6) . . ?
C52 C51 C54 121.1(6) . . ?
C53 C52 C51 121.2(5) . . ?
C53 C52 H52 119.4 . . ?
C51 C52 H52 119.4 . . ?
C52 C53 C48 120.1(6) . . ?
C52 C53 H53 119.9 . . ?
C48 C53 H53 119.9 . . ?
C51 C54 H54 109.5 . . ?
C51 C54 H54A 109.5 . . ?
H54 C54 H54A 109.5 . . ?
C51 C54 H54B 109.5 . . ?
H54 C54 H54B 109.5 . . ?
H54A C54 H54B 109.5 . . ?
C56 C55 C60 117.0(5) . . ?
C56 C55 Si2 122.2(4) . . ?
C60 C55 Si2 120.6(4) . . ?
C57 C56 C55 122.0(6) . . ?
C57 C56 H56 119.0 . . ?
C55 C56 H56 119.0 . . ?
C56 C57 C58 121.3(5) . . ?
C56 C57 H57 119.3 . . ?
C58 C57 H57 119.3 . . ?
C57 C58 C59 118.0(5) . . ?
C57 C58 C61 121.8(6) . . ?
C59 C58 C61 120.2(6) . . ?
C60 C59 C58 120.9(6) . . ?
C60 C59 H59 119.6 . . ?
C58 C59 H59 119.6 . . ?
C59 C60 C55 120.8(5) . . ?
C59 C60 H60 119.6 . . ?
C55 C60 H60 119.6 . . ?
C58 C61 H61 109.5 . . ?
C58 C61 H61A 109.5 . . ?
H61 C61 H61A 109.5 . . ?
C58 C61 H61B 109.5 . . ?
H61 C61 H61B 109.5 . . ?
H61A C61 H61B 109.5 . . ?
C67 C62 C63 117.1(5) . . ?
C67 C62 Si2 122.5(4) . . ?
C63 C62 Si2 120.4(4) . . ?
C64 C63 C62 121.7(6) . . ?
C64 C63 H63 119.2 . . ?
C62 C63 H63 119.2 . . ?
C63 C64 C65 121.4(6) . . ?
C63 C64 H64 119.3 . . ?
C65 C64 H64 119.3 . . ?
C64 C65 C66 117.7(6) . . ?
C64 C65 C68 121.5(6) . . ?
C66 C65 C68 120.8(6) . . ?
C67 C66 C65 120.6(6) . . ?
C67 C66 H66 119.7 . . ?
C65 C66 H66 119.7 . . ?
C66 C67 C62 121.5(6) . . ?
C66 C67 H67 119.2 . . ?
C62 C67 H67 119.2 . . ?
C65 C68 H68 109.5 . . ?
C65 C68 H68A 109.5 . . ?
H68 C68 H68A 109.5 . . ?
C65 C68 H68B 109.5 . . ?
H68 C68 H68B 109.5 . . ?
H68A C68 H68B 109.5 . . ?
C70 C69 C73 107.6(5) . . ?
C70 C69 C74 126.6(7) . . ?
C73 C69 C74 125.8(7) . . ?
C70 C69 Mo2 72.8(3) . . ?
C73 C69 Mo2 70.2(3) . . ?
C74 C69 Mo2 123.4(4) . . ?
C69 C70 C71 108.4(6) . . ?
C69 C70 C75 125.8(6) . . ?
C71 C70 C75 125.7(7) . . ?
C69 C70 Mo2 72.3(4) . . ?
C71 C70 Mo2 72.6(4) . . ?
C75 C70 Mo2 122.4(4) . . ?
C72 C71 C70 108.2(6) . . ?
C72 C71 C76 127.3(6) . . ?
C70 C71 C76 124.4(6) . . ?
C72 C71 Mo2 71.6(3) . . ?
C70 C71 Mo2 72.2(4) . . ?
C76 C71 Mo2 124.3(4) . . ?
C71 C72 C73 107.4(6) . . ?
C71 C72 C77 126.3(6) . . ?
C73 C72 C77 126.2(6) . . ?
C71 C72 Mo2 73.6(3) . . ?
C73 C72 Mo2 70.5(3) . . ?
C77 C72 Mo2 124.9(4) . . ?
C69 C73 C72 108.4(6) . . ?
C69 C73 C78 125.4(6) . . ?
C72 C73 C78 125.5(6) . . ?
C69 C73 Mo2 74.3(3) . . ?
C72 C73 Mo2 73.4(3) . . ?
C78 C73 Mo2 126.4(4) . . ?
C69 C74 H74 109.5 . . ?
C69 C74 H74A 109.5 . . ?
H74 C74 H74A 109.5 . . ?
C69 C74 H74B 109.5 . . ?
H74 C74 H74B 109.5 . . ?
H74A C74 H74B 109.5 . . ?
C70 C75 H75 109.5 . . ?
C70 C75 H75A 109.5 . . ?
H75 C75 H75A 109.5 . . ?
C70 C75 H75B 109.5 . . ?
H75 C75 H75B 109.5 . . ?
H75A C75 H75B 109.5 . . ?
C71 C76 H76 109.5 . . ?
C71 C76 H76A 109.5 . . ?
H76 C76 H76A 109.5 . . ?
C71 C76 H76B 109.5 . . ?
H76 C76 H76B 109.5 . . ?
H76A C76 H76B 109.5 . . ?
C72 C77 H77 109.5 . . ?
C72 C77 H77A 109.5 . . ?
H77 C77 H77A 109.5 . . ?
C72 C77 H77B 109.5 . . ?
H77 C77 H77B 109.5 . . ?
H77A C77 H77B 109.5 . . ?
C73 C78 H78 109.5 . . ?
C73 C78 H78A 109.5 . . ?
H78 C78 H78A 109.5 . . ?
C73 C78 H78B 109.5 . . ?
H78 C78 H78B 109.5 . . ?
H78A C78 H78B 109.5 . . ?

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
C2 Mo1 O3 C3 -31.4(5) . . . . ?
C1 Mo1 O3 C3 -100.1(4) . . . . ?
C30 Mo1 O3 C3 172.3(3) . . . . ?
C34 Mo1 O3 C3 163.1(4) . . . . ?
C31 Mo1 O3 C3 127.7(4) . . . . ?
C4 Mo1 O3 C3 26.4(3) . . . . ?
C33 Mo1 O3 C3 128.2(4) . . . . ?
C32 Mo1 O3 C3 106.2(3) . . . . ?
C9 Si1 O4 C3 -61.2(5) . . . . ?
C23 Si1 O4 C3 179.4(4) . . . . ?
C16 Si1 O4 C3 63.7(5) . . . . ?
C40 Mo2 O7 C42 23.5(5) . . . . ?
C41 Mo2 O7 C42 94.5(4) . . . . ?
C73 Mo2 O7 C42 -149.4(4) . . . . ?
C72 Mo2 O7 C42 -110.3(4) . . . . ?
C69 Mo2 O7 C42 -176.7(3) . . . . ?
C70 Mo2 O7 C42 -157.9(4) . . . . ?
C71 Mo2 O7 C42 -122.8(4) . . . . ?
C43 Mo2 O7 C42 -26.6(3) . . . . ?
C62 Si2 O8 C42 176.2(4) . . . . ?
C55 Si2 O8 C42 -66.2(5) . . . . ?
C48 Si2 O8 C42 56.8(5) . . . . ?
Mo1 O3 C3 O4 126.6(4) . . . . ?
Mo1 O3 C3 C4 -47.9(5) . . . . ?
Si1 O4 C3 O3 16.0(7) . . . . ?
Si1 O4 C3 C4 -169.8(4) . . . . ?
Si1 O4 C3 Mo1 96.3(5) . . . . ?
C2 Mo1 C3 O3 156.1(4) . . . . ?
C1 Mo1 C3 O3 80.7(4) . . . . ?
C30 Mo1 C3 O3 -16.2(7) . . . . ?
C34 Mo1 C3 O3 -19.9(4) . . . . ?
C31 Mo1 C3 O3 -101.8(5) . . . . ?
C4 Mo1 C3 O3 -136.4(5) . . . . ?
C33 Mo1 C3 O3 -53.5(4) . . . . ?
C32 Mo1 C3 O3 -88.3(4) . . . . ?
C2 Mo1 C3 O4 50.7(6) . . . . ?
C1 Mo1 C3 O4 -24.8(5) . . . . ?
O3 Mo1 C3 O4 -105.4(6) . . . . ?
C30 Mo1 C3 O4 -121.6(6) . . . . ?
C34 Mo1 C3 O4 -125.3(5) . . . . ?
C31 Mo1 C3 O4 152.7(5) . . . . ?
C4 Mo1 C3 O4 118.2(7) . . . . ?
C33 Mo1 C3 O4 -158.9(5) . . . . ?
C32 Mo1 C3 O4 166.3(5) . . . . ?
C2 Mo1 C3 C4 -67.5(4) . . . . ?
C1 Mo1 C3 C4 -142.9(4) . . . . ?
O3 Mo1 C3 C4 136.4(5) . . . . ?
C30 Mo1 C3 C4 120.2(6) . . . . ?
C34 Mo1 C3 C4 116.5(4) . . . . ?
C31 Mo1 C3 C4 34.6(6) . . . . ?
C33 Mo1 C3 C4 82.9(4) . . . . ?
C32 Mo1 C3 C4 48.1(4) . . . . ?
O3 C3 C4 C5 -178.2(5) . . . . ?
O4 C3 C4 C5 7.7(9) . . . . ?
Mo1 C3 C4 C5 136.5(6) . . . . ?
O3 C3 C4 Mo1 45.3(5) . . . . ?
O4 C3 C4 Mo1 -128.8(5) . . . . ?
C2 Mo1 C4 C3 115.1(4) . . . . ?
C1 Mo1 C4 C3 44.4(4) . . . . ?
O3 Mo1 C4 C3 -24.7(3) . . . . ?
C30 Mo1 C4 C3 -136.6(4) . . . . ?
C34 Mo1 C4 C3 -88.4(4) . . . . ?
C31 Mo1 C4 C3 -161.2(3) . . . . ?
C33 Mo1 C4 C3 -103.4(4) . . . . ?
C32 Mo1 C4 C3 -138.2(4) . . . . ?
C2 Mo1 C4 C5 -8.3(7) . . . . ?
C1 Mo1 C4 C5 -79.1(7) . . . . ?
O3 Mo1 C4 C5 -148.2(7) . . . . ?
C30 Mo1 C4 C5 99.9(7) . . . . ?
C34 Mo1 C4 C5 148.2(6) . . . . ?
C31 Mo1 C4 C5 75.3(7) . . . . ?
C33 Mo1 C4 C5 133.1(7) . . . . ?
C3 Mo1 C4 C5 -123.5(8) . . . . ?
C32 Mo1 C4 C5 98.3(6) . . . . ?
C3 C4 C5 C7 -53.4(8) . . . . ?
Mo1 C4 C5 C7 51.1(8) . . . . ?
C3 C4 C5 C8 69.8(8) . . . . ?
Mo1 C4 C5 C8 174.3(6) . . . . ?
C3 C4 C5 C6 -173.1(7) . . . . ?
Mo1 C4 C5 C6 -68.7(9) . . . . ?
O4 Si1 C9 C10 -91.2(5) . . . . ?
C23 Si1 C9 C10 23.6(5) . . . . ?
C16 Si1 C9 C10 146.2(5) . . . . ?
O4 Si1 C9 C14 88.5(5) . . . . ?
C23 Si1 C9 C14 -156.8(5) . . . . ?
C16 Si1 C9 C14 -34.1(5) . . . . ?
C14 C9 C10 C11 -1.4(8) . . . . ?
Si1 C9 C10 C11 178.3(5) . . . . ?
C9 C10 C11 C12 -0.4(9) . . . . ?
C10 C11 C12 C13 2.3(10) . . . . ?
C10 C11 C12 C15 -177.7(6) . . . . ?
C11 C12 C13 C14 -2.2(10) . . . . ?
C15 C12 C13 C14 177.7(7) . . . . ?
C12 C13 C14 C9 0.4(10) . . . . ?
C10 C9 C14 C13 1.4(9) . . . . ?
Si1 C9 C14 C13 -178.3(5) . . . . ?
O4 Si1 C16 C21 -167.7(5) . . . . ?
C9 Si1 C16 C21 -40.2(5) . . . . ?
C23 Si1 C16 C21 82.4(5) . . . . ?
O4 Si1 C16 C17 19.4(5) . . . . ?
C9 Si1 C16 C17 146.9(5) . . . . ?
C23 Si1 C16 C17 -90.5(5) . . . . ?
C21 C16 C17 C18 0.5(9) . . . . ?
Si1 C16 C17 C18 173.7(5) . . . . ?
C16 C17 C18 C19 -0.5(9) . . . . ?
C17 C18 C19 C20 1.1(10) . . . . ?
C17 C18 C19 C22 -177.7(6) . . . . ?
C18 C19 C20 C21 -1.9(10) . . . . ?
C22 C19 C20 C21 176.9(6) . . . . ?
C19 C20 C21 C16 2.0(10) . . . . ?
C17 C16 C21 C20 -1.3(9) . . . . ?
Si1 C16 C21 C20 -174.5(5) . . . . ?
O4 Si1 C23 C24 -8.3(6) . . . . ?
C9 Si1 C23 C24 -131.6(5) . . . . ?
C16 Si1 C23 C24 105.0(5) . . . . ?
O4 Si1 C23 C28 175.7(5) . . . . ?
C9 Si1 C23 C28 52.4(5) . . . . ?
C16 Si1 C23 C28 -71.0(5) . . . . ?
C28 C23 C24 C25 -1.6(9) . . . . ?
Si1 C23 C24 C25 -177.7(5) . . . . ?
C23 C24 C25 C26 1.4(9) . . . . ?
C24 C25 C26 C27 -0.2(9) . . . . ?
C24 C25 C26 C29 177.9(6) . . . . ?
C25 C26 C27 C28 -0.6(10) . . . . ?
C29 C26 C27 C28 -178.6(7) . . . . ?
C26 C27 C28 C23 0.3(10) . . . . ?
C24 C23 C28 C27 0.8(9) . . . . ?
Si1 C23 C28 C27 177.0(5) . . . . ?
C2 Mo1 C30 C34 -177.8(4) . . . . ?
C1 Mo1 C30 C34 -103.4(4) . . . . ?
O3 Mo1 C30 C34 -16.0(5) . . . . ?
C31 Mo1 C30 C34 116.2(6) . . . . ?
C4 Mo1 C30 C34 77.4(6) . . . . ?
C33 Mo1 C30 C34 38.0(4) . . . . ?
C3 Mo1 C30 C34 -5.5(8) . . . . ?
C32 Mo1 C30 C34 79.3(4) . . . . ?
C2 Mo1 C30 C31 66.0(4) . . . . ?
C1 Mo1 C30 C31 140.4(4) . . . . ?
O3 Mo1 C30 C31 -132.2(3) . . . . ?
C34 Mo1 C30 C31 -116.2(6) . . . . ?
C4 Mo1 C30 C31 -38.8(6) . . . . ?
C33 Mo1 C30 C31 -78.2(4) . . . . ?
C3 Mo1 C30 C31 -121.7(5) . . . . ?
C32 Mo1 C30 C31 -36.9(4) . . . . ?
C2 Mo1 C30 C35 -56.6(6) . . . . ?
C1 Mo1 C30 C35 17.7(6) . . . . ?
O3 Mo1 C30 C35 105.2(6) . . . . ?
C34 Mo1 C30 C35 121.2(8) . . . . ?
C31 Mo1 C30 C35 -122.6(7) . . . . ?
C4 Mo1 C30 C35 -161.4(5) . . . . ?
C33 Mo1 C30 C35 159.2(7) . . . . ?
C3 Mo1 C30 C35 115.7(7) . . . . ?
C32 Mo1 C30 C35 -159.6(7) . . . . ?
C34 C30 C31 C32 2.5(7) . . . . ?
C35 C30 C31 C32 -172.5(6) . . . . ?
Mo1 C30 C31 C32 66.6(4) . . . . ?
C34 C30 C31 C36 173.7(6) . . . . ?
C35 C30 C31 C36 -1.3(10) . . . . ?
Mo1 C30 C31 C36 -122.2(6) . . . . ?
C34 C30 C31 Mo1 -64.1(4) . . . . ?
C35 C30 C31 Mo1 120.9(6) . . . . ?
C2 Mo1 C31 C30 -116.0(4) . . . . ?
C1 Mo1 C31 C30 -44.9(4) . . . . ?
O3 Mo1 C31 C30 79.8(5) . . . . ?
C34 Mo1 C31 C30 37.6(4) . . . . ?
C4 Mo1 C31 C30 159.4(4) . . . . ?
C33 Mo1 C31 C30 79.3(4) . . . . ?
C3 Mo1 C31 C30 137.8(4) . . . . ?
C32 Mo1 C31 C30 116.4(5) . . . . ?
C2 Mo1 C31 C32 127.6(4) . . . . ?
C1 Mo1 C31 C32 -161.3(4) . . . . ?
O3 Mo1 C31 C32 -36.6(5) . . . . ?
C30 Mo1 C31 C32 -116.4(5) . . . . ?
C34 Mo1 C31 C32 -78.8(4) . . . . ?
C4 Mo1 C31 C32 43.0(4) . . . . ?
C33 Mo1 C31 C32 -37.1(4) . . . . ?
C3 Mo1 C31 C32 21.4(6) . . . . ?
C2 Mo1 C31 C36 5.2(6) . . . . ?
C1 Mo1 C31 C36 76.2(6) . . . . ?
O3 Mo1 C31 C36 -159.0(5) . . . . ?
C30 Mo1 C31 C36 121.2(7) . . . . ?
C34 Mo1 C31 C36 158.8(6) . . . . ?
C4 Mo1 C31 C36 -79.5(6) . . . . ?
C33 Mo1 C31 C36 -159.5(6) . . . . ?
C3 Mo1 C31 C36 -101.0(6) . . . . ?
C32 Mo1 C31 C36 -122.4(7) . . . . ?
C30 C31 C32 C33 -1.5(7) . . . . ?
C36 C31 C32 C33 -172.8(6) . . . . ?
Mo1 C31 C32 C33 62.1(4) . . . . ?
C30 C31 C32 C37 171.5(6) . . . . ?
C36 C31 C32 C37 0.1(10) . . . . ?
Mo1 C31 C32 C37 -125.0(6) . . . . ?
C30 C31 C32 Mo1 -63.6(4) . . . . ?
C36 C31 C32 Mo1 125.1(6) . . . . ?
C2 Mo1 C32 C31 -55.6(4) . . . . ?
C1 Mo1 C32 C31 32.5(6) . . . . ?
O3 Mo1 C32 C31 156.9(3) . . . . ?
C30 Mo1 C32 C31 37.5(4) . . . . ?
C34 Mo1 C32 C31 79.6(4) . . . . ?
C4 Mo1 C32 C31 -143.4(4) . . . . ?
C33 Mo1 C32 C31 116.6(5) . . . . ?
C3 Mo1 C32 C31 -168.3(3) . . . . ?
C2 Mo1 C32 C33 -172.2(4) . . . . ?
C1 Mo1 C32 C33 -84.1(6) . . . . ?
O3 Mo1 C32 C33 40.3(4) . . . . ?
C30 Mo1 C32 C33 -79.1(4) . . . . ?
C34 Mo1 C32 C33 -37.0(4) . . . . ?
C31 Mo1 C32 C33 -116.6(5) . . . . ?
C4 Mo1 C32 C33 100.0(4) . . . . ?
C3 Mo1 C32 C33 75.1(4) . . . . ?
C2 Mo1 C32 C37 65.8(7) . . . . ?
C1 Mo1 C32 C37 153.9(6) . . . . ?
O3 Mo1 C32 C37 -81.7(6) . . . . ?
C30 Mo1 C32 C37 158.9(7) . . . . ?
C34 Mo1 C32 C37 -159.0(7) . . . . ?
C31 Mo1 C32 C37 121.4(8) . . . . ?
C4 Mo1 C32 C37 -22.0(6) . . . . ?
C33 Mo1 C32 C37 -122.0(8) . . . . ?
C3 Mo1 C32 C37 -46.9(7) . . . . ?
C31 C32 C33 C34 -0.1(7) . . . . ?
C37 C32 C33 C34 -173.1(6) . . . . ?
Mo1 C32 C33 C34 60.7(4) . . . . ?
C31 C32 C33 C38 178.3(6) . . . . ?
C37 C32 C33 C38 5.4(10) . . . . ?
Mo1 C32 C33 C38 -120.9(6) . . . . ?
C31 C32 C33 Mo1 -60.8(4) . . . . ?
C37 C32 C33 Mo1 126.2(6) . . . . ?
C2 Mo1 C33 C34 -105.1(5) . . . . ?
C1 Mo1 C33 C34 17.5(5) . . . . ?
O3 Mo1 C33 C34 100.1(4) . . . . ?
C30 Mo1 C33 C34 -38.3(4) . . . . ?
C31 Mo1 C33 C34 -80.2(4) . . . . ?
C4 Mo1 C33 C34 160.0(4) . . . . ?
C3 Mo1 C33 C34 125.6(4) . . . . ?
C32 Mo1 C33 C34 -117.2(5) . . . . ?
C2 Mo1 C33 C32 12.1(6) . . . . ?
C1 Mo1 C33 C32 134.7(4) . . . . ?
O3 Mo1 C33 C32 -142.7(4) . . . . ?
C30 Mo1 C33 C32 78.9(4) . . . . ?
C34 Mo1 C33 C32 117.2(5) . . . . ?
C31 Mo1 C33 C32 37.0(3) . . . . ?
C4 Mo1 C33 C32 -82.8(4) . . . . ?
C3 Mo1 C33 C32 -117.2(4) . . . . ?
C2 Mo1 C33 C38 134.2(6) . . . . ?
C1 Mo1 C33 C38 -103.2(7) . . . . ?
O3 Mo1 C33 C38 -20.6(6) . . . . ?
C30 Mo1 C33 C38 -159.0(7) . . . . ?
C34 Mo1 C33 C38 -120.7(8) . . . . ?
C31 Mo1 C33 C38 159.1(7) . . . . ?
C4 Mo1 C33 C38 39.3(6) . . . . ?
C3 Mo1 C33 C38 4.9(7) . . . . ?
C32 Mo1 C33 C38 122.1(8) . . . . ?
C31 C30 C34 C33 -2.5(7) . . . . ?
C35 C30 C34 C33 172.5(6) . . . . ?
Mo1 C30 C34 C33 -67.6(4) . . . . ?
C31 C30 C34 C39 -178.3(6) . . . . ?
C35 C30 C34 C39 -3.3(11) . . . . ?
Mo1 C30 C34 C39 116.6(7) . . . . ?
C31 C30 C34 Mo1 65.1(4) . . . . ?
C35 C30 C34 Mo1 -119.9(6) . . . . ?
C32 C33 C34 C30 1.6(7) . . . . ?
C38 C33 C34 C30 -176.8(6) . . . . ?
Mo1 C33 C34 C30 65.3(4) . . . . ?
C32 C33 C34 C39 177.5(6) . . . . ?
C38 C33 C34 C39 -0.9(11) . . . . ?
Mo1 C33 C34 C39 -118.8(6) . . . . ?
C32 C33 C34 Mo1 -63.7(4) . . . . ?
C38 C33 C34 Mo1 117.9(7) . . . . ?
C2 Mo1 C34 C30 3.2(6) . . . . ?
C1 Mo1 C34 C30 78.3(4) . . . . ?
O3 Mo1 C34 C30 167.0(4) . . . . ?
C31 Mo1 C34 C30 -37.3(4) . . . . ?
C4 Mo1 C34 C30 -141.2(4) . . . . ?
C33 Mo1 C34 C30 -114.8(6) . . . . ?
C3 Mo1 C34 C30 177.5(4) . . . . ?
C32 Mo1 C34 C30 -78.3(4) . . . . ?
C2 Mo1 C34 C33 118.0(5) . . . . ?
C1 Mo1 C34 C33 -166.8(4) . . . . ?
O3 Mo1 C34 C33 -78.1(4) . . . . ?
C30 Mo1 C34 C33 114.8(6) . . . . ?
C31 Mo1 C34 C33 77.5(4) . . . . ?
C4 Mo1 C34 C33 -26.3(5) . . . . ?
C3 Mo1 C34 C33 -67.7(4) . . . . ?
C32 Mo1 C34 C33 36.6(4) . . . . ?
C2 Mo1 C34 C39 -120.2(6) . . . . ?
C1 Mo1 C34 C39 -45.0(6) . . . . ?
O3 Mo1 C34 C39 43.7(6) . . . . ?
C30 Mo1 C34 C39 -123.4(8) . . . . ?
C31 Mo1 C34 C39 -160.7(7) . . . . ?
C4 Mo1 C34 C39 95.5(7) . . . . ?
C33 Mo1 C34 C39 121.8(8) . . . . ?
C3 Mo1 C34 C39 54.1(7) . . . . ?
C32 Mo1 C34 C39 158.3(7) . . . . ?
Mo2 O7 C42 O8 -125.0(5) . . . . ?
Mo2 O7 C42 C43 48.4(5) . . . . ?
Si2 O8 C42 O7 -16.8(7) . . . . ?
Si2 O8 C42 C43 169.9(4) . . . . ?
Si2 O8 C42 Mo2 -97.4(5) . . . . ?
C40 Mo2 C42 O7 -163.0(4) . . . . ?
C41 Mo2 C42 O7 -86.5(4) . . . . ?
C73 Mo2 C42 O7 82.2(7) . . . . ?
C72 Mo2 C42 O7 90.5(4) . . . . ?
C69 Mo2 C42 O7 5.3(5) . . . . ?
C70 Mo2 C42 O7 23.8(4) . . . . ?
C71 Mo2 C42 O7 59.9(4) . . . . ?
C43 Mo2 C42 O7 136.4(5) . . . . ?
C40 Mo2 C42 O8 -55.7(6) . . . . ?
C41 Mo2 C42 O8 20.8(5) . . . . ?
O7 Mo2 C42 O8 107.3(6) . . . . ?
C73 Mo2 C42 O8 -170.5(6) . . . . ?
C72 Mo2 C42 O8 -162.2(5) . . . . ?
C69 Mo2 C42 O8 112.6(5) . . . . ?
C70 Mo2 C42 O8 131.1(5) . . . . ?
C71 Mo2 C42 O8 167.2(5) . . . . ?
C43 Mo2 C42 O8 -116.3(7) . . . . ?
C40 Mo2 C42 C43 60.7(4) . . . . ?
C41 Mo2 C42 C43 137.2(4) . . . . ?
O7 Mo2 C42 C43 -136.4(5) . . . . ?
C73 Mo2 C42 C43 -54.2(8) . . . . ?
C72 Mo2 C42 C43 -45.9(4) . . . . ?
C69 Mo2 C42 C43 -131.0(4) . . . . ?
C70 Mo2 C42 C43 -112.5(4) . . . . ?
C71 Mo2 C42 C43 -76.5(4) . . . . ?
O7 C42 C43 C44 -179.3(5) . . . . ?
O8 C42 C43 C44 -6.1(9) . . . . ?
Mo2 C42 C43 C44 -133.8(6) . . . . ?
O7 C42 C43 Mo2 -45.5(5) . . . . ?
O8 C42 C43 Mo2 127.8(5) . . . . ?
C40 Mo2 C43 C42 -122.2(4) . . . . ?
C41 Mo2 C43 C42 -49.8(4) . . . . ?
O7 Mo2 C43 C42 24.6(3) . . . . ?
C73 Mo2 C43 C42 159.4(3) . . . . ?
C72 Mo2 C43 C42 143.7(4) . . . . ?
C69 Mo2 C43 C42 109.0(5) . . . . ?
C70 Mo2 C43 C42 85.2(4) . . . . ?
C71 Mo2 C43 C42 109.0(4) . . . . ?
C40 Mo2 C43 C44 1.3(6) . . . . ?
C41 Mo2 C43 C44 73.7(6) . . . . ?
O7 Mo2 C43 C44 148.0(6) . . . . ?
C73 Mo2 C43 C44 -77.1(6) . . . . ?
C72 Mo2 C43 C44 -92.8(6) . . . . ?
C69 Mo2 C43 C44 -127.5(6) . . . . ?
C70 Mo2 C43 C44 -151.4(5) . . . . ?
C71 Mo2 C43 C44 -127.5(6) . . . . ?
C42 Mo2 C43 C44 123.5(7) . . . . ?
C42 C43 C44 C47 175.9(6) . . . . ?
Mo2 C43 C44 C47 73.5(7) . . . . ?
C42 C43 C44 C45 52.5(8) . . . . ?
Mo2 C43 C44 C45 -49.9(8) . . . . ?
C42 C43 C44 C46 -67.2(7) . . . . ?
Mo2 C43 C44 C46 -169.6(5) . . . . ?
O8 Si2 C48 C49 -86.9(5) . . . . ?
C62 Si2 C48 C49 158.3(5) . . . . ?
C55 Si2 C48 C49 34.6(6) . . . . ?
O8 Si2 C48 C53 95.1(5) . . . . ?
C62 Si2 C48 C53 -19.6(5) . . . . ?
C55 Si2 C48 C53 -143.4(5) . . . . ?
C53 C48 C49 C50 -2.4(9) . . . . ?
Si2 C48 C49 C50 179.6(5) . . . . ?
C48 C49 C50 C51 0.2(9) . . . . ?
C49 C50 C51 C52 1.1(9) . . . . ?
C49 C50 C51 C54 -179.6(6) . . . . ?
C50 C51 C52 C53 -0.1(9) . . . . ?
C54 C51 C52 C53 -179.5(6) . . . . ?
C51 C52 C53 C48 -2.1(9) . . . . ?
C49 C48 C53 C52 3.3(8) . . . . ?
Si2 C48 C53 C52 -178.7(5) . . . . ?
O8 Si2 C55 C56 163.3(5) . . . . ?
C62 Si2 C55 C56 -85.5(5) . . . . ?
C48 Si2 C55 C56 37.3(6) . . . . ?
O8 Si2 C55 C60 -21.9(5) . . . . ?
C62 Si2 C55 C60 89.3(5) . . . . ?
C48 Si2 C55 C60 -147.9(5) . . . . ?
C60 C55 C56 C57 -0.5(9) . . . . ?
Si2 C55 C56 C57 174.4(5) . . . . ?
C55 C56 C57 C58 0.0(10) . . . . ?
C56 C57 C58 C59 0.6(9) . . . . ?
C56 C57 C58 C61 -178.5(6) . . . . ?
C57 C58 C59 C60 -0.7(9) . . . . ?
C61 C58 C59 C60 178.5(6) . . . . ?
C58 C59 C60 C55 0.2(9) . . . . ?
C56 C55 C60 C59 0.4(8) . . . . ?
Si2 C55 C60 C59 -174.6(5) . . . . ?
O8 Si2 C62 C67 -31.4(5) . . . . ?
C55 Si2 C62 C67 -146.0(5) . . . . ?
C48 Si2 C62 C67 91.3(5) . . . . ?
O8 Si2 C62 C63 151.1(5) . . . . ?
C55 Si2 C62 C63 36.6(5) . . . . ?
C48 Si2 C62 C63 -86.2(5) . . . . ?
C67 C62 C63 C64 -0.8(9) . . . . ?
Si2 C62 C63 C64 176.8(5) . . . . ?
C62 C63 C64 C65 -0.3(10) . . . . ?
C63 C64 C65 C66 0.7(10) . . . . ?
C63 C64 C65 C68 -178.3(7) . . . . ?
C64 C65 C66 C67 -0.1(9) . . . . ?
C68 C65 C66 C67 179.0(6) . . . . ?
C65 C66 C67 C62 -1.0(10) . . . . ?
C63 C62 C67 C66 1.4(9) . . . . ?
Si2 C62 C67 C66 -176.2(5) . . . . ?
C40 Mo2 C69 C70 -161.3(4) . . . . ?
C41 Mo2 C69 C70 124.0(4) . . . . ?
O7 Mo2 C69 C70 33.9(4) . . . . ?
C73 Mo2 C69 C70 -116.6(5) . . . . ?
C72 Mo2 C69 C70 -78.2(4) . . . . ?
C71 Mo2 C69 C70 -37.3(4) . . . . ?
C43 Mo2 C69 C70 -37.3(7) . . . . ?
C42 Mo2 C69 C70 30.8(5) . . . . ?
C40 Mo2 C69 C73 -44.7(5) . . . . ?
C41 Mo2 C69 C73 -119.4(4) . . . . ?
O7 Mo2 C69 C73 150.5(3) . . . . ?
C72 Mo2 C69 C73 38.4(4) . . . . ?
C70 Mo2 C69 C73 116.6(5) . . . . ?
C71 Mo2 C69 C73 79.3(4) . . . . ?
C43 Mo2 C69 C73 79.3(6) . . . . ?
C42 Mo2 C69 C73 147.4(4) . . . . ?
C40 Mo2 C69 C74 75.8(7) . . . . ?
C41 Mo2 C69 C74 1.1(6) . . . . ?
O7 Mo2 C69 C74 -89.0(6) . . . . ?
C73 Mo2 C69 C74 120.5(8) . . . . ?
C72 Mo2 C69 C74 158.9(7) . . . . ?
C70 Mo2 C69 C74 -122.9(8) . . . . ?
C71 Mo2 C69 C74 -160.2(7) . . . . ?
C43 Mo2 C69 C74 -160.2(6) . . . . ?
C42 Mo2 C69 C74 -92.1(7) . . . . ?
C73 C69 C70 C71 2.1(7) . . . . ?
C74 C69 C70 C71 -176.8(6) . . . . ?
Mo2 C69 C70 C71 64.1(4) . . . . ?
C73 C69 C70 C75 -179.6(6) . . . . ?
C74 C69 C70 C75 1.5(10) . . . . ?
Mo2 C69 C70 C75 -117.7(6) . . . . ?
C73 C69 C70 Mo2 -62.0(4) . . . . ?
C74 C69 C70 Mo2 119.2(6) . . . . ?
C40 Mo2 C70 C69 29.5(6) . . . . ?
C41 Mo2 C70 C69 -60.4(4) . . . . ?
O7 Mo2 C70 C69 -148.8(4) . . . . ?
C73 Mo2 C70 C69 37.4(4) . . . . ?
C72 Mo2 C70 C69 80.0(4) . . . . ?
C71 Mo2 C70 C69 116.6(5) . . . . ?
C43 Mo2 C70 C69 160.9(3) . . . . ?
C42 Mo2 C70 C69 -161.2(3) . . . . ?
C40 Mo2 C70 C71 -87.0(6) . . . . ?
C41 Mo2 C70 C71 -177.0(4) . . . . ?
O7 Mo2 C70 C71 94.6(4) . . . . ?
C73 Mo2 C70 C71 -79.2(4) . . . . ?
C72 Mo2 C70 C71 -36.6(3) . . . . ?
C69 Mo2 C70 C71 -116.6(5) . . . . ?
C43 Mo2 C70 C71 44.3(4) . . . . ?
C42 Mo2 C70 C71 82.2(4) . . . . ?
C40 Mo2 C70 C75 151.3(6) . . . . ?
C41 Mo2 C70 C75 61.3(7) . . . . ?
O7 Mo2 C70 C75 -27.1(6) . . . . ?
C73 Mo2 C70 C75 159.1(7) . . . . ?
C72 Mo2 C70 C75 -158.3(7) . . . . ?
C69 Mo2 C70 C75 121.7(7) . . . . ?
C71 Mo2 C70 C75 -121.7(8) . . . . ?
C43 Mo2 C70 C75 -77.4(6) . . . . ?
C42 Mo2 C70 C75 -39.5(7) . . . . ?
C69 C70 C71 C72 -1.0(7) . . . . ?
C75 C70 C71 C72 -179.3(6) . . . . ?
Mo2 C70 C71 C72 62.9(4) . . . . ?
C69 C70 C71 C76 176.2(6) . . . . ?
C75 C70 C71 C76 -2.0(10) . . . . ?
Mo2 C70 C71 C76 -119.8(6) . . . . ?
C69 C70 C71 Mo2 -63.9(4) . . . . ?
C75 C70 C71 Mo2 117.8(6) . . . . ?
C40 Mo2 C71 C72 11.4(5) . . . . ?
C41 Mo2 C71 C72 -112.2(5) . . . . ?
O7 Mo2 C71 C72 160.7(4) . . . . ?
C73 Mo2 C71 C72 -38.3(4) . . . . ?
C69 Mo2 C71 C72 -80.1(4) . . . . ?
C70 Mo2 C71 C72 -116.9(5) . . . . ?
C43 Mo2 C71 C72 99.9(4) . . . . ?
C42 Mo2 C71 C72 133.5(4) . . . . ?
C40 Mo2 C71 C70 128.3(4) . . . . ?
C41 Mo2 C71 C70 4.8(6) . . . . ?
O7 Mo2 C71 C70 -82.3(4) . . . . ?
C73 Mo2 C71 C70 78.6(4) . . . . ?
C72 Mo2 C71 C70 116.9(5) . . . . ?
C69 Mo2 C71 C70 36.8(4) . . . . ?
C43 Mo2 C71 C70 -143.2(4) . . . . ?
C42 Mo2 C71 C70 -109.6(4) . . . . ?
C40 Mo2 C71 C76 -111.7(6) . . . . ?
C41 Mo2 C71 C76 124.8(6) . . . . ?
O7 Mo2 C71 C76 37.7(6) . . . . ?
C73 Mo2 C71 C76 -161.4(7) . . . . ?
C72 Mo2 C71 C76 -123.0(7) . . . . ?
C69 Mo2 C71 C76 156.8(7) . . . . ?
C70 Mo2 C71 C76 120.0(7) . . . . ?
C43 Mo2 C71 C76 -23.2(6) . . . . ?
C42 Mo2 C71 C76 10.5(6) . . . . ?
C70 C71 C72 C73 -0.4(7) . . . . ?
C76 C71 C72 C73 -177.6(6) . . . . ?
Mo2 C71 C72 C73 62.9(4) . . . . ?
C70 C71 C72 C77 175.0(6) . . . . ?
C76 C71 C72 C77 -2.1(10) . . . . ?
Mo2 C71 C72 C77 -121.6(6) . . . . ?
C70 C71 C72 Mo2 -63.3(4) . . . . ?
C76 C71 C72 Mo2 119.5(6) . . . . ?
C40 Mo2 C72 C71 -171.1(4) . . . . ?
C41 Mo2 C72 C71 115.3(5) . . . . ?
O7 Mo2 C72 C71 -22.3(4) . . . . ?
C73 Mo2 C72 C71 115.7(5) . . . . ?
C69 Mo2 C72 C71 78.0(4) . . . . ?
C70 Mo2 C72 C71 37.1(4) . . . . ?
C43 Mo2 C72 C71 -84.2(4) . . . . ?
C42 Mo2 C72 C71 -59.8(4) . . . . ?
C40 Mo2 C72 C73 73.2(4) . . . . ?
C41 Mo2 C72 C73 -0.4(6) . . . . ?
O7 Mo2 C72 C73 -138.0(3) . . . . ?
C69 Mo2 C72 C73 -37.7(4) . . . . ?
C70 Mo2 C72 C73 -78.6(4) . . . . ?
C71 Mo2 C72 C73 -115.7(5) . . . . ?
C43 Mo2 C72 C73 160.1(4) . . . . ?
C42 Mo2 C72 C73 -175.5(3) . . . . ?
C40 Mo2 C72 C77 -48.0(6) . . . . ?
C41 Mo2 C72 C77 -121.5(6) . . . . ?
O7 Mo2 C72 C77 100.9(5) . . . . ?
C73 Mo2 C72 C77 -121.1(7) . . . . ?
C69 Mo2 C72 C77 -158.8(6) . . . . ?
C70 Mo2 C72 C77 160.2(6) . . . . ?
C71 Mo2 C72 C77 123.2(7) . . . . ?
C43 Mo2 C72 C77 39.0(6) . . . . ?
C42 Mo2 C72 C77 63.4(6) . . . . ?
C70 C69 C73 C72 -2.4(6) . . . . ?
C74 C69 C73 C72 176.5(6) . . . . ?
Mo2 C69 C73 C72 -66.0(4) . . . . ?
C70 C69 C73 C78 -172.6(6) . . . . ?
C74 C69 C73 C78 6.3(10) . . . . ?
Mo2 C69 C73 C78 123.8(6) . . . . ?
C70 C69 C73 Mo2 63.7(4) . . . . ?
C74 C69 C73 Mo2 -117.4(6) . . . . ?
C71 C72 C73 C69 1.7(7) . . . . ?
C77 C72 C73 C69 -173.8(6) . . . . ?
Mo2 C72 C73 C69 66.7(4) . . . . ?
C71 C72 C73 C78 171.9(6) . . . . ?
C77 C72 C73 C78 -3.6(10) . . . . ?
Mo2 C72 C73 C78 -123.1(6) . . . . ?
C71 C72 C73 Mo2 -64.9(4) . . . . ?
C77 C72 C73 Mo2 119.6(6) . . . . ?
C40 Mo2 C73 C69 138.4(4) . . . . ?
C41 Mo2 C73 C69 64.6(4) . . . . ?
O7 Mo2 C73 C69 -46.7(5) . . . . ?
C72 Mo2 C73 C69 -115.2(5) . . . . ?
C70 Mo2 C73 C69 -36.7(4) . . . . ?
C71 Mo2 C73 C69 -78.2(4) . . . . ?
C43 Mo2 C73 C69 -142.2(4) . . . . ?
C42 Mo2 C73 C69 -103.6(7) . . . . ?
C40 Mo2 C73 C72 -106.4(4) . . . . ?
C41 Mo2 C73 C72 179.8(4) . . . . ?
O7 Mo2 C73 C72 68.5(5) . . . . ?
C69 Mo2 C73 C72 115.2(5) . . . . ?
C70 Mo2 C73 C72 78.4(4) . . . . ?
C71 Mo2 C73 C72 37.0(4) . . . . ?
C43 Mo2 C73 C72 -27.0(5) . . . . ?
C42 Mo2 C73 C72 11.5(9) . . . . ?
C40 Mo2 C73 C78 15.7(6) . . . . ?
C41 Mo2 C73 C78 -58.1(6) . . . . ?
O7 Mo2 C73 C78 -169.4(5) . . . . ?
C72 Mo2 C73 C78 122.1(7) . . . . ?
C69 Mo2 C73 C78 -122.7(7) . . . . ?
C70 Mo2 C73 C78 -159.4(7) . . . . ?
C71 Mo2 C73 C78 159.1(7) . . . . ?
C43 Mo2 C73 C78 95.1(6) . . . . ?
C42 Mo2 C73 C78 133.7(7) . . . . ?

#===END 
