# Electronic Supplementary Material (ESI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2018

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_2
_database_code_depnum_ccdc_archive 'CCDC 1855045'
_audit_update_record             
;
2018-07-11 deposited with the CCDC.
2018-07-31 downloaded from the CCDC.
;
_audit_creation_date             2018-07-10
_audit_creation_method           
;
Olex2 1.2
(compiled 2018.05.18 svn.r3508 for OlexSys, GUI svn.r5497)
;
_chemical_formula_moiety         'C43 H43 Cl2 N Ru'
_chemical_formula_sum            'C43 H43 Cl2 N Ru'
_chemical_formula_weight         745.80
loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_Cromer_Mann_a1
_atom_type_scat_Cromer_Mann_a2
_atom_type_scat_Cromer_Mann_a3
_atom_type_scat_Cromer_Mann_a4
_atom_type_scat_Cromer_Mann_b1
_atom_type_scat_Cromer_Mann_b2
_atom_type_scat_Cromer_Mann_b3
_atom_type_scat_Cromer_Mann_b4
_atom_type_scat_Cromer_Mann_c
_atom_type_scat_source
_atom_type_scat_dispersion_source
H 0.00000 0.00000 0.49300 0.32291 0.14019 0.04081 10.51090 26.12570 3.14236
57.79970 0.0030380000826
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'
C 0.00347 0.00161 2.31000 1.02000 1.58860 0.86500 20.84390 10.20750 0.56870
51.65120 0.215599998832
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'
Cl 0.14873 0.16029 11.46040 7.19640 6.25560 1.64550 0.01040 1.16620 18.51940
47.77840 -9.55739974976
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'
Ru -1.23940 0.83517 19.26740 12.91820 4.86337 1.56756 0.80852 8.43467 24.79970
94.29280 5.37873983383
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'
N 0.00653 0.00323 12.21260 3.13220 2.01250 1.16630 0.00570 9.89330 28.99750
0.58260 -11.5290002823
'International Tables Volume C Table 6.1.1.4 (pp. 500-502)'
'Henke, Gullikson and Davis, At. Data and Nucl. Data Tables, 1993, 54, 2'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 1'
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x,-y,-z

_symmetry_Int_Tables_number      2
_cell_length_a                   7.8768(12)
_cell_length_b                   13.917(2)
_cell_length_c                   17.713(3)
_cell_angle_alpha                104.199(4)
_cell_angle_beta                 93.373(4)
_cell_angle_gamma                105.059(4)
_cell_volume                     1802.1(5)
_cell_formula_units_Z            2
_cell_measurement_reflns_used    9854
_cell_measurement_temperature    296
_cell_measurement_theta_max      27.13
_cell_measurement_theta_min      2.48
_exptl_absorpt_coefficient_mu    0.615
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.85491
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   
'CrysAlisPro, Agilent Technologies, Version 1.171.35.19 (release 27-10-2011 CrysAlis171                              .NET)                                                                    (compiled Oct 27 2011, 15:02:11)                                     Empirical absorption correction using spherical harmonics,                                                                        implemented in SCALE3ABSPACK scaling algorithm.'
_exptl_crystal_colour            'clear dark red'
_exptl_crystal_colour_lustre     clear
_exptl_crystal_colour_modifier   dark
_exptl_crystal_colour_primary    red
_exptl_crystal_density_diffrn    1.3743
_exptl_crystal_description       plate
_exptl_crystal_F_000             770.3401
_exptl_crystal_size_max          0.433
_exptl_crystal_size_mid          0.364
_exptl_crystal_size_min          0.21
_diffrn_reflns_av_R_equivalents  0.0219
_diffrn_reflns_av_unetI/netI     0.0150
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_limit_l_min       -22
_diffrn_reflns_number            46323
_diffrn_reflns_theta_full        27.2221
_diffrn_reflns_theta_max         27.22
_diffrn_reflns_theta_min         2.39
_diffrn_ambient_temperature      296.15
_diffrn_measured_fraction_theta_full 0.9936
_diffrn_measured_fraction_theta_max 0.9904
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and ω scans'
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_standards_number         0
_reflns_Friedel_coverage         0.0
_reflns_limit_h_max              10
_reflns_limit_h_min              -10
_reflns_limit_k_max              17
_reflns_limit_k_min              -17
_reflns_limit_l_max              22
_reflns_limit_l_min              0
_reflns_number_gt                7218
_reflns_number_total             7965
_reflns_threshold_expression     I>=2u(I)
_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
_computing_publication_material  'Olex2 (Dolomanov et al., 2009)'
_computing_structure_refinement  'olex2.refine (Bourhis et al., 2015)'
_computing_structure_solution    'olex2.solve (Bourhis et al., 2015)'
_refine_diff_density_max         0.5991
_refine_diff_density_min         -0.5726
_refine_diff_density_rms         0.0709
_refine_ls_d_res_high            0.7769
_refine_ls_d_res_low             8.5121
_refine_ls_goodness_of_fit_ref   1.0488
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_constraints    77
_refine_ls_number_parameters     428
_refine_ls_number_reflns         7965
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0346
_refine_ls_R_factor_gt           0.0299
_refine_ls_restrained_S_all      1.0488
_refine_ls_shift/su_max          0.0001
_refine_ls_shift/su_mean         0.0000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0477P)²+0.9679P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0827
_refine_ls_wR_factor_ref         0.0871
_olex2_refinement_description    
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All N(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 C20(H20), C7(H7), C40(H40)
2.b Secondary CH2 refined with riding coordinates:
 N1(H1a,H1b)
2.c Aromatic/amide H refined with riding coordinates:
 C3(H3), C32(H32), C38(H38), C28(H28), C5(H5), C29(H29), C30(H30), C31(H31),
 C34(H34), C35(H35), C37(H37), C19(H19), C26(H26), C22(H22), C15(H15), C24(H24),
  C23(H23), C25(H25), C9(H9), C18(H18), C17(H17), C16(H16), C13(H13), C10(H10),
 C12(H12), C11(H11)
2.d Idealised Me refined as rotating group:
 C43(H43a,H43b,H43c), C39(H39a,H39b,H39c), C42(H42a,H42b,H42c), C41(H41a,H41b,
 H41c)
;
_atom_sites_solution_primary     iterative
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_refinement_flags_posn
Ru1 Ru 0.081338(19) 0.840077(12) 0.381938(8) 0.03595(6) Uani 1.000000 .
N1 N 0.04820(19) 0.75484(12) 0.25769(9) 0.0304(3) Uani 1.000000 .
H1a H -0.03660(19) 0.69495(12) 0.25147(9) 0.0365(4) Uiso 1.000000 R
H1b H 0.00426(19) 0.79130(12) 0.23005(9) 0.0365(4) Uiso 1.000000 R
C2 C 0.2295(2) 0.63540(13) 0.21916(10) 0.0298(3) Uani 1.000000 .
C14 C 0.1038(3) 0.87337(14) 0.11465(12) 0.0346(4) Uani 1.000000 .
C20 C 0.1034(2) 0.55439(14) 0.25023(11) 0.0323(4) Uani 1.000000 .
H20 H 0.0682(2) 0.59193(14) 0.29834(11) 0.0388(4) Uiso 1.000000 R
C3 C 0.3748(2) 0.61396(14) 0.18468(12) 0.0345(4) Uani 1.000000 .
H3 H 0.3994(2) 0.55211(14) 0.18467(12) 0.0415(5) Uiso 1.000000 R
C32 C 0.3408(3) 0.5115(2) 0.32850(15) 0.0524(5) Uani 1.000000 .
H32 H 0.3919(3) 0.5821(2) 0.34979(15) 0.0629(7) Uiso 1.000000 R
C6 C 0.3027(2) 0.79987(13) 0.18598(11) 0.0305(4) Uani 1.000000 .
C38 C 0.3079(3) 0.79215(18) 0.41479(12) 0.0441(5) Uani 1.000000 .
H38 H 0.3454(3) 0.73606(18) 0.38910(12) 0.0530(6) Uiso 1.000000 R
C1 C 0.1948(2) 0.72929(13) 0.22005(10) 0.0278(3) Uani 1.000000 .
C28 C 0.1227(3) 0.37142(17) 0.24051(16) 0.0523(6) Uani 1.000000 .
H28 H 0.0243(3) 0.34618(17) 0.20221(16) 0.0628(7) Uiso 1.000000 R
C5 C 0.4460(2) 0.77465(14) 0.15193(12) 0.0345(4) Uani 1.000000 .
H5 H 0.5186(2) 0.82127(14) 0.12956(12) 0.0414(5) Uiso 1.000000 R
C8 C 0.4162(3) 0.98385(15) 0.17270(14) 0.0432(5) Uani 1.000000 .
C29 C 0.1997(4) 0.3025(2) 0.2642(2) 0.0690(8) Uani 1.000000 .
H29 H 0.1523(4) 0.2319(2) 0.2416(2) 0.0828(9) Uiso 1.000000 R
C30 C 0.3436(4) 0.3374(2) 0.3201(2) 0.0705(8) Uani 1.000000 .
H30 H 0.3932(4) 0.2909(2) 0.3365(2) 0.0846(10) Uiso 1.000000 R
C31 C 0.4155(4) 0.4425(2) 0.35254(18) 0.0658(7) Uani 1.000000 .
H31 H 0.5145(4) 0.4670(2) 0.39058(18) 0.0789(9) Uiso 1.000000 R
C27 C 0.1904(3) 0.47700(16) 0.27303(12) 0.0373(4) Uani 1.000000 .
C34 C 0.1369(3) 0.86799(19) 0.50909(12) 0.0488(5) Uani 1.000000 .
H34 H 0.0593(3) 0.86273(19) 0.54645(12) 0.0585(6) Uiso 1.000000 R
C35 C 0.1983(3) 0.96189(18) 0.49067(12) 0.0482(5) Uani 1.000000 .
H35 H 0.1620(3) 1.01833(18) 0.51660(12) 0.0578(6) Uiso 1.000000 R
C36 C 0.3149(3) 0.97324(17) 0.43323(13) 0.0451(5) Uani 1.000000 .
C7 C 0.2556(2) 0.89794(14) 0.18053(11) 0.0334(4) Uani 1.000000 .
H7 H 0.2123(2) 0.92448(14) 0.22990(11) 0.0400(5) Uiso 1.000000 R
C33 C 0.1913(3) 0.77995(18) 0.47152(12) 0.0465(5) Uani 1.000000 .
C37 C 0.3693(3) 0.88723(18) 0.39591(12) 0.0438(5) Uani 1.000000 .
H37 H 0.4465(3) 0.89274(18) 0.35841(12) 0.0525(6) Uiso 1.000000 R
C40 C 0.1325(4) 0.6769(2) 0.49137(16) 0.0654(7) Uani 1.000000 .
H40 H 0.1009(4) 0.6220(2) 0.44193(16) 0.0785(9) Uiso 1.000000 R
Cl1 Cl -0.05909(9) 0.94778(5) 0.32819(3) 0.05881(17) Uani 1.000000 .
Cl2 Cl -0.21262(8) 0.72719(7) 0.37305(4) 0.0732(2) Uani 1.000000 .
C4 C 0.4841(2) 0.68204(15) 0.15033(12) 0.0338(4) Uani 1.000000 .
C21 C -0.0661(2) 0.50002(14) 0.19242(12) 0.0332(4) Uani 1.000000 .
C43 C 0.6425(3) 0.65831(18) 0.11527(15) 0.0467(5) Uani 1.000000 .
H43a H 0.7016(14) 0.6289(13) 0.1487(5) 0.0700(8) Uiso 1.000000 GR
H43b H 0.6044(4) 0.6100(11) 0.0643(5) 0.0700(8) Uiso 1.000000 GR
H43c H 0.7225(11) 0.7209(3) 0.1103(10) 0.0700(8) Uiso 1.000000 GR
C19 C -0.0168(3) 0.93132(18) 0.12147(14) 0.0462(5) Uani 1.000000 .
H19 H -0.0100(3) 0.98198(18) 0.16782(14) 0.0555(6) Uiso 1.000000 R
C26 C -0.0661(3) 0.47974(16) 0.11215(13) 0.0421(4) Uani 1.000000 .
H26 H 0.0385(3) 0.50378(16) 0.09214(13) 0.0506(5) Uiso 1.000000 R
C22 C -0.2250(3) 0.46441(17) 0.22060(14) 0.0451(5) Uani 1.000000 .
H22 H -0.2292(3) 0.47880(17) 0.27446(14) 0.0541(6) Uiso 1.000000 R
C15 C 0.0856(3) 0.79731(19) 0.04614(14) 0.0511(5) Uani 1.000000 .
H15 H 0.1635(3) 0.75679(19) 0.04055(14) 0.0613(6) Uiso 1.000000 R
C24 C -0.3741(3) 0.38698(18) 0.08922(17) 0.0562(6) Uani 1.000000 .
H24 H -0.4760(3) 0.34810(18) 0.05476(17) 0.0674(7) Uiso 1.000000 R
C23 C -0.3777(3) 0.40744(19) 0.16878(17) 0.0551(6) Uani 1.000000 .
H23 H -0.4829(3) 0.38310(19) 0.18822(17) 0.0662(7) Uiso 1.000000 R
C25 C -0.2196(3) 0.42405(17) 0.06071(14) 0.0514(5) Uani 1.000000 .
H25 H -0.2174(3) 0.41190(17) 0.00680(14) 0.0617(7) Uiso 1.000000 R
C9 C 0.5672(3) 1.0176(2) 0.22835(16) 0.0573(6) Uani 1.000000 .
H9 H 0.5723(3) 0.9850(2) 0.26806(16) 0.0687(7) Uiso 1.000000 R
C18 C -0.1472(3) 0.9141(2) 0.05963(17) 0.0563(6) Uani 1.000000 .
H18 H -0.2263(3) 0.9540(2) 0.06455(17) 0.0676(7) Uiso 1.000000 R
C17 C -0.1604(4) 0.8391(2) -0.00846(17) 0.0632(7) Uani 1.000000 .
H17 H -0.2467(4) 0.8287(2) -0.05013(17) 0.0759(8) Uiso 1.000000 R
C16 C -0.0471(4) 0.7797(2) -0.01497(16) 0.0634(7) Uani 1.000000 .
H16 H -0.0583(4) 0.7271(2) -0.06056(16) 0.0760(8) Uiso 1.000000 R
C39 C 0.3697(4) 1.0744(2) 0.41194(17) 0.0652(7) Uani 1.000000 .
H39a H 0.302(2) 1.0686(6) 0.3634(7) 0.0978(11) Uiso 1.000000 GR
H39b H 0.349(3) 1.1281(4) 0.4527(6) 0.0978(11) Uiso 1.000000 GR
H39c H 0.4935(8) 1.0910(9) 0.4062(13) 0.0978(11) Uiso 1.000000 GR
C13 C 0.4174(4) 1.0298(2) 0.1114(2) 0.0688(8) Uani 1.000000 .
H13 H 0.3200(4) 1.0069(2) 0.0726(2) 0.0826(10) Uiso 1.000000 R
C10 C 0.7090(4) 1.0986(2) 0.2253(2) 0.0766(9) Uani 1.000000 .
H10 H 0.8066(4) 1.1224(2) 0.2640(2) 0.0919(11) Uiso 1.000000 R
C12 C 0.5626(4) 1.1097(3) 0.1072(3) 0.0944(13) Uani 1.000000 .
H12 H 0.5619(4) 1.1393(3) 0.0655(3) 0.1133(15) Uiso 1.000000 R
C11 C 0.7047(4) 1.1446(2) 0.1636(3) 0.0924(12) Uani 1.000000 .
H11 H 0.7998(4) 1.1994(2) 0.1613(3) 0.1109(14) Uiso 1.000000 R
C42 C 0.2904(6) 0.6632(3) 0.5379(2) 0.1005(13) Uani 1.000000 .
H42a H 0.3893(15) 0.669(2) 0.5084(8) 0.151(2) Uiso 1.000000 GR
H42b H 0.322(3) 0.7154(16) 0.5872(8) 0.151(2) Uiso 1.000000 GR
H42c H 0.2587(15) 0.5961(10) 0.5473(17) 0.151(2) Uiso 1.000000 GR
C41 C -0.0267(6) 0.6653(3) 0.5360(2) 0.1047(13) Uani 1.000000 .
H41a H 0.0036(15) 0.7154(18) 0.5863(8) 0.157(2) Uiso 1.000000 GR
H41b H -0.1233(15) 0.676(3) 0.5067(10) 0.157(2) Uiso 1.000000 GR
H41c H -0.061(3) 0.5970(9) 0.5432(18) 0.157(2) Uiso 1.000000 GR


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
Ru1 N1 2.1931(15) . ?
Ru1 C38 2.157(2) . ?
Ru1 C34 2.187(2) . ?
Ru1 C35 2.193(2) . ?
Ru1 C36 2.202(2) . ?
Ru1 C33 2.199(2) . ?
Ru1 C37 2.172(2) . ?
Ru1 Cl1 2.4113(6) . ?
Ru1 Cl2 2.4083(7) . ?
N1 C1 1.446(2) . ?
C2 C20 1.532(2) . ?
C2 C3 1.394(3) . ?
C2 C1 1.399(2) . ?
C14 C7 1.529(3) . ?
C14 C19 1.389(3) . ?
C14 C15 1.373(3) . ?
C20 C27 1.536(3) . ?
C20 C21 1.529(3) . ?
C3 C4 1.389(3) . ?
C32 C31 1.383(3) . ?
C32 C27 1.391(3) . ?
C6 C1 1.403(2) . ?
C6 C5 1.394(3) . ?
C6 C7 1.527(2) . ?
C38 C33 1.412(3) . ?
C38 C37 1.414(3) . ?
C28 C29 1.390(3) . ?
C28 C27 1.384(3) . ?
C5 C4 1.391(3) . ?
C8 C7 1.538(3) . ?
C8 C9 1.397(3) . ?
C8 C13 1.388(3) . ?
C29 C30 1.359(4) . ?
C30 C31 1.382(4) . ?
C34 C35 1.395(4) . ?
C34 C33 1.426(3) . ?
C35 C36 1.420(3) . ?
C36 C37 1.402(3) . ?
C36 C39 1.509(3) . ?
C33 C40 1.522(3) . ?
C40 C42 1.531(4) . ?
C40 C41 1.515(5) . ?
C4 C43 1.502(3) . ?
C21 C26 1.380(3) . ?
C21 C22 1.391(3) . ?
C19 C18 1.387(3) . ?
C26 C25 1.389(3) . ?
C22 C23 1.391(3) . ?
C15 C16 1.388(3) . ?
C24 C23 1.371(4) . ?
C24 C25 1.370(4) . ?
C9 C10 1.380(4) . ?
C18 C17 1.367(4) . ?
C17 C16 1.357(4) . ?
C13 C12 1.393(4) . ?
C10 C11 1.398(5) . ?
C12 C11 1.355(5) . ?

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
C38 Ru1 N1 94.87(7) . . ?
C34 Ru1 N1 157.00(8) . . ?
C34 Ru1 C38 67.70(9) . . ?
C35 Ru1 N1 158.24(8) . . ?
C35 Ru1 C38 79.69(8) . . ?
C35 Ru1 C34 37.16(9) . . ?
C36 Ru1 N1 120.74(7) . . ?
C36 Ru1 C38 68.25(8) . . ?
C36 Ru1 C34 68.08(9) . . ?
C36 Ru1 C35 37.71(9) . . ?
C33 Ru1 N1 119.43(7) . . ?
C33 Ru1 C38 37.81(9) . . ?
C33 Ru1 C34 37.95(9) . . ?
C33 Ru1 C35 68.01(9) . . ?
C33 Ru1 C36 81.52(8) . . ?
C37 Ru1 N1 95.39(7) . . ?
C37 Ru1 C38 38.13(9) . . ?
C37 Ru1 C34 80.20(9) . . ?
C37 Ru1 C35 67.29(9) . . ?
C37 Ru1 C36 37.38(8) . . ?
C37 Ru1 C33 68.83(9) . . ?
Cl1 Ru1 N1 81.94(4) . . ?
Cl1 Ru1 C38 153.26(7) . . ?
Cl1 Ru1 C34 120.44(7) . . ?
Cl1 Ru1 C35 93.45(6) . . ?
Cl1 Ru1 C36 90.48(6) . . ?
Cl1 Ru1 C33 158.35(6) . . ?
Cl1 Ru1 C37 115.45(6) . . ?
Cl2 Ru1 N1 81.31(4) . . ?
Cl2 Ru1 C38 119.45(7) . . ?
Cl2 Ru1 C34 94.05(7) . . ?
Cl2 Ru1 C35 119.80(7) . . ?
Cl2 Ru1 C36 157.11(7) . . ?
Cl2 Ru1 C33 93.11(7) . . ?
Cl2 Ru1 C37 157.31(7) . . ?
Cl2 Ru1 Cl1 86.47(3) . . ?
C1 N1 Ru1 121.83(11) . . ?
C3 C2 C20 120.38(16) . . ?
C1 C2 C20 120.80(16) . . ?
C1 C2 C3 118.69(16) . . ?
C19 C14 C7 120.24(18) . . ?
C15 C14 C7 121.87(18) . . ?
C15 C14 C19 117.8(2) . . ?
C27 C20 C2 113.46(15) . . ?
C21 C20 C2 110.79(15) . . ?
C21 C20 C27 111.88(15) . . ?
C4 C3 C2 122.08(17) . . ?
C27 C32 C31 121.1(2) . . ?
C5 C6 C1 118.46(16) . . ?
C7 C6 C1 120.69(16) . . ?
C7 C6 C5 120.68(16) . . ?
C33 C38 Ru1 72.68(12) . . ?
C37 C38 Ru1 71.49(12) . . ?
C37 C38 C33 121.9(2) . . ?
C2 C1 N1 119.77(15) . . ?
C6 C1 N1 119.55(15) . . ?
C6 C1 C2 120.67(16) . . ?
C27 C28 C29 121.0(2) . . ?
C4 C5 C6 122.16(17) . . ?
C9 C8 C7 119.8(2) . . ?
C13 C8 C7 122.1(2) . . ?
C13 C8 C9 118.1(2) . . ?
C30 C29 C28 120.7(3) . . ?
C31 C30 C29 119.5(2) . . ?
C30 C31 C32 120.1(3) . . ?
C32 C27 C20 120.44(19) . . ?
C28 C27 C20 121.99(18) . . ?
C28 C27 C32 117.6(2) . . ?
C35 C34 Ru1 71.67(12) . . ?
C33 C34 Ru1 71.48(12) . . ?
C33 C34 C35 121.0(2) . . ?
C34 C35 Ru1 71.17(12) . . ?
C36 C35 Ru1 71.49(12) . . ?
C36 C35 C34 121.5(2) . . ?
C35 C36 Ru1 70.80(12) . . ?
C37 C36 Ru1 70.14(12) . . ?
C37 C36 C35 118.0(2) . . ?
C39 C36 Ru1 128.23(16) . . ?
C39 C36 C35 119.7(2) . . ?
C39 C36 C37 122.3(2) . . ?
C6 C7 C14 110.84(15) . . ?
C8 C7 C14 111.68(16) . . ?
C8 C7 C6 113.11(15) . . ?
C38 C33 Ru1 69.51(12) . . ?
C34 C33 Ru1 70.57(12) . . ?
C34 C33 C38 117.0(2) . . ?
C40 C33 Ru1 131.89(16) . . ?
C40 C33 C38 120.0(2) . . ?
C40 C33 C34 123.0(2) . . ?
C38 C37 Ru1 70.38(12) . . ?
C36 C37 Ru1 72.48(13) . . ?
C36 C37 C38 120.6(2) . . ?
C42 C40 C33 108.3(2) . . ?
C41 C40 C33 114.2(3) . . ?
C41 C40 C42 110.5(3) . . ?
C5 C4 C3 117.94(17) . . ?
C43 C4 C3 121.07(17) . . ?
C43 C4 C5 120.95(17) . . ?
C26 C21 C20 122.25(17) . . ?
C22 C21 C20 119.56(18) . . ?
C22 C21 C26 118.10(19) . . ?
C18 C19 C14 120.4(2) . . ?
C25 C26 C21 121.1(2) . . ?
C23 C22 C21 120.5(2) . . ?
C16 C15 C14 121.2(2) . . ?
C25 C24 C23 119.7(2) . . ?
C24 C23 C22 120.4(2) . . ?
C24 C25 C26 120.1(2) . . ?
C10 C9 C8 121.0(3) . . ?
C17 C18 C19 120.5(2) . . ?
C16 C17 C18 119.7(2) . . ?
C17 C16 C15 120.3(3) . . ?
C12 C13 C8 120.8(3) . . ?
C11 C10 C9 119.5(3) . . ?
C11 C12 C13 120.3(3) . . ?
C12 C11 C10 120.2(3) . . ?

_olex2_submission_special_instructions 'No special instructions were received'
