# 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 2023

####################################################################### 
# 
# 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_RuHPMICH3CNPF6
_database_code_depnum_ccdc_archive 'CCDC 2217910'
loop_
_audit_author_name
_audit_author_address
'Tomoyuki Mochida'
;Kobe University
Japan
;
_audit_update_record             
;
2022-11-07 deposited with the CCDC.	2023-10-09 downloaded from the CCDC.
;
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_formula_moiety         ?
_chemical_formula_sum            'C19 H26 F6 N3 P Ru'
_chemical_formula_iupac          ?
_chemical_formula_weight         542.47

_chemical_melting_point          ?

_space_group_crystal_system      monoclinic
_space_group_name_H-M_alt        'P 1 21/c 1'
_space_group_name_Hall           '-P 2ybc'
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y-1/2, z-1/2'

_cell_length_a                   9.4336(12)
_cell_length_b                   21.056(3)
_cell_length_c                   11.5841(14)
_cell_angle_alpha                90
_cell_angle_beta                 104.669(2)
_cell_angle_gamma                90
_cell_volume                     2226.0(5)
_cell_formula_units_Z            4
_cell_measurement_reflns_used    2957
_cell_measurement_theta_min      2.2316
_cell_measurement_theta_max      26.9980
_cell_measurement_temperature    90.(2)

_exptl_crystal_description       block
_exptl_crystal_colour            brown
_exptl_crystal_size_max          0.051
_exptl_crystal_size_mid          0.042
_exptl_crystal_size_min          0.032
_exptl_crystal_density_diffrn    1.619
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             1096

_exptl_absorpt_coefficient_mu    0.836
_exptl_absorpt_correction_type   Multi-Scan
_exptl_absorpt_process_details   
;
SADABS-2016/2 - Bruker AXS area detector scaling and absorption correction
;
_exptl_absorpt_correction_T_min  0.88
_exptl_absorpt_correction_T_max  0.97

_exptl_special_details           
;
;

_diffrn_ambient_temperature      90.(2)

_diffrn_source                   'rotating-anode X-ray tube'
_diffrn_source_type              'Bruker Turbo X-ray Source'

_diffrn_radiation_type           MoK\a
_diffrn_radiation_source         'Bruker TXS fine-focus rotating anode'
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_monochromator  'Bruker Helios multilayer confocal mirror'

_diffrn_measurement_device_type  'Bruker APEXII CCD area detector'
_diffrn_measurement_method       'phi and omega scans'

_diffrn_detector_area_resol_mean 8.3333

_diffrn_reflns_number            12833
_diffrn_reflns_av_R_equivalents  0.0446
_diffrn_reflns_av_unetI/netI     0.0620
_diffrn_reflns_theta_min         1.93
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_full        27.48
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measured_fraction_theta_full 0.997
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_k_min       -15
_diffrn_reflns_limit_k_max       27
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_limit_l_max       14

_refine_special_details          
;
;

_reflns_number_total             5085
_reflns_number_gt                3853
_reflns_threshold_expression     'I > 2σ(I)'

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_R_factor_all          0.0569
_refine_ls_R_factor_gt           0.0355
_refine_ls_wR_factor_gt          0.0661
_refine_ls_wR_factor_ref         0.0726
_refine_ls_goodness_of_fit_ref   0.991
_refine_ls_restrained_S_all      0.951
_refine_ls_number_reflns         5085
_refine_ls_number_parameters     319
_refine_ls_number_restraints     492
_refine_ls_number_constraints    ?
_refine_ls_hydrogen_treatment    constr
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0287P)²] where P=(Fo²+2Fc²)/3'

_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     ?
_atom_sites_solution_secondary   ?

_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_diff_density_max         0.519
_refine_diff_density_min         -0.681
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       ?

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'
F F 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_computing_data_collection       ?
_computing_cell_refinement       'SAINT V8.38A (Bruker AXS Inc., 2017)'
_computing_data_reduction        'SAINT V8.38A (Bruker AXS Inc., 2017)'
_computing_structure_solution    'SHELXT 2014/5 (Sheldrick, 2014)'
_computing_structure_refinement  'SHELXL-2016/6 (Sheldrick, 2016)'
_computing_molecular_graphics    'shelXle (C.B. Huebschle, rev 833)'
_computing_publication_material  ?

loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_refinement_flags_posn
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
C C1 0.3916(13) 0.4546(5) 0.7014(9) 0.0187(19) Uani d U P . 0.62(2) A 1
H H1 0.475806 0.431851 0.743634 0.022 Uiso calc U P R 0.62(2) A 1
C C2 0.2453(13) 0.4471(6) 0.7133(10) 0.0207(19) Uani d U P . 0.62(2) A 1
H H2 0.214239 0.418651 0.765678 0.025 Uiso calc U P R 0.62(2) A 1
C C3 0.1548(14) 0.4901(6) 0.6321(11) 0.024(2) Uani d U P . 0.62(2) A 1
H H3 0.052065 0.494777 0.62084 0.028 Uiso calc U P R 0.62(2) A 1
C C4 0.2405(15) 0.5246(5) 0.5712(10) 0.021(2) Uani d U P . 0.62(2) A 1
H H4 0.206456 0.556533 0.512758 0.026 Uiso calc U P R 0.62(2) A 1
C C5 0.3867(13) 0.5034(5) 0.6127(9) 0.0193(19) Uani d U P . 0.62(2) A 1
H H5 0.468121 0.518619 0.586598 0.023 Uiso calc U P R 0.62(2) A 1
C C1' 0.294(2) 0.4446(9) 0.7180(17) 0.023(3) Uani d U P . 0.38(2) A 2
H H1' 0.305828 0.413107 0.778495 0.028 Uiso calc U P R 0.38(2) A 2
C C2' 0.161(2) 0.4746(9) 0.6597(15) 0.017(3) Uani d U P . 0.38(2) A 2
H H2' 0.066303 0.467164 0.672375 0.02 Uiso calc U P R 0.38(2) A 2
C C3' 0.1966(19) 0.5170(9) 0.5806(17) 0.017(3) Uani d U P . 0.38(2) A 2
H H3' 0.128164 0.543929 0.52881 0.02 Uiso calc U P R 0.38(2) A 2
C C4' 0.345(2) 0.5154(8) 0.5864(16) 0.019(3) Uani d U P . 0.38(2) A 2
H H4' 0.396277 0.540531 0.541732 0.023 Uiso calc U P R 0.38(2) A 2
C C5' 0.405(2) 0.4688(9) 0.6719(17) 0.024(3) Uani d U P . 0.38(2) A 2
H H5' 0.505169 0.4561 0.694443 0.029 Uiso calc U P R 0.38(2) A 2
C C6 0.4930(3) 0.33606(14) 0.4633(2) 0.0179(6) Uani d U . . 1.0 . .
C C7 0.6060(3) 0.29594(16) 0.4359(3) 0.0269(8) Uani d U . . 1.0 . .
H H7A 0.55993 0.262497 0.38009 0.04 Uiso calc U . R 1.0 . .
H H7B 0.664502 0.276585 0.509556 0.04 Uiso calc U . R 1.0 . .
H H7C 0.669638 0.321764 0.399598 0.04 Uiso calc U . R 1.0 . .
C C8 0.1805(3) 0.46695(15) 0.2680(2) 0.0210(7) Uani d U . . 1.0 . .
H H8 0.245688 0.501146 0.296422 0.025 Uiso calc U . R 1.0 . .
C C9 0.1179(4) 0.46157(15) 0.1468(3) 0.0281(8) Uani d U . . 1.0 . .
H H9 0.141279 0.491397 0.092862 0.034 Uiso calc U . R 1.0 . .
C C10 0.0215(4) 0.41266(15) 0.1046(3) 0.0316(8) Uani d U . . 1.0 . .
H H10 -0.023466 0.40902 0.021691 0.038 Uiso calc U . R 1.0 . .
C C11 -0.0092(4) 0.36895(15) 0.1840(3) 0.0260(8) Uani d U . . 1.0 . .
H H11 -0.074428 0.334626 0.156693 0.031 Uiso calc U . R 1.0 . .
C C12 0.0574(3) 0.37644(14) 0.3042(3) 0.0197(7) Uani d U . . 1.0 . .
C C13 0.0364(3) 0.33373(15) 0.3965(3) 0.0219(7) Uani d U . . 1.0 . .
H H13 -0.029058 0.298727 0.378743 0.026 Uiso calc U . R 1.0 . .
C C14 0.0958(4) 0.30204(15) 0.5999(3) 0.0278(8) Uani d U . . 1.0 . .
H H14A 0.012657 0.272829 0.56877 0.033 Uiso calc U . R 1.0 . .
H H14B 0.074013 0.326864 0.665912 0.033 Uiso calc U . R 1.0 . .
C C15 0.2352(4) 0.26348(15) 0.6473(3) 0.0271(8) Uani d U . . 1.0 . .
H H15A 0.22631 0.239687 0.718842 0.033 Uiso calc U . R 1.0 . .
H H15B 0.319017 0.293015 0.672247 0.033 Uiso calc U . R 1.0 . .
C C16 0.2676(3) 0.21650(15) 0.5564(3) 0.0255(7) Uani d U . . 1.0 . .
H H16A 0.181176 0.188773 0.527084 0.031 Uiso calc U . R 1.0 . .
H H16B 0.283879 0.240417 0.487286 0.031 Uiso calc U . R 1.0 . .
C C17 0.4016(4) 0.17517(15) 0.6085(3) 0.0278(8) Uani d U . . 1.0 . .
H H17A 0.488043 0.203042 0.636251 0.033 Uiso calc U . R 1.0 . .
H H17B 0.385961 0.152254 0.678843 0.033 Uiso calc U . R 1.0 . .
C C18 0.4345(4) 0.12691(16) 0.5207(3) 0.0317(8) Uani d U . . 1.0 . .
H H18A 0.34933 0.098127 0.494988 0.038 Uiso calc U . R 1.0 . .
H H18B 0.446951 0.149693 0.4492 0.038 Uiso calc U . R 1.0 . .
C C19 0.5703(4) 0.08741(18) 0.5715(3) 0.0471(10) Uani d U . . 1.0 . .
H H19A 0.585848 0.057933 0.510426 0.071 Uiso calc U . R 1.0 . .
H H19B 0.557441 0.063316 0.64054 0.071 Uiso calc U . R 1.0 . .
H H19C 0.655513 0.11546 0.596481 0.071 Uiso calc U . R 1.0 . .
F F1 0.81670(18) 0.19514(8) 0.40921(13) 0.0249(4) Uani d U . . 1.0 . .
F F2 0.8342(2) 0.22234(8) 0.22372(14) 0.0273(4) Uani d U . . 1.0 . .
F F3 0.95543(18) 0.13552(8) 0.31723(14) 0.0258(4) Uani d U . . 1.0 . .
F F4 0.74117(19) 0.09644(8) 0.34223(14) 0.0248(4) Uani d U . . 1.0 . .
F F5 0.62101(18) 0.18264(8) 0.24900(14) 0.0269(4) Uani d U . . 1.0 . .
F F6 0.7613(2) 0.12321(8) 0.15713(13) 0.0252(4) Uani d U . . 1.0 . .
N N1 0.4048(3) 0.36694(11) 0.48598(19) 0.0163(5) Uani d U . . 1.0 . .
N N2 0.1518(2) 0.42529(11) 0.34658(19) 0.0163(5) Uani d U . . 1.0 . .
N N3 0.1111(3) 0.34558(12) 0.5041(2) 0.0195(6) Uani d U . . 1.0 . .
P P1 0.78791(9) 0.15916(4) 0.28309(6) 0.01734(17) Uani d U . . 1.0 . .
Ru Ru1 0.24961(3) 0.42367(2) 0.53105(2) 0.01400(7) Uani d U . . 1.0 . .


_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_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
C1 C2 . 1.430(12) ?
C1 C5 . 1.446(10) ?
C1 Ru1 . 2.185(9) ?
C1 H1 . 0.95 ?
C2 C3 . 1.425(13) ?
C2 Ru1 . 2.178(11) ?
C2 H2 . 0.95 ?
C3 C4 . 1.402(12) ?
C3 Ru1 . 2.158(11) ?
C3 H3 . 0.95 ?
C4 C5 . 1.413(11) ?
C4 Ru1 . 2.183(11) ?
C4 H4 . 0.95 ?
C5 Ru1 . 2.183(9) ?
C5 H5 . 0.95 ?
C1' C5' . 1.39(2) ?
C1' C2' . 1.42(2) ?
C1' Ru1 . 2.145(19) ?
C1' H1' . 0.95 ?
C2' C3' . 1.382(19) ?
C2' Ru1 . 2.171(18) ?
C2' H2' . 0.95 ?
C3' C4' . 1.389(17) ?
C3' Ru1 . 2.142(18) ?
C3' H3' . 0.95 ?
C4' C5' . 1.407(17) ?
C4' Ru1 . 2.160(15) ?
C4' H4' . 0.95 ?
C5' Ru1 . 2.124(15) ?
C5' H5' . 0.95 ?
C6 N1 . 1.138(4) ?
C6 C7 . 1.457(4) ?
C7 H7A . 0.98 ?
C7 H7B . 0.98 ?
C7 H7C . 0.98 ?
C8 N2 . 1.340(4) ?
C8 C9 . 1.384(4) ?
C8 H8 . 0.95 ?
C9 C10 . 1.379(5) ?
C9 H9 . 0.95 ?
C10 C11 . 1.382(4) ?
C10 H10 . 0.95 ?
C11 C12 . 1.384(4) ?
C11 H11 . 0.95 ?
C12 N2 . 1.367(4) ?
C12 C13 . 1.449(4) ?
C13 N3 . 1.292(3) ?
C13 H13 . 0.95 ?
C14 N3 . 1.474(4) ?
C14 C15 . 1.524(5) ?
C14 H14A . 0.99 ?
C14 H14B . 0.99 ?
C15 C16 . 1.531(4) ?
C15 H15A . 0.99 ?
C15 H15B . 0.99 ?
C16 C17 . 1.528(4) ?
C16 H16A . 0.99 ?
C16 H16B . 0.99 ?
C17 C18 . 1.524(4) ?
C17 H17A . 0.99 ?
C17 H17B . 0.99 ?
C18 C19 . 1.516(5) ?
C18 H18A . 0.99 ?
C18 H18B . 0.99 ?
C19 H19A . 0.98 ?
C19 H19B . 0.98 ?
C19 H19C . 0.98 ?
F1 P1 . 1.6066(16) ?
F2 P1 . 1.6080(18) ?
F3 P1 . 1.6078(18) ?
F4 P1 . 1.6003(18) ?
F5 P1 . 1.6014(18) ?
F6 P1 . 1.6061(17) ?
N1 Ru1 . 2.057(2) ?
N2 Ru1 . 2.102(2) ?
N3 Ru1 . 2.074(2) ?

loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
C2 C1 C5 . . 106.8(10) ?
C2 C1 Ru1 . . 70.6(6) ?
C5 C1 Ru1 . . 70.6(5) ?
C2 C1 H1 . . 126.6 ?
C5 C1 H1 . . 126.6 ?
Ru1 C1 H1 . . 123.8 ?
C3 C2 C1 . . 107.3(10) ?
C3 C2 Ru1 . . 70.1(6) ?
C1 C2 Ru1 . . 71.1(6) ?
C3 C2 H2 . . 126.3 ?
C1 C2 H2 . . 126.3 ?
Ru1 C2 H2 . . 124.1 ?
C4 C3 C2 . . 109.7(11) ?
C4 C3 Ru1 . . 72.1(7) ?
C2 C3 Ru1 . . 71.6(6) ?
C4 C3 H3 . . 125.2 ?
C2 C3 H3 . . 125.2 ?
Ru1 C3 H3 . . 122.7 ?
C3 C4 C5 . . 107.6(10) ?
C3 C4 Ru1 . . 70.2(6) ?
C5 C4 Ru1 . . 71.1(6) ?
C3 C4 H4 . . 126.2 ?
C5 C4 H4 . . 126.2 ?
Ru1 C4 H4 . . 124.1 ?
C4 C5 C1 . . 108.7(9) ?
C4 C5 Ru1 . . 71.1(5) ?
C1 C5 Ru1 . . 70.7(5) ?
C4 C5 H5 . . 125.7 ?
C1 C5 H5 . . 125.7 ?
Ru1 C5 H5 . . 124.1 ?
C5' C1' C2' . . 108.6(17) ?
C5' C1' Ru1 . . 70.2(10) ?
C2' C1' Ru1 . . 71.8(10) ?
C5' C1' H1' . . 125.7 ?
C2' C1' H1' . . 125.7 ?
Ru1 C1' H1' . . 123.9 ?
C3' C2' C1' . . 105.4(18) ?
C3' C2' Ru1 . . 70.2(10) ?
C1' C2' Ru1 . . 69.8(11) ?
C3' C2' H2' . . 127.3 ?
C1' C2' H2' . . 127.3 ?
Ru1 C2' H2' . . 124.4 ?
C2' C3' C4' . . 111.6(17) ?
C2' C3' Ru1 . . 72.4(11) ?
C4' C3' Ru1 . . 71.9(10) ?
C2' C3' H3' . . 124.2 ?
C4' C3' H3' . . 124.2 ?
Ru1 C3' H3' . . 123.0 ?
C3' C4' C5' . . 105.7(16) ?
C3' C4' Ru1 . . 70.5(10) ?
C5' C4' Ru1 . . 69.4(9) ?
C3' C4' H4' . . 127.1 ?
C5' C4' H4' . . 127.1 ?
Ru1 C4' H4' . . 124.6 ?
C1' C5' C4' . . 108.7(16) ?
C1' C5' Ru1 . . 71.8(10) ?
C4' C5' Ru1 . . 72.2(9) ?
C1' C5' H5' . . 125.7 ?
C4' C5' H5' . . 125.7 ?
Ru1 C5' H5' . . 122.0 ?
N1 C6 C7 . . 179.1(3) ?
C6 C7 H7A . . 109.5 ?
C6 C7 H7B . . 109.5 ?
H7A C7 H7B . . 109.5 ?
C6 C7 H7C . . 109.5 ?
H7A C7 H7C . . 109.5 ?
H7B C7 H7C . . 109.5 ?
N2 C8 C9 . . 121.9(3) ?
N2 C8 H8 . . 119.1 ?
C9 C8 H8 . . 119.1 ?
C10 C9 C8 . . 119.6(3) ?
C10 C9 H9 . . 120.2 ?
C8 C9 H9 . . 120.2 ?
C9 C10 C11 . . 119.5(3) ?
C9 C10 H10 . . 120.3 ?
C11 C10 H10 . . 120.3 ?
C10 C11 C12 . . 118.4(3) ?
C10 C11 H11 . . 120.8 ?
C12 C11 H11 . . 120.8 ?
N2 C12 C11 . . 122.4(3) ?
N2 C12 C13 . . 113.6(2) ?
C11 C12 C13 . . 124.0(3) ?
N3 C13 C12 . . 116.7(3) ?
N3 C13 H13 . . 121.6 ?
C12 C13 H13 . . 121.6 ?
N3 C14 C15 . . 111.3(2) ?
N3 C14 H14A . . 109.4 ?
C15 C14 H14A . . 109.4 ?
N3 C14 H14B . . 109.4 ?
C15 C14 H14B . . 109.4 ?
H14A C14 H14B . . 108.0 ?
C14 C15 C16 . . 113.6(2) ?
C14 C15 H15A . . 108.8 ?
C16 C15 H15A . . 108.8 ?
C14 C15 H15B . . 108.8 ?
C16 C15 H15B . . 108.8 ?
H15A C15 H15B . . 107.7 ?
C17 C16 C15 . . 112.7(2) ?
C17 C16 H16A . . 109.1 ?
C15 C16 H16A . . 109.1 ?
C17 C16 H16B . . 109.1 ?
C15 C16 H16B . . 109.1 ?
H16A C16 H16B . . 107.8 ?
C18 C17 C16 . . 113.9(2) ?
C18 C17 H17A . . 108.8 ?
C16 C17 H17A . . 108.8 ?
C18 C17 H17B . . 108.8 ?
C16 C17 H17B . . 108.8 ?
H17A C17 H17B . . 107.7 ?
C19 C18 C17 . . 113.7(3) ?
C19 C18 H18A . . 108.8 ?
C17 C18 H18A . . 108.8 ?
C19 C18 H18B . . 108.8 ?
C17 C18 H18B . . 108.8 ?
H18A C18 H18B . . 107.7 ?
C18 C19 H19A . . 109.5 ?
C18 C19 H19B . . 109.5 ?
H19A C19 H19B . . 109.5 ?
C18 C19 H19C . . 109.5 ?
H19A C19 H19C . . 109.5 ?
H19B C19 H19C . . 109.5 ?
C6 N1 Ru1 . . 178.5(2) ?
C8 N2 C12 . . 118.3(2) ?
C8 N2 Ru1 . . 126.05(19) ?
C12 N2 Ru1 . . 115.53(19) ?
C13 N3 C14 . . 118.2(3) ?
C13 N3 Ru1 . . 117.8(2) ?
C14 N3 Ru1 . . 123.91(18) ?
F4 P1 F5 . . 90.01(10) ?
F4 P1 F6 . . 90.19(9) ?
F5 P1 F6 . . 90.21(9) ?
F4 P1 F1 . . 90.08(9) ?
F5 P1 F1 . . 90.45(9) ?
F6 P1 F1 . . 179.28(11) ?
F4 P1 F3 . . 89.96(10) ?
F5 P1 F3 . . 179.94(13) ?
F6 P1 F3 . . 89.73(9) ?
F1 P1 F3 . . 89.60(9) ?
F4 P1 F2 . . 179.74(11) ?
F5 P1 F2 . . 89.75(10) ?
F6 P1 F2 . . 89.90(9) ?
F1 P1 F2 . . 89.83(9) ?
F3 P1 F2 . . 90.28(10) ?
N1 Ru1 N3 . . 87.91(9) ?
N1 Ru1 N2 . . 84.78(9) ?
N3 Ru1 N2 . . 76.26(9) ?
N1 Ru1 C5' . . 93.3(5) ?
N3 Ru1 C5' . . 139.2(7) ?
N2 Ru1 C5' . . 144.5(7) ?
N1 Ru1 C3' . . 146.1(5) ?
N3 Ru1 C3' . . 125.9(5) ?
N2 Ru1 C3' . . 100.7(5) ?
C5' Ru1 C3' . . 63.0(6) ?
N1 Ru1 C1' . . 113.9(5) ?
N3 Ru1 C1' . . 105.6(6) ?
N2 Ru1 C1' . . 161.2(5) ?
C5' Ru1 C1' . . 37.9(5) ?
C3' Ru1 C1' . . 62.6(7) ?
N1 Ru1 C3 . . 159.0(3) ?
N3 Ru1 C3 . . 105.3(4) ?
N2 Ru1 C3 . . 113.9(3) ?
N1 Ru1 C4' . . 108.9(5) ?
N3 Ru1 C4' . . 162.5(5) ?
N2 Ru1 C4' . . 109.3(5) ?
C5' Ru1 C4' . . 38.3(5) ?
C3' Ru1 C4' . . 37.7(4) ?
C1' Ru1 C4' . . 63.7(7) ?
N1 Ru1 C2' . . 152.3(5) ?
N3 Ru1 C2' . . 99.0(5) ?
N2 Ru1 C2' . . 122.9(5) ?
C5' Ru1 C2' . . 64.1(7) ?
C3' Ru1 C2' . . 37.4(5) ?
C1' Ru1 C2' . . 38.4(5) ?
C4' Ru1 C2' . . 63.9(6) ?
N1 Ru1 C2 . . 124.5(4) ?
N3 Ru1 C2 . . 99.2(3) ?
N2 Ru1 C2 . . 150.5(4) ?
C3 Ru1 C2 . . 38.4(3) ?
N1 Ru1 C5 . . 100.1(3) ?
N3 Ru1 C5 . . 163.0(3) ?
N2 Ru1 C5 . . 119.2(3) ?
C3 Ru1 C5 . . 63.1(4) ?
C2 Ru1 C5 . . 63.9(4) ?
N1 Ru1 C4 . . 133.5(4) ?
N3 Ru1 C4 . . 138.3(4) ?
N2 Ru1 C4 . . 99.8(3) ?
C3 Ru1 C4 . . 37.7(3) ?
C2 Ru1 C4 . . 64.0(4) ?
C5 Ru1 C4 . . 37.8(3) ?

