############################################################################## ### CIF submission form for molecular structure report (Acta Cryst. C) ### ### Version: 2.0.2 (6 July 1998) ### ############################################################################## # This is an electronic "form" for submitting a structural paper to Acta Cryst. # Section C as a Crystallographic Information File. Full details of the format # of such files are given in the paper "The Crystallographic Information File # (CIF): a New Standard Archive File for Crystallography" by S. R. Hall, F. H. # Allen and I. D. Brown [Acta Cryst. (1991), A47, 655-685]. # # The current version of the core CIF dictionary is obtainable from # ftp://ftp.iucr.org/pub/cif_core.dic. The current version number is 2.0.1. # A few data names below appear in the 1998 Notes for Authors [Acta Cryst. # (1998), C54, 153-168] but are not yet in an approved dictionary; these # are indicated by the comment 'Not in version 2.0.1'. # # Note that all fields should be numeric or character type EXCEPT those which # are flagged as 'text' - free-form text of any length may be included in # these latter fields provided the text block begins and ends with a semicolon # as the first character of a new line. Note also that the query marks # '?' are significant as placeholders, and should not be deleted where a data # item is not given, UNLESS the accompanying data name is also deleted. # Lines should not exceed 80 characters in length. # # An example file derived from this form and annotated in the 1998 Notes for # Authors may be retrieved as ftp://ftp.iucr.org/pub/example.cif. #============================================================================== data_3 #============================================================================== # SUBMISSION DETAILS _publ_contact_author_name 'Dr. Zhiping Zheng' _publ_contact_author_address ; University of Arizona Department of Chemistry 1306 E. University Tucson, AZ 85721-0041 USA ; _publ_contact_author_email 'zhiping@u.arizona.edu' _publ_contact_author_fax '520-621-8407' _publ_contact_author_phone '520-626-6495' _publ_contact_letter ; Please consider this CIF for publication in. ; _publ_requested_journal ? _publ_requested_category ? # Acta C: one of CI/CM/CO/FI/FM/FO #============================================================================== # TITLE AND AUTHOR LIST _publ_section_title ; Hydrogen-Bonded Supramolecular Arrays of the [Re~6~(\m~3~-Se)~8~]^2+^ Core-Containing Clusters ; _publ_section_title_footnote ; ; # The loop structure below should contain the names and addresses of all # authors, in the required order of publication. Repeat as necessary. loop_ _publ_author_name _publ_author_footnote _publ_author_address 'Selby, Hugh D.' ; ? ; ; University of Arizona Department of Chemistry 1306 E. University Tucson, AZ 85721-0041 USA ; 'Roland, B. K.' ; ? ; ; University of Arizona Department of Chemistry 1306 E. University Tucson, AZ 85721-0041 USA ; 'Carducci, M. D.' ; ? ; ; University of Arizona Department of Chemistry 1306 E. University Tucson, AZ 85721-0041 USA ; 'Zheng, Zhiping' ; ; ; University of Arizona Department of Chemistry 1306 E. University Tucson, AZ 85721-0041 USA ; #============================================================================== # TEXT _publ_section_synopsis ; ? ; _publ_section_abstract ; ? ; _publ_section_comment ; ? ; _publ_section_acknowledgements ; This structure was determined in the Molecular Structure Laboratory of the Department of Chemistry, University of Arizona, Tucson AZ 85721. The SMART1000 diffractometer was gratefully obtained with funds provided by NSF grant CHE9610374. ; _publ_section_references ; ? ; _publ_section_figure_captions ; ? ; _publ_section_exptl_prep ; ? ; _publ_section_exptl_refinement ; ? ; # The following lines are used to test the character set of files sent by # network email or other means. They are not part of the CIF data set. # abcdefghijklmnopqrstuvwxyzABCDEFGHIJKLMNOPQRSTUVWXYZ0123456789 # !@#$%^&*()_+{}:"~<>?|\-=[];'`,./ #============================================================================== _audit_creation_method SHELXL-97 _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_melting_point ? _chemical_formula_structural ? _chemical_formula_analytical ? _chemical_formula_iupac ? _diffrn_measurement_specimen_support 'glass fiber' _chemical_formula_moiety ; (C36 H72 N4 O2 P4 Re6 Se8), 2(F6 Sb), 0.5(C H2 Cl2), 2(C4 H10 O) ; _chemical_formula_sum 'C44.50 H93 Cl F12 N4 O4 P4 Re6 Sb2 Se8' _chemical_formula_weight 3127.94 loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source 'C' 'C' 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'H' 'H' 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'N' 'N' 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'O' 'O' 0.0106 0.0060 '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' 'P' 'P' 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Se' 'Se' -0.0929 2.2259 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Sb' 'Sb' -0.5866 1.5461 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Re' 'Re' -1.0185 7.2310 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Cl' 'Cl' 0.1484 0.1585 '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_space_group_number 2 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, -y, -z' _cell_length_a 15.515(2) _cell_length_b 15.736(2) _cell_length_c 19.451(3) _cell_angle_alpha 75.958(2) _cell_angle_beta 69.934(2) _cell_angle_gamma 60.681(2) _cell_volume 3873.3(9) _cell_formula_units_Z 2 _cell_measurement_temperature 173(2) _cell_measurement_reflns_used 6029 _cell_measurement_theta_min 2.25 _cell_measurement_theta_max 25.00 _exptl_crystal_description plate _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 2.682 _exptl_crystal_density_method 'not measured' _exptl_crystal_F_000 2858 _exptl_absorpt_coefficient_mu 13.964 _exptl_absorpt_correction_type multi-scan _exptl_absorpt_correction_T_min 0.1666 _exptl_absorpt_correction_T_max 0.4013 _exptl_absorpt_process_details 'SADABS V2.03 (Sheldrick)' _exptl_special_details ; ? ; _diffrn_ambient_temperature 173(2) _diffrn_radiation_wavelength 0.71073 _diffrn_radiation_type MoK\a _diffrn_radiation_source 'fine-focus sealed tube' _diffrn_radiation_monochromator graphite _diffrn_measurement_device_type 'Bruker SMART1000 CCD Area Detector' _diffrn_measurement_method '\w scans' _diffrn_detector_area_resol_mean ? _diffrn_standards_number 145 _diffrn_standards_interval_count ? _diffrn_standards_interval_time 1080 _diffrn_standards_decay_% 0.11 _diffrn_reflns_number 19554 _diffrn_reflns_av_R_equivalents 0.0418 _diffrn_reflns_av_sigmaI/netI 0.1029 _diffrn_reflns_limit_h_min -18 _diffrn_reflns_limit_h_max 16 _diffrn_reflns_limit_k_min -18 _diffrn_reflns_limit_k_max 17 _diffrn_reflns_limit_l_min -23 _diffrn_reflns_limit_l_max 11 _diffrn_reflns_theta_min 1.12 _diffrn_reflns_theta_max 25.03 _reflns_number_total 13372 _reflns_number_gt 6663 _reflns_threshold_expression I>2sigma(I) _computing_data_collection 'Bruker SMART' _computing_cell_refinement 'Bruker SMART and SAINT' _computing_data_reduction 'Bruker SHELXTL' _computing_structure_solution 'Bruker SHELXTL' _computing_structure_refinement 'Bruker SHELXTL' _computing_molecular_graphics 'Bruker SHELXTL' _computing_publication_material 'Bruker SHELXTL' _refine_special_details ; After completing the initial structure solution it was found that 20% of the cell volume consisted of 2 solvent/anion voids in which the contents were severly disordered and could not be modeled well as discrete molecules. Analysis of these solvent voids using Platon (Spek, A.L. (1990), Acta Cryst. A46, C-34) gave a volume of 452 A^3 for each. From this point on, atoms in the region were removed and the solvent region was refined as a diffuse contribution without specific atom positions using the Platon module SQUEEZE (P. van der Sluis & A.L. Spek (1990). Acta Cryst. A46, 194-201). The removed portion of the initial model included a diethyl ether with O at 0.248423, -0.181829, 0.209722 and a 0.5 occupied SbF6 anion with Sb at 0.230287, -0.069173, 0.687883. Additional peaks near that Sb suggested a 0.5 occupied dichloromethane disordered at the same spot. The solvent/anion contribution amounted to 311 electrons per cell. The given electron count and volume can be accounted for by 1.0 SbF6- anion, 4.0 molecules of diethyl ether and 0.9 molecules of dichloromethane per unit cell, which maintains charge balance. While not part of the atom list, these are included in the formulas, F000, density and absorption coefficient. An improvement was observed in all refinement parameters and indices. Still a number of constraints and restraints were required to maintain chemically reasonable bond lengths and angles. The nicatinamide moieties were treated as overlapping, partially occupied, rigid bodies and bond length restraints were applied to the SBF6 anions. The triethyl phosphine ligands were restrained to have similar bond distances and angles to each other. An overall rigid bond restraint was applied to all atoms and an isotropic thermal parameter restraint was applied to all F and O atoms. Refinement of F^2^ against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F^2^, conventional R-factors R are based on F, with F set to zero for negative F^2^. The threshold expression of F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F^2^ 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/[\s^2^(Fo^2^)+(0.0622P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _atom_sites_solution_hydrogens geom _refine_ls_hydrogen_treatment mixed _refine_ls_extinction_method none _refine_ls_extinction_coef ? _refine_ls_number_reflns 13372 _refine_ls_number_parameters 709 _refine_ls_number_restraints 692 _refine_ls_R_factor_all 0.0981 _refine_ls_R_factor_gt 0.0528 _refine_ls_wR_factor_ref 0.1380 _refine_ls_wR_factor_gt 0.1265 _refine_ls_goodness_of_fit_ref 0.829 _refine_ls_restrained_S_all 0.852 _refine_ls_shift/su_max 0.002 _refine_ls_shift/su_mean 0.000 _diffrn_measured_fraction_theta_max 0.976 _diffrn_reflns_theta_full 25.03 _diffrn_measured_fraction_theta_full 0.976 _refine_diff_density_max 2.989 _refine_diff_density_min -2.133 _refine_diff_density_rms 0.301 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 Re1 Re 0.26422(4) 0.08874(4) 0.31530(3) 0.02144(16) Uani 1 1 d U . . Re4 Re 0.19859(5) 0.34554(4) 0.23417(3) 0.02359(17) Uani 1 1 d U . . Re2 Re 0.36743(4) 0.17940(4) 0.22286(3) 0.02272(17) Uani 1 1 d U . . Re3 Re 0.20674(5) 0.19063(4) 0.19657(3) 0.02158(16) Uani 1 1 d U . . Re6 Re 0.09395(4) 0.25408(4) 0.32696(3) 0.02245(16) Uani 1 1 d U . . Re5 Re 0.25580(5) 0.24212(5) 0.35348(4) 0.02450(17) Uani 1 1 d U . . Se7 Se 0.36989(11) 0.03343(11) 0.18903(9) 0.0262(4) Uani 1 1 d U . . Se8 Se 0.41676(11) 0.08349(11) 0.33814(9) 0.0276(4) Uani 1 1 d U . . Se9 Se 0.10950(11) 0.10358(11) 0.28918(9) 0.0259(4) Uani 1 1 d U . . Se10 Se 0.04626(11) 0.35069(11) 0.21102(9) 0.0273(4) Uani 1 1 d U . . Se11 Se 0.30737(12) 0.27880(11) 0.11159(9) 0.0275(4) Uani 1 1 d U . . Se12 Se 0.35435(12) 0.32773(12) 0.26084(10) 0.0317(4) Uani 1 1 d U . . Se13 Se 0.09333(12) 0.39960(11) 0.36053(9) 0.0304(4) Uani 1 1 d U . . Se14 Se 0.15442(12) 0.15448(11) 0.43792(9) 0.0271(4) Uani 1 1 d U . . N1 N 0.3073(6) -0.0620(5) 0.3645(5) 0.024(2) Uani 1 1 d GU A . C11 C 0.3270(7) -0.0875(6) 0.4331(5) 0.028(3) Uani 1 1 d GU . . H11A H 0.3137 -0.0383 0.4607 0.033 Uiso 1 1 calc R . . C12 C 0.3662(8) -0.1851(6) 0.4611(4) 0.034(4) Uani 1 1 d GU A . H12A H 0.3797 -0.2025 0.5080 0.041 Uiso 1 1 calc R . . C13 C 0.3857(8) -0.2572(5) 0.4207(5) 0.035(4) Uani 1 1 d GU . . C14 C 0.3659(8) -0.2317(6) 0.3522(5) 0.033(4) Uani 1 1 d GU A . H14A H 0.3792 -0.2810 0.3245 0.040 Uiso 1 1 calc R . . C15 C 0.3267(7) -0.1341(6) 0.3241(4) 0.033(4) Uani 1 1 d GU . . H15A H 0.3132 -0.1167 0.2773 0.039 Uiso 1 1 calc R A . C161 C 0.4352(14) -0.3629(12) 0.4551(10) 0.043(4) Uani 0.50 1 d PU A 1 O111 O 0.4128(10) -0.3785(8) 0.5208(8) 0.052(4) Uani 0.50 1 d PU A 1 N121 N 0.4957(10) -0.4329(9) 0.4090(8) 0.062(4) Uani 0.50 1 d PU A 1 H12B H 0.5217 -0.4948 0.4263 0.075 Uiso 0.50 1 calc PR A 1 H12C H 0.5096 -0.4170 0.3612 0.075 Uiso 0.50 1 calc PR A 1 C162 C 0.4352(14) -0.3629(12) 0.4551(10) 0.043(4) Uani 0.50 1 d PU A 2 N112 N 0.4128(10) -0.3785(8) 0.5208(8) 0.052(4) Uani 0.50 1 d PU A 2 H11B H 0.4365 -0.4390 0.5413 0.062 Uiso 0.50 1 calc PR A 2 H11C H 0.3726 -0.3294 0.5485 0.062 Uiso 0.50 1 calc PR A 2 O122 O 0.4957(10) -0.4329(9) 0.4090(8) 0.062(4) Uani 0.50 1 d PU A 2 N2 N 0.5292(5) 0.1363(6) 0.1617(5) 0.030(3) Uani 1 1 d GU B . C21 C 0.5999(7) 0.0408(6) 0.1759(5) 0.039(4) Uani 1 1 d GU . . H21A H 0.5773 -0.0041 0.2091 0.047 Uiso 1 1 calc R . . C22 C 0.7037(6) 0.0108(6) 0.1417(5) 0.035(3) Uani 1 1 d GU B . H22A H 0.7520 -0.0545 0.1514 0.042 Uiso 1 1 calc R . . C23 C 0.7368(5) 0.0764(7) 0.0931(5) 0.038(4) Uani 1 1 d GU . . C24 C 0.6660(7) 0.1719(7) 0.0789(5) 0.049(5) Uani 1 1 d GU B . H24A H 0.6887 0.2167 0.0457 0.059 Uiso 1 1 calc R . . C25 C 0.5623(6) 0.2019(5) 0.1132(5) 0.039(4) Uani 1 1 d GU . . H25A H 0.5139 0.2672 0.1034 0.047 Uiso 1 1 calc R B . C261 C 0.8529(8) 0.0463(12) 0.0522(9) 0.047(4) Uani 0.25 1 d PGDU B 3 N211 N 0.8734(14) 0.0698(17) -0.0105(9) 0.043(6) Uani 0.25 1 d PGDU B 3 H21B H 0.9375 0.0437 -0.0369 0.051 Uiso 0.25 1 calc PR B 3 H21C H 0.8248 0.1136 -0.0314 0.051 Uiso 0.25 1 calc PR B 3 O221 O 0.9146(16) -0.015(2) 0.0884(11) 0.067(9) Uani 0.25 1 d PGDU B 3 C262 C 0.8529(8) 0.0463(12) 0.0522(9) 0.047(4) Uani 0.25 1 d PDU B 4 N222 N 0.9146(16) -0.015(2) 0.0884(11) 0.067(9) Uani 0.25 1 d PDU B 4 H22B H 0.9804 -0.0447 0.0664 0.080 Uiso 0.25 1 calc PR B 4 H22C H 0.8921 -0.0283 0.1359 0.080 Uiso 0.25 1 calc PR B 4 O212 O 0.8734(14) 0.0698(17) -0.0105(9) 0.043(6) Uani 0.25 1 d PDU B 4 C263 C 0.8529(8) 0.0463(12) 0.0522(9) 0.047(4) Uani 0.25 1 d PDU B 1 N213 N 0.9041(16) -0.0402(12) 0.045(2) 0.085(14) Uani 0.25 1 d PDU B 1 H21D H 0.9696 -0.0628 0.0212 0.102 Uiso 0.25 1 calc PR B 1 H21E H 0.8760 -0.0805 0.0629 0.102 Uiso 0.25 1 calc PR B 1 O223 O 0.883(2) 0.1086(14) 0.030(3) 0.13(2) Uani 0.25 1 d PDU B 1 C264 C 0.8529(8) 0.0463(12) 0.0522(9) 0.047(4) Uani 0.25 1 d PDU B 2 N224 N 0.883(2) 0.1086(14) 0.030(3) 0.13(2) Uani 0.25 1 d PDU B 2 H22D H 0.9473 0.0924 0.0057 0.157 Uiso 0.25 1 calc PR B 2 H22E H 0.8399 0.1701 0.0378 0.157 Uiso 0.25 1 calc PR B 2 O214 O 0.9041(16) -0.0402(12) 0.045(2) 0.085(14) Uani 0.25 1 d PDU B 2 P3 P 0.1687(3) 0.1594(3) 0.0939(2) 0.0312(10) Uani 1 1 d DU . . C31 C 0.2757(10) 0.0572(11) 0.0414(9) 0.061(5) Uani 1 1 d DU . . H31A H 0.2992 -0.0011 0.0764 0.073 Uiso 1 1 calc R . . H31B H 0.2494 0.0418 0.0087 0.073 Uiso 1 1 calc R . . C34 C 0.3665(12) 0.0742(17) -0.0045(11) 0.100(9) Uani 1 1 d DU . . H34A H 0.4181 0.0164 -0.0307 0.151 Uiso 1 1 calc R . . H34B H 0.3959 0.0861 0.0273 0.151 Uiso 1 1 calc R . . H34C H 0.3449 0.1312 -0.0401 0.151 Uiso 1 1 calc R . . C32 C 0.0629(11) 0.1255(13) 0.1197(9) 0.061(5) Uani 1 1 d DU . . H32A H 0.0609 0.1060 0.0758 0.073 Uiso 1 1 calc R . . H32B H 0.0769 0.0679 0.1565 0.073 Uiso 1 1 calc R . . C35 C -0.0386(11) 0.2048(16) 0.1503(11) 0.079(7) Uani 1 1 d DU . . H35A H -0.0907 0.1811 0.1647 0.119 Uiso 1 1 calc R . . H35B H -0.0552 0.2605 0.1130 0.119 Uiso 1 1 calc R . . H35C H -0.0371 0.2253 0.1934 0.119 Uiso 1 1 calc R . . C33 C 0.1383(12) 0.2624(9) 0.0251(8) 0.039(4) Uani 1 1 d DU . . H33A H 0.0820 0.3207 0.0500 0.047 Uiso 1 1 calc R . . H33B H 0.1990 0.2753 0.0031 0.047 Uiso 1 1 calc R . . C36 C 0.1069(16) 0.2511(13) -0.0368(9) 0.065(6) Uani 1 1 d DU . . H36A H 0.0920 0.3107 -0.0707 0.097 Uiso 1 1 calc R . . H36B H 0.0455 0.2403 -0.0163 0.097 Uiso 1 1 calc R . . H36C H 0.1628 0.1951 -0.0633 0.097 Uiso 1 1 calc R . . P4 P 0.1499(3) 0.5179(3) 0.1837(2) 0.0331(10) Uani 1 1 d DU . . C41 C 0.0147(10) 0.6012(10) 0.2205(10) 0.053(5) Uani 1 1 d DU . . H41A H -0.0270 0.5846 0.2022 0.063 Uiso 1 1 calc R . . H41B H -0.0025 0.5872 0.2746 0.063 Uiso 1 1 calc R . . C44 C -0.0190(13) 0.7101(10) 0.2034(10) 0.050(5) Uani 1 1 d DU . . H44A H -0.0931 0.7454 0.2246 0.075 Uiso 1 1 calc R . . H44B H -0.0028 0.7260 0.1501 0.075 Uiso 1 1 calc R . . H44C H 0.0170 0.7294 0.2246 0.075 Uiso 1 1 calc R . . C42 C 0.1710(14) 0.5393(13) 0.0824(7) 0.056(5) Uani 1 1 d DU . . H42A H 0.1537 0.6092 0.0670 0.068 Uiso 1 1 calc R . . H42B H 0.2444 0.5003 0.0586 0.068 Uiso 1 1 calc R . . C45 C 0.1063(18) 0.5116(17) 0.0564(13) 0.109(10) Uani 1 1 d DU . . H45A H 0.1203 0.5234 0.0028 0.163 Uiso 1 1 calc R . . H45B H 0.0334 0.5514 0.0787 0.163 Uiso 1 1 calc R . . H45C H 0.1237 0.4422 0.0711 0.163 Uiso 1 1 calc R . . C43 C 0.2209(12) 0.5723(12) 0.1999(8) 0.040(4) Uani 1 1 d DU . . H43A H 0.2949 0.5313 0.1791 0.048 Uiso 1 1 calc R . . H43B H 0.2028 0.6374 0.1717 0.048 Uiso 1 1 calc R . . C46 C 0.2051(14) 0.5853(14) 0.2791(9) 0.058(6) Uani 1 1 d DU . . H46A H 0.2455 0.6170 0.2801 0.087 Uiso 1 1 calc R . . H46B H 0.2274 0.5211 0.3074 0.087 Uiso 1 1 calc R . . H46C H 0.1323 0.6261 0.3008 0.087 Uiso 1 1 calc R . . P5 P 0.2927(4) 0.2662(4) 0.4597(3) 0.0437(12) Uani 1 1 d DU . . C51 C 0.1882(12) 0.3617(13) 0.5198(10) 0.083(7) Uani 1 1 d DU . . H51A H 0.2154 0.3677 0.5566 0.100 Uiso 1 1 calc R . . H51B H 0.1654 0.4252 0.4896 0.100 Uiso 1 1 calc R . . C54 C 0.0967(12) 0.3416(14) 0.5595(10) 0.072(7) Uani 1 1 d DU . . H54A H 0.0402 0.3996 0.5834 0.108 Uiso 1 1 calc R . . H54B H 0.1153 0.2860 0.5966 0.108 Uiso 1 1 calc R . . H54C H 0.0751 0.3262 0.5241 0.108 Uiso 1 1 calc R . . C52 C 0.3298(18) 0.1566(12) 0.5249(11) 0.098(7) Uani 1 1 d DU . . H52A H 0.2720 0.1391 0.5440 0.117 Uiso 1 1 calc R . . H52B H 0.3885 0.1022 0.4970 0.117 Uiso 1 1 calc R . . C55 C 0.358(3) 0.161(3) 0.5889(13) 0.20(2) Uani 1 1 d DU . . H55A H 0.3760 0.0979 0.6187 0.305 Uiso 1 1 calc R . . H55B H 0.3001 0.2126 0.6187 0.305 Uiso 1 1 calc R . . H55C H 0.4172 0.1755 0.5715 0.305 Uiso 1 1 calc R . . C53 C 0.4007(15) 0.2959(19) 0.4354(12) 0.136(10) Uani 1 1 d DU . . H53A H 0.4326 0.2711 0.4769 0.163 Uiso 1 1 calc R . . H53B H 0.4527 0.2608 0.3924 0.163 Uiso 1 1 calc R . . C56 C 0.374(4) 0.401(3) 0.418(4) 0.45(4) Uani 1 1 d DU . . H56A H 0.4362 0.4100 0.4034 0.671 Uiso 1 1 calc R . . H56B H 0.3264 0.4363 0.4612 0.671 Uiso 1 1 calc R . . H56C H 0.3413 0.4271 0.3773 0.671 Uiso 1 1 calc R . . P6 P -0.0870(3) 0.3064(3) 0.3985(2) 0.0323(10) Uani 1 1 d DU . . C61 C -0.1119(11) 0.3459(13) 0.4898(7) 0.046(5) Uani 1 1 d DU . . H61A H -0.0621 0.2926 0.5157 0.055 Uiso 1 1 calc R . . H61B H -0.0987 0.4036 0.4810 0.055 Uiso 1 1 calc R . . C64 C -0.2182(11) 0.3714(14) 0.5395(9) 0.056(6) Uani 1 1 d DU . . H64A H -0.2232 0.3893 0.5861 0.084 Uiso 1 1 calc R . . H64B H -0.2324 0.3148 0.5490 0.084 Uiso 1 1 calc R . . H64C H -0.2682 0.4267 0.5159 0.084 Uiso 1 1 calc R . . C62 C -0.1322(12) 0.2127(10) 0.4211(9) 0.043(4) Uani 1 1 d DU . . H62A H -0.2074 0.2443 0.4425 0.052 Uiso 1 1 calc R . . H62B H -0.1191 0.1873 0.3748 0.052 Uiso 1 1 calc R . . C65 C -0.0854(14) 0.1275(12) 0.4734(11) 0.064(6) Uani 1 1 d DU . . H65A H -0.1145 0.0818 0.4815 0.096 Uiso 1 1 calc R . . H65B H -0.0999 0.1509 0.5203 0.096 Uiso 1 1 calc R . . H65C H -0.0110 0.0940 0.4525 0.096 Uiso 1 1 calc R . . C63 C -0.1819(12) 0.4136(11) 0.3589(9) 0.058(5) Uani 1 1 d DU . . H63A H -0.2415 0.4476 0.3993 0.069 Uiso 1 1 calc R . . H63B H -0.1518 0.4591 0.3324 0.069 Uiso 1 1 calc R . . C66 C -0.2193(16) 0.3912(18) 0.3065(12) 0.104(9) Uani 1 1 d DU . . H66A H -0.2716 0.4520 0.2890 0.156 Uiso 1 1 calc R . . H66B H -0.2491 0.3459 0.3320 0.156 Uiso 1 1 calc R . . H66C H -0.1617 0.3612 0.2646 0.156 Uiso 1 1 calc R . . Sb1 Sb -0.5000 -0.5000 1.0000 0.0487(5) Uani 1 2 d SDU . . F11 F -0.6179(8) -0.3873(7) 1.0224(8) 0.093(4) Uani 1 1 d DU C . F12 F -0.550(2) -0.5634(18) 1.0869(13) 0.081(8) Uani 0.50 1 d PDU C 1 F13 F -0.4245(17) -0.480(2) 1.0476(15) 0.088(8) Uani 0.50 1 d PDU C 1 F14 F -0.506(2) -0.532(3) 1.0980(10) 0.124(12) Uani 0.50 1 d PDU C 2 F15 F -0.564(2) -0.5794(18) 1.017(2) 0.112(10) Uani 0.50 1 d PDU C 2 Sb21 Sb 0.3279(3) -0.7080(3) 0.7627(2) 0.0687(11) Uani 0.50 1 d PDU D 1 F211 F 0.402(3) -0.634(3) 0.7340(19) 0.110(10) Uani 0.50 1 d PDU D 1 F213 F 0.263(2) -0.789(2) 0.7750(15) 0.086(8) Uani 0.50 1 d PDU D 1 F216 F 0.4505(16) -0.8203(16) 0.730(2) 0.122(11) Uani 0.50 1 d PDU D 1 F214 F 0.349(3) -0.746(3) 0.8563(11) 0.122(11) Uani 0.50 1 d PDU D 1 F215 F 0.202(2) -0.602(3) 0.799(3) 0.158(13) Uani 0.50 1 d PDU D 1 F212 F 0.288(5) -0.662(2) 0.6729(19) 0.160(15) Uani 0.50 1 d PDU D 1 Sb22 Sb 0.3328(3) -0.7435(4) 0.7300(3) 0.0858(13) Uani 0.50 1 d PDU E 2 F221 F 0.388(4) -0.661(3) 0.731(3) 0.160(15) Uani 0.50 1 d PDU E 2 F223 F 0.264(4) -0.812(4) 0.730(4) 0.27(2) Uani 0.50 1 d PDU E 2 F226 F 0.444(3) -0.830(4) 0.667(3) 0.28(2) Uani 0.50 1 d PDU E 2 F224 F 0.362(4) -0.808(3) 0.8203(19) 0.208(18) Uani 0.50 1 d PDU E 2 F225 F 0.224(3) -0.645(4) 0.789(4) 0.26(2) Uani 0.50 1 d PDU E 2 F222 F 0.321(6) -0.660(6) 0.641(3) 0.31(3) Uani 0.50 1 d PDU E 2 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 Re1 0.0221(4) 0.0224(3) 0.0166(4) -0.0032(3) -0.0065(3) -0.0060(3) Re4 0.0245(4) 0.0222(4) 0.0202(4) -0.0035(3) -0.0062(3) -0.0066(3) Re2 0.0207(4) 0.0253(4) 0.0191(4) -0.0043(3) -0.0054(3) -0.0069(3) Re3 0.0214(3) 0.0232(4) 0.0165(4) -0.0034(3) -0.0067(3) -0.0055(3) Re6 0.0216(4) 0.0234(4) 0.0178(4) -0.0040(3) -0.0050(3) -0.0059(3) Re5 0.0252(4) 0.0269(4) 0.0200(4) -0.0061(3) -0.0074(3) -0.0079(3) Se7 0.0254(9) 0.0262(8) 0.0219(9) -0.0064(7) -0.0072(7) -0.0051(7) Se8 0.0245(9) 0.0316(9) 0.0244(10) -0.0038(8) -0.0097(7) -0.0081(8) Se9 0.0247(9) 0.0270(9) 0.0262(10) -0.0045(7) -0.0077(7) -0.0100(7) Se10 0.0247(9) 0.0254(9) 0.0267(10) -0.0031(7) -0.0100(7) -0.0049(7) Se11 0.0262(9) 0.0301(9) 0.0203(9) -0.0022(7) -0.0051(7) -0.0089(8) Se12 0.0315(9) 0.0345(10) 0.0337(11) -0.0063(8) -0.0102(8) -0.0159(8) Se13 0.0323(9) 0.0276(9) 0.0252(10) -0.0084(8) -0.0054(8) -0.0077(8) Se14 0.0287(9) 0.0303(9) 0.0160(9) -0.0049(7) -0.0044(7) -0.0081(8) N1 0.018(6) 0.025(4) 0.024(6) -0.001(4) -0.005(5) -0.008(4) C11 0.026(9) 0.033(6) 0.022(8) -0.003(6) -0.005(7) -0.012(7) C12 0.064(12) 0.037(6) 0.014(8) 0.008(6) -0.007(8) -0.038(9) C13 0.050(11) 0.026(6) 0.026(8) -0.001(5) -0.011(8) -0.016(7) C14 0.045(10) 0.029(6) 0.017(8) 0.000(6) 0.004(7) -0.019(8) C15 0.039(10) 0.025(6) 0.030(9) -0.003(6) -0.012(8) -0.010(8) C161 0.052(12) 0.033(6) 0.034(7) -0.004(6) -0.015(8) -0.009(8) O111 0.060(9) 0.020(7) 0.034(6) 0.002(5) -0.016(7) 0.013(6) N121 0.066(10) 0.036(7) 0.042(8) -0.006(7) -0.006(7) 0.005(7) C162 0.052(12) 0.033(6) 0.034(7) -0.004(6) -0.015(8) -0.009(8) N112 0.060(9) 0.020(7) 0.034(6) 0.002(5) -0.016(7) 0.013(6) O122 0.066(10) 0.036(7) 0.042(8) -0.006(7) -0.006(7) 0.005(7) N2 0.023(4) 0.037(6) 0.029(6) -0.005(5) -0.013(4) -0.007(4) C21 0.025(6) 0.024(7) 0.050(12) -0.014(7) -0.010(7) 0.008(6) C22 0.034(7) 0.038(8) 0.034(10) -0.018(7) -0.012(7) -0.009(6) C23 0.037(6) 0.050(8) 0.031(10) -0.028(7) 0.001(6) -0.018(6) C24 0.030(6) 0.066(9) 0.046(13) 0.007(9) -0.011(8) -0.021(6) C25 0.031(7) 0.043(9) 0.036(11) -0.005(7) -0.004(7) -0.015(7) C261 0.031(6) 0.066(10) 0.057(10) -0.036(9) -0.009(6) -0.020(6) N211 0.015(11) 0.073(17) 0.045(9) -0.054(11) 0.002(8) -0.008(11) O221 0.039(11) 0.08(2) 0.059(18) -0.032(15) -0.006(13) -0.009(14) C262 0.031(6) 0.066(10) 0.057(10) -0.036(9) -0.009(6) -0.020(6) N222 0.039(11) 0.08(2) 0.059(18) -0.032(15) -0.006(13) -0.009(14) O212 0.015(11) 0.073(17) 0.045(9) -0.054(11) 0.002(8) -0.008(11) C263 0.031(6) 0.066(10) 0.057(10) -0.036(9) -0.009(6) -0.020(6) N213 0.035(12) 0.076(14) 0.16(4) -0.08(3) 0.02(2) -0.033(12) O223 0.031(17) 0.059(17) 0.24(5) -0.05(3) 0.05(3) -0.013(15) C264 0.031(6) 0.066(10) 0.057(10) -0.036(9) -0.009(6) -0.020(6) N224 0.031(17) 0.059(17) 0.24(5) -0.05(3) 0.05(3) -0.013(15) O214 0.035(12) 0.076(14) 0.16(4) -0.08(3) 0.02(2) -0.033(12) P3 0.030(2) 0.037(3) 0.025(2) -0.007(2) -0.0137(19) -0.007(2) C31 0.048(9) 0.051(10) 0.072(15) -0.044(10) -0.046(8) 0.024(8) C34 0.029(10) 0.15(2) 0.09(2) -0.085(18) -0.013(9) 0.010(12) C32 0.074(10) 0.109(16) 0.027(11) 0.002(10) -0.019(9) -0.062(11) C35 0.049(8) 0.18(2) 0.044(14) -0.027(15) -0.009(10) -0.068(12) C33 0.051(11) 0.034(8) 0.033(10) 0.000(6) -0.025(9) -0.012(8) C36 0.130(19) 0.042(11) 0.030(12) 0.010(8) -0.049(12) -0.032(13) P4 0.041(3) 0.027(2) 0.029(3) 0.0000(19) -0.011(2) -0.013(2) C41 0.037(7) 0.029(7) 0.074(14) -0.024(10) -0.008(8) 0.004(7) C44 0.054(11) 0.032(7) 0.054(14) -0.010(9) -0.020(10) -0.006(7) C42 0.086(15) 0.040(10) 0.028(7) 0.005(7) -0.011(8) -0.024(11) C45 0.14(2) 0.10(2) 0.086(19) -0.040(17) -0.063(18) -0.012(17) C43 0.049(10) 0.044(9) 0.026(9) 0.004(9) -0.002(8) -0.029(9) C46 0.075(14) 0.075(14) 0.041(11) -0.010(11) -0.022(11) -0.040(12) P5 0.048(3) 0.062(3) 0.028(3) -0.019(2) -0.011(2) -0.022(3) C51 0.071(12) 0.101(14) 0.058(16) -0.057(13) -0.023(10) 0.002(11) C54 0.050(10) 0.084(15) 0.045(14) -0.055(13) -0.017(8) 0.021(11) C52 0.12(2) 0.095(12) 0.076(17) 0.006(10) -0.078(16) -0.023(13) C55 0.23(4) 0.42(6) 0.036(19) 0.06(2) -0.07(2) -0.22(4) C53 0.127(17) 0.31(3) 0.062(18) -0.069(19) 0.012(14) -0.17(2) C56 0.65(4) 0.46(2) 0.55(11) 0.18(7) -0.26(8) -0.515 P6 0.027(2) 0.034(2) 0.027(3) -0.006(2) -0.0011(19) -0.009(2) C61 0.046(10) 0.081(14) 0.026(8) -0.024(8) 0.006(6) -0.042(11) C64 0.043(10) 0.087(15) 0.041(12) -0.040(12) 0.010(8) -0.028(11) C62 0.040(10) 0.045(9) 0.052(13) -0.023(7) 0.003(8) -0.026(9) C65 0.066(14) 0.064(12) 0.084(18) 0.005(10) -0.018(11) -0.051(12) C63 0.026(8) 0.064(10) 0.039(11) 0.009(9) -0.003(8) 0.002(8) C66 0.066(16) 0.13(2) 0.08(2) -0.019(16) -0.036(13) -0.002(15) Sb1 0.0539(12) 0.0451(11) 0.0358(12) 0.0005(9) 0.0003(9) -0.0234(10) F11 0.078(8) 0.048(6) 0.097(11) 0.004(6) -0.001(7) -0.006(6) F12 0.09(2) 0.054(12) 0.069(17) 0.013(12) 0.005(15) -0.037(13) F13 0.078(14) 0.12(2) 0.08(2) -0.042(18) 0.005(13) -0.058(14) F14 0.07(2) 0.20(3) 0.033(10) -0.002(17) -0.014(13) -0.014(19) F15 0.11(2) 0.071(13) 0.16(3) 0.03(2) -0.05(2) -0.058(15) Sb21 0.064(2) 0.069(3) 0.062(3) 0.001(2) -0.014(2) -0.025(2) F211 0.13(2) 0.13(2) 0.08(2) -0.018(18) 0.029(18) -0.091(19) F213 0.075(15) 0.13(2) 0.061(18) 0.017(15) -0.001(14) -0.072(16) F216 0.046(11) 0.081(13) 0.16(3) -0.008(17) 0.040(16) -0.015(9) F214 0.12(2) 0.21(3) 0.065(13) 0.037(15) -0.035(14) -0.11(2) F215 0.072(16) 0.10(2) 0.23(3) -0.03(2) 0.00(2) 0.000(11) F212 0.34(4) 0.063(17) 0.14(2) 0.080(16) -0.17(3) -0.11(2) Sb22 0.073(3) 0.094(4) 0.074(3) 0.006(2) -0.018(2) -0.033(3) F221 0.17(3) 0.15(3) 0.18(4) 0.10(2) -0.06(3) -0.14(3) F223 0.18(3) 0.39(5) 0.37(6) -0.04(4) -0.05(4) -0.22(4) F226 0.13(3) 0.30(4) 0.31(4) -0.16(3) 0.12(3) -0.07(3) F224 0.31(5) 0.16(3) 0.18(3) 0.15(3) -0.14(3) -0.16(3) F225 0.04(2) 0.22(4) 0.35(5) -0.10(3) 0.05(3) 0.043(19) F222 0.33(6) 0.42(5) 0.19(3) 0.20(3) -0.19(4) -0.20(4) _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 Re1 N1 2.186(6) . ? Re1 Se9 2.5111(16) . ? Re1 Se8 2.5135(16) . ? Re1 Se14 2.5188(16) . ? Re1 Se7 2.5210(17) . ? Re1 Re2 2.6172(9) . ? Re1 Re5 2.6247(9) . ? Re1 Re3 2.6298(10) . ? Re1 Re6 2.6351(9) . ? Re4 P4 2.470(4) . ? Re4 Se12 2.5128(17) . ? Re4 Se10 2.5139(16) . ? Re4 Se13 2.5163(17) . ? Re4 Se11 2.5208(17) . ? Re4 Re2 2.6310(9) . ? Re4 Re6 2.6424(9) . ? Re4 Re5 2.6435(10) . ? Re4 Re3 2.6445(9) . ? Re2 N2 2.202(7) . ? Re2 Se8 2.5094(18) . ? Re2 Se12 2.5110(16) . ? Re2 Se11 2.5124(18) . ? Re2 Se7 2.5182(16) . ? Re2 Re3 2.6282(9) . ? Re2 Re5 2.6368(9) . ? Re3 P3 2.480(4) . ? Re3 Se11 2.5166(17) . ? Re3 Se7 2.5174(16) . ? Re3 Se10 2.5188(16) . ? Re3 Se9 2.5217(17) . ? Re3 Re6 2.6389(9) . ? Re6 P6 2.471(4) . ? Re6 Se14 2.5107(18) . ? Re6 Se10 2.5148(18) . ? Re6 Se9 2.5238(15) . ? Re6 Se13 2.5241(16) . ? Re6 Re5 2.6433(9) . ? Re5 P5 2.479(4) . ? Re5 Se8 2.5105(16) . ? Re5 Se13 2.5148(17) . ? Re5 Se14 2.5153(17) . ? Re5 Se12 2.5195(18) . ? N1 C11 1.3900 . ? N1 C15 1.3900 . ? C11 C12 1.3900 . ? C11 H11A 0.9500 . ? C12 C13 1.3900 . ? C12 H12A 0.9500 . ? C13 C14 1.3900 . ? C13 C161 1.539(18) . ? C14 C15 1.3900 . ? C14 H14A 0.9500 . ? C15 H15A 0.9500 . ? C161 O111 1.20(2) . ? C161 N121 1.338(18) . ? N121 H12B 0.8800 . ? N121 H12C 0.8800 . ? N2 C21 1.3900 . ? N2 C25 1.3900 . ? C21 C22 1.3900 . ? C21 H21A 0.9500 . ? C22 C23 1.3900 . ? C22 H22A 0.9500 . ? C23 C24 1.3900 . ? C23 C261 1.570(12) . ? C24 C25 1.3900 . ? C24 H24A 0.9500 . ? C25 H25A 0.9500 . ? C261 N211 1.1641 . ? C261 O221 1.2534 . ? N211 H21B 0.8800 . ? N211 H21C 0.8800 . ? N213 H21D 0.8800 . ? N213 H21E 0.8800 . ? P3 C33 1.809(12) . ? P3 C32 1.842(13) . ? P3 C31 1.845(12) . ? C31 C34 1.497(17) . ? C31 H31A 0.9900 . ? C31 H31B 0.9900 . ? C34 H34A 0.9800 . ? C34 H34B 0.9800 . ? C34 H34C 0.9800 . ? C32 C35 1.477(16) . ? C32 H32A 0.9900 . ? C32 H32B 0.9900 . ? C35 H35A 0.9800 . ? C35 H35B 0.9800 . ? C35 H35C 0.9800 . ? C33 C36 1.520(15) . ? C33 H33A 0.9900 . ? C33 H33B 0.9900 . ? C36 H36A 0.9800 . ? C36 H36B 0.9800 . ? C36 H36C 0.9800 . ? P4 C43 1.826(12) . ? P4 C41 1.834(12) . ? P4 C42 1.856(13) . ? C41 C44 1.512(15) . ? C41 H41A 0.9900 . ? C41 H41B 0.9900 . ? C44 H44A 0.9800 . ? C44 H44B 0.9800 . ? C44 H44C 0.9800 . ? C42 C45 1.529(17) . ? C42 H42A 0.9900 . ? C42 H42B 0.9900 . ? C45 H45A 0.9800 . ? C45 H45B 0.9800 . ? C45 H45C 0.9800 . ? C43 C46 1.524(15) . ? C43 H43A 0.9900 . ? C43 H43B 0.9900 . ? C46 H46A 0.9800 . ? C46 H46B 0.9800 . ? C46 H46C 0.9800 . ? P5 C53 1.834(14) . ? P5 C52 1.840(14) . ? P5 C51 1.849(13) . ? C51 C54 1.510(16) . ? C51 H51A 0.9900 . ? C51 H51B 0.9900 . ? C54 H54A 0.9800 . ? C54 H54B 0.9800 . ? C54 H54C 0.9800 . ? C52 C55 1.481(17) . ? C52 H52A 0.9900 . ? C52 H52B 0.9900 . ? C55 H55A 0.9800 . ? C55 H55B 0.9800 . ? C55 H55C 0.9800 . ? C53 C56 1.48(2) . ? C53 H53A 0.9900 . ? C53 H53B 0.9900 . ? C56 H56A 0.9800 . ? C56 H56B 0.9800 . ? C56 H56C 0.9800 . ? P6 C63 1.823(13) . ? P6 C62 1.829(12) . ? P6 C61 1.877(12) . ? C61 C64 1.504(14) . ? C61 H61A 0.9900 . ? C61 H61B 0.9900 . ? C64 H64A 0.9800 . ? C64 H64B 0.9800 . ? C64 H64C 0.9800 . ? C62 C65 1.501(16) . ? C62 H62A 0.9900 . ? C62 H62B 0.9900 . ? C65 H65A 0.9800 . ? C65 H65B 0.9800 . ? C65 H65C 0.9800 . ? C63 C66 1.509(17) . ? C63 H63A 0.9900 . ? C63 H63B 0.9900 . ? C66 H66A 0.9800 . ? C66 H66B 0.9800 . ? C66 H66C 0.9800 . ? Sb1 F11 1.825(10) 2_447 ? Sb1 F11 1.825(10) . ? Sb1 F14 1.831(17) 2_447 ? Sb1 F14 1.831(17) . ? Sb1 F15 1.856(16) . ? Sb1 F15 1.856(16) 2_447 ? Sb1 F12 1.872(16) 2_447 ? Sb1 F12 1.872(16) . ? Sb1 F13 1.894(16) 2_447 ? Sb1 F13 1.894(16) . ? Sb21 F214 1.863(17) . ? Sb21 F215 1.881(18) . ? Sb21 F211 1.889(17) . ? Sb21 F216 1.890(16) . ? Sb21 F213 1.902(17) . ? Sb21 F212 1.908(18) . ? Sb22 F226 1.845(19) . ? Sb22 F223 1.855(19) . ? Sb22 F221 1.880(18) . ? Sb22 F224 1.884(19) . ? Sb22 F225 1.886(19) . ? Sb22 F222 1.90(2) . ? loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle_publ_flag N1 Re1 Se9 93.5(2) . . ? N1 Re1 Se8 89.7(2) . . ? Se9 Re1 Se8 176.79(6) . . ? N1 Re1 Se14 91.4(2) . . ? Se9 Re1 Se14 89.56(5) . . ? Se8 Re1 Se14 90.45(5) . . ? N1 Re1 Se7 92.0(2) . . ? Se9 Re1 Se7 89.77(5) . . ? Se8 Re1 Se7 90.03(5) . . ? Se14 Re1 Se7 176.53(6) . . ? N1 Re1 Re2 133.7(2) . . ? Se9 Re1 Re2 118.81(5) . . ? Se8 Re1 Re2 58.52(4) . . ? Se14 Re1 Re2 118.88(4) . . ? Se7 Re1 Re2 58.66(4) . . ? N1 Re1 Re5 132.9(2) . . ? Se9 Re1 Re5 119.01(4) . . ? Se8 Re1 Re5 58.45(4) . . ? Se14 Re1 Re5 58.51(4) . . ? Se7 Re1 Re5 119.05(4) . . ? Re2 Re1 Re5 60.40(2) . . ? N1 Re1 Re3 136.5(2) . . ? Se9 Re1 Re3 58.69(4) . . ? Se8 Re1 Re3 118.63(5) . . ? Se14 Re1 Re3 118.41(5) . . ? Se7 Re1 Re3 58.47(4) . . ? Re2 Re1 Re3 60.12(3) . . ? Re5 Re1 Re3 90.60(3) . . ? N1 Re1 Re6 136.0(2) . . ? Se9 Re1 Re6 58.68(4) . . ? Se8 Re1 Re6 118.77(4) . . ? Se14 Re1 Re6 58.25(4) . . ? Se7 Re1 Re6 118.63(5) . . ? Re2 Re1 Re6 90.28(3) . . ? Re5 Re1 Re6 60.34(2) . . ? Re3 Re1 Re6 60.16(2) . . ? P4 Re4 Se12 92.96(11) . . ? P4 Re4 Se10 91.17(11) . . ? Se12 Re4 Se10 175.88(6) . . ? P4 Re4 Se13 90.26(11) . . ? Se12 Re4 Se13 89.93(6) . . ? Se10 Re4 Se13 90.12(5) . . ? P4 Re4 Se11 93.89(11) . . ? Se12 Re4 Se11 89.86(6) . . ? Se10 Re4 Se11 89.80(5) . . ? Se13 Re4 Se11 175.86(6) . . ? P4 Re4 Re2 137.01(11) . . ? Se12 Re4 Re2 58.39(4) . . ? Se10 Re4 Re2 118.14(4) . . ? Se13 Re4 Re2 118.25(5) . . ? Se11 Re4 Re2 58.33(4) . . ? P4 Re4 Re6 133.16(11) . . ? Se12 Re4 Re6 118.43(5) . . ? Se10 Re4 Re6 58.32(4) . . ? Se13 Re4 Re6 58.53(4) . . ? Se11 Re4 Re6 118.13(4) . . ? Re2 Re4 Re6 89.82(3) . . ? P4 Re4 Re5 134.38(10) . . ? Se12 Re4 Re5 58.44(4) . . ? Se10 Re4 Re5 118.31(5) . . ? Se13 Re4 Re5 58.27(4) . . ? Se11 Re4 Re5 118.30(5) . . ? Re2 Re4 Re5 59.99(2) . . ? Re6 Re4 Re5 60.01(3) . . ? P4 Re4 Re3 135.69(10) . . ? Se12 Re4 Re3 118.13(4) . . ? Se10 Re4 Re3 58.39(4) . . ? Se13 Re4 Re3 118.39(4) . . ? Se11 Re4 Re3 58.26(4) . . ? Re2 Re4 Re3 59.76(2) . . ? Re6 Re4 Re3 59.89(2) . . ? Re5 Re4 Re3 89.87(3) . . ? N2 Re2 Se8 91.5(2) . . ? N2 Re2 Se12 91.2(2) . . ? Se8 Re2 Se12 89.63(6) . . ? N2 Re2 Se11 91.8(2) . . ? Se8 Re2 Se11 176.69(6) . . ? Se12 Re2 Se11 90.09(6) . . ? N2 Re2 Se7 92.2(2) . . ? Se8 Re2 Se7 90.19(5) . . ? Se12 Re2 Se7 176.67(6) . . ? Se11 Re2 Se7 89.90(5) . . ? N2 Re2 Re1 135.3(2) . . ? Se8 Re2 Re1 58.67(4) . . ? Se12 Re2 Re1 118.48(5) . . ? Se11 Re2 Re1 118.74(4) . . ? Se7 Re2 Re1 58.76(4) . . ? N2 Re2 Re3 135.3(2) . . ? Se8 Re2 Re3 118.84(4) . . ? Se12 Re2 Re3 118.82(4) . . ? Se11 Re2 Re3 58.57(4) . . ? Se7 Re2 Re3 58.52(4) . . ? Re1 Re2 Re3 60.18(2) . . ? N2 Re2 Re4 134.5(2) . . ? Se8 Re2 Re4 118.57(4) . . ? Se12 Re2 Re4 58.45(4) . . ? Se11 Re2 Re4 58.64(4) . . ? Se7 Re2 Re4 118.89(4) . . ? Re1 Re2 Re4 90.27(3) . . ? Re3 Re2 Re4 60.38(2) . . ? N2 Re2 Re5 134.4(2) . . ? Se8 Re2 Re5 58.33(4) . . ? Se12 Re2 Re5 58.55(4) . . ? Se11 Re2 Re5 118.87(4) . . ? Se7 Re2 Re5 118.70(5) . . ? Re1 Re2 Re5 59.94(2) . . ? Re3 Re2 Re5 90.37(3) . . ? Re4 Re2 Re5 60.24(2) . . ? P3 Re3 Se11 92.67(11) . . ? P3 Re3 Se7 93.38(10) . . ? Se11 Re3 Se7 89.82(5) . . ? P3 Re3 Se10 90.58(10) . . ? Se11 Re3 Se10 89.78(6) . . ? Se7 Re3 Se10 176.03(6) . . ? P3 Re3 Se9 91.43(11) . . ? Se11 Re3 Se9 175.89(6) . . ? Se7 Re3 Se9 89.61(6) . . ? Se10 Re3 Se9 90.50(5) . . ? P3 Re3 Re2 136.70(10) . . ? Se11 Re3 Re2 58.41(4) . . ? Se7 Re3 Re2 58.55(4) . . ? Se10 Re3 Re2 118.06(4) . . ? Se9 Re3 Re2 118.00(5) . . ? P3 Re3 Re1 135.85(11) . . ? Se11 Re3 Re1 118.10(5) . . ? Se7 Re3 Re1 58.60(4) . . ? Se10 Re3 Re1 118.30(5) . . ? Se9 Re3 Re1 58.30(4) . . ? Re2 Re3 Re1 59.70(2) . . ? P3 Re3 Re6 133.33(10) . . ? Se11 Re3 Re6 118.42(4) . . ? Se7 Re3 Re6 118.62(5) . . ? Se10 Re3 Re6 58.31(4) . . ? Se9 Re3 Re6 58.51(4) . . ? Re2 Re3 Re6 89.96(3) . . ? Re1 Re3 Re6 60.02(2) . . ? P3 Re3 Re4 134.41(11) . . ? Se11 Re3 Re4 58.41(4) . . ? Se7 Re3 Re4 118.41(4) . . ? Se10 Re3 Re4 58.21(4) . . ? Se9 Re3 Re4 118.49(4) . . ? Re2 Re3 Re4 59.86(2) . . ? Re1 Re3 Re4 89.70(3) . . ? Re6 Re3 Re4 60.02(2) . . ? P6 Re6 Se14 91.09(11) . . ? P6 Re6 Se10 92.91(11) . . ? Se14 Re6 Se10 175.99(6) . . ? P6 Re6 Se9 93.84(10) . . ? Se14 Re6 Se9 89.45(5) . . ? Se10 Re6 Se9 90.54(5) . . ? P6 Re6 Se13 90.58(10) . . ? Se14 Re6 Se13 89.77(6) . . ? Se10 Re6 Se13 89.92(6) . . ? Se9 Re6 Se13 175.52(5) . . ? P6 Re6 Re1 135.89(11) . . ? Se14 Re6 Re1 58.55(4) . . ? Se10 Re6 Re1 118.25(4) . . ? Se9 Re6 Re1 58.21(4) . . ? Se13 Re6 Re1 117.80(5) . . ? P6 Re6 Re3 136.75(10) . . ? Se14 Re6 Re3 118.37(4) . . ? Se10 Re6 Re3 58.46(4) . . ? Se9 Re6 Re3 58.43(4) . . ? Se13 Re6 Re3 118.32(5) . . ? Re1 Re6 Re3 59.82(2) . . ? P6 Re6 Re4 134.42(10) . . ? Se14 Re6 Re4 118.36(5) . . ? Se10 Re6 Re4 58.29(4) . . ? Se9 Re6 Re4 118.50(4) . . ? Se13 Re6 Re4 58.24(4) . . ? Re1 Re6 Re4 89.63(3) . . ? Re3 Re6 Re4 60.10(2) . . ? P6 Re6 Re5 133.25(10) . . ? Se14 Re6 Re5 58.36(4) . . ? Se10 Re6 Re5 118.29(4) . . ? Se9 Re6 Re5 117.84(4) . . ? Se13 Re6 Re5 58.19(4) . . ? Re1 Re6 Re5 59.64(2) . . ? Re3 Re6 Re5 90.00(3) . . ? Re4 Re6 Re5 60.02(3) . . ? P5 Re5 Se8 89.41(12) . . ? P5 Re5 Se13 94.59(12) . . ? Se8 Re5 Se13 175.97(6) . . ? P5 Re5 Se14 90.40(12) . . ? Se8 Re5 Se14 90.59(6) . . ? Se13 Re5 Se14 89.88(6) . . ? P5 Re5 Se12 93.98(12) . . ? Se8 Re5 Se12 89.41(6) . . ? Se13 Re5 Se12 89.81(6) . . ? Se14 Re5 Se12 175.62(6) . . ? P5 Re5 Re1 132.07(13) . . ? Se8 Re5 Re1 58.56(4) . . ? Se13 Re5 Re1 118.54(4) . . ? Se14 Re5 Re1 58.64(4) . . ? Se12 Re5 Re1 117.88(4) . . ? P5 Re5 Re2 134.56(11) . . ? Se8 Re5 Re2 58.29(4) . . ? Se13 Re5 Re2 118.09(5) . . ? Se14 Re5 Re2 118.27(4) . . ? Se12 Re5 Re2 58.23(4) . . ? Re1 Re5 Re2 59.66(2) . . ? P5 Re5 Re6 135.60(11) . . ? Se8 Re5 Re6 118.57(4) . . ? Se13 Re5 Re6 58.53(4) . . ? Se14 Re5 Re6 58.18(4) . . ? Se12 Re5 Re6 118.14(5) . . ? Re1 Re5 Re6 60.03(2) . . ? Re2 Re5 Re6 89.68(3) . . ? P5 Re5 Re4 138.09(12) . . ? Se8 Re5 Re4 118.06(5) . . ? Se13 Re5 Re4 58.33(4) . . ? Se14 Re5 Re4 118.15(5) . . ? Se12 Re5 Re4 58.19(4) . . ? Re1 Re5 Re4 89.83(3) . . ? Re2 Re5 Re4 59.77(3) . . ? Re6 Re5 Re4 59.97(2) . . ? Re3 Se7 Re2 62.92(4) . . ? Re3 Se7 Re1 62.93(4) . . ? Re2 Se7 Re1 62.58(4) . . ? Re2 Se8 Re5 63.37(4) . . ? Re2 Se8 Re1 62.81(4) . . ? Re5 Se8 Re1 62.99(4) . . ? Re1 Se9 Re3 63.00(4) . . ? Re1 Se9 Re6 63.12(4) . . ? Re3 Se9 Re6 63.07(4) . . ? Re4 Se10 Re6 63.40(4) . . ? Re4 Se10 Re3 63.40(4) . . ? Re6 Se10 Re3 63.24(4) . . ? Re2 Se11 Re3 63.02(4) . . ? Re2 Se11 Re4 63.03(4) . . ? Re3 Se11 Re4 63.33(4) . . ? Re2 Se12 Re4 63.16(4) . . ? Re2 Se12 Re5 63.22(4) . . ? Re4 Se12 Re5 63.38(4) . . ? Re5 Se13 Re4 63.40(4) . . ? Re5 Se13 Re6 63.28(4) . . ? Re4 Se13 Re6 63.23(4) . . ? Re6 Se14 Re5 63.46(5) . . ? Re6 Se14 Re1 63.19(4) . . ? Re5 Se14 Re1 62.85(4) . . ? C11 N1 C15 120.0 . . ? C11 N1 Re1 119.4(4) . . ? C15 N1 Re1 120.2(5) . . ? C12 C11 N1 120.0 . . ? C12 C11 H11A 120.0 . . ? N1 C11 H11A 120.0 . . ? C11 C12 C13 120.0 . . ? C11 C12 H12A 120.0 . . ? C13 C12 H12A 120.0 . . ? C14 C13 C12 120.0 . . ? C14 C13 C161 124.6(9) . . ? C12 C13 C161 115.3(9) . . ? C13 C14 C15 120.0 . . ? C13 C14 H14A 120.0 . . ? C15 C14 H14A 120.0 . . ? C14 C15 N1 120.0 . . ? C14 C15 H15A 120.0 . . ? N1 C15 H15A 120.0 . . ? O111 C161 N121 124.0(17) . . ? O111 C161 C13 118.8(14) . . ? N121 C161 C13 117.0(15) . . ? C161 N121 H12B 120.0 . . ? C161 N121 H12C 120.0 . . ? H12B N121 H12C 120.0 . . ? C21 N2 C25 120.0 . . ? C21 N2 Re2 117.4(4) . . ? C25 N2 Re2 122.5(4) . . ? N2 C21 C22 120.0 . . ? N2 C21 H21A 120.0 . . ? C22 C21 H21A 120.0 . . ? C21 C22 C23 120.0 . . ? C21 C22 H22A 120.0 . . ? C23 C22 H22A 120.0 . . ? C24 C23 C22 120.0 . . ? C24 C23 C261 117.8(9) . . ? C22 C23 C261 122.2(9) . . ? C23 C24 C25 120.0 . . ? C23 C24 H24A 120.0 . . ? C25 C24 H24A 120.0 . . ? C24 C25 N2 120.0 . . ? C24 C25 H25A 120.0 . . ? N2 C25 H25A 120.0 . . ? N211 C261 O221 126.2 . . ? N211 C261 C23 117.7(15) . . ? O221 C261 C23 114.8(14) . . ? C261 N211 H21B 120.0 . . ? C261 N211 H21C 120.0 . . ? H21B N211 H21C 120.0 . . ? H21D N213 H21E 120.0 . . ? C33 P3 C32 105.7(8) . . ? C33 P3 C31 104.0(8) . . ? C32 P3 C31 102.3(7) . . ? C33 P3 Re3 113.2(5) . . ? C32 P3 Re3 116.0(6) . . ? C31 P3 Re3 114.3(5) . . ? C34 C31 P3 116.0(12) . . ? C34 C31 H31A 108.3 . . ? P3 C31 H31A 108.3 . . ? C34 C31 H31B 108.3 . . ? P3 C31 H31B 108.3 . . ? H31A C31 H31B 107.4 . . ? C31 C34 H34A 109.5 . . ? C31 C34 H34B 109.5 . . ? H34A C34 H34B 109.5 . . ? C31 C34 H34C 109.5 . . ? H34A C34 H34C 109.5 . . ? H34B C34 H34C 109.5 . . ? C35 C32 P3 113.7(11) . . ? C35 C32 H32A 108.8 . . ? P3 C32 H32A 108.8 . . ? C35 C32 H32B 108.8 . . ? P3 C32 H32B 108.8 . . ? H32A C32 H32B 107.7 . . ? C32 C35 H35A 109.5 . . ? C32 C35 H35B 109.5 . . ? H35A C35 H35B 109.5 . . ? C32 C35 H35C 109.5 . . ? H35A C35 H35C 109.5 . . ? H35B C35 H35C 109.5 . . ? C36 C33 P3 116.1(10) . . ? C36 C33 H33A 108.3 . . ? P3 C33 H33A 108.3 . . ? C36 C33 H33B 108.3 . . ? P3 C33 H33B 108.3 . . ? H33A C33 H33B 107.4 . . ? C33 C36 H36A 109.5 . . ? C33 C36 H36B 109.5 . . ? H36A C36 H36B 109.5 . . ? C33 C36 H36C 109.5 . . ? H36A C36 H36C 109.5 . . ? H36B C36 H36C 109.5 . . ? C43 P4 C41 104.6(7) . . ? C43 P4 C42 102.7(7) . . ? C41 P4 C42 104.6(8) . . ? C43 P4 Re4 114.6(6) . . ? C41 P4 Re4 114.0(5) . . ? C42 P4 Re4 114.9(6) . . ? C44 C41 P4 118.3(11) . . ? C44 C41 H41A 107.7 . . ? P4 C41 H41A 107.7 . . ? C44 C41 H41B 107.7 . . ? P4 C41 H41B 107.7 . . ? H41A C41 H41B 107.1 . . ? C41 C44 H44A 109.5 . . ? C41 C44 H44B 109.5 . . ? H44A C44 H44B 109.5 . . ? C41 C44 H44C 109.5 . . ? H44A C44 H44C 109.5 . . ? H44B C44 H44C 109.5 . . ? C45 C42 P4 112.3(12) . . ? C45 C42 H42A 109.1 . . ? P4 C42 H42A 109.1 . . ? C45 C42 H42B 109.1 . . ? P4 C42 H42B 109.1 . . ? H42A C42 H42B 107.9 . . ? C42 C45 H45A 109.5 . . ? C42 C45 H45B 109.5 . . ? H45A C45 H45B 109.5 . . ? C42 C45 H45C 109.5 . . ? H45A C45 H45C 109.5 . . ? H45B C45 H45C 109.5 . . ? C46 C43 P4 117.6(10) . . ? C46 C43 H43A 107.9 . . ? P4 C43 H43A 107.9 . . ? C46 C43 H43B 107.9 . . ? P4 C43 H43B 107.9 . . ? H43A C43 H43B 107.2 . . ? C43 C46 H46A 109.5 . . ? C43 C46 H46B 109.5 . . ? H46A C46 H46B 109.5 . . ? C43 C46 H46C 109.5 . . ? H46A C46 H46C 109.5 . . ? H46B C46 H46C 109.5 . . ? C53 P5 C52 102.8(10) . . ? C53 P5 C51 103.8(9) . . ? C52 P5 C51 102.7(9) . . ? C53 P5 Re5 114.6(7) . . ? C52 P5 Re5 113.6(6) . . ? C51 P5 Re5 117.5(6) . . ? C54 C51 P5 113.9(11) . . ? C54 C51 H51A 108.8 . . ? P5 C51 H51A 108.8 . . ? C54 C51 H51B 108.8 . . ? P5 C51 H51B 108.8 . . ? H51A C51 H51B 107.7 . . ? C51 C54 H54A 109.5 . . ? C51 C54 H54B 109.5 . . ? H54A C54 H54B 109.5 . . ? C51 C54 H54C 109.5 . . ? H54A C54 H54C 109.5 . . ? H54B C54 H54C 109.5 . . ? C55 C52 P5 118.4(17) . . ? C55 C52 H52A 107.7 . . ? P5 C52 H52A 107.7 . . ? C55 C52 H52B 107.7 . . ? P5 C52 H52B 107.7 . . ? H52A C52 H52B 107.1 . . ? C52 C55 H55A 109.5 . . ? C52 C55 H55B 109.5 . . ? H55A C55 H55B 109.5 . . ? C52 C55 H55C 109.5 . . ? H55A C55 H55C 109.5 . . ? H55B C55 H55C 109.5 . . ? C56 C53 P5 115.0(18) . . ? C56 C53 H53A 108.5 . . ? P5 C53 H53A 108.5 . . ? C56 C53 H53B 108.5 . . ? P5 C53 H53B 108.5 . . ? H53A C53 H53B 107.5 . . ? C53 C56 H56A 109.5 . . ? C53 C56 H56B 109.5 . . ? H56A C56 H56B 109.5 . . ? C53 C56 H56C 109.5 . . ? H56A C56 H56C 109.5 . . ? H56B C56 H56C 109.5 . . ? C63 P6 C62 105.5(7) . . ? C63 P6 C61 101.8(7) . . ? C62 P6 C61 104.4(7) . . ? C63 P6 Re6 116.3(6) . . ? C62 P6 Re6 115.5(5) . . ? C61 P6 Re6 111.8(5) . . ? C64 C61 P6 115.4(10) . . ? C64 C61 H61A 108.4 . . ? P6 C61 H61A 108.4 . . ? C64 C61 H61B 108.4 . . ? P6 C61 H61B 108.4 . . ? H61A C61 H61B 107.5 . . ? C61 C64 H64A 109.5 . . ? C61 C64 H64B 109.5 . . ? H64A C64 H64B 109.5 . . ? C61 C64 H64C 109.5 . . ? H64A C64 H64C 109.5 . . ? H64B C64 H64C 109.5 . . ? C65 C62 P6 116.1(10) . . ? C65 C62 H62A 108.3 . . ? P6 C62 H62A 108.3 . . ? C65 C62 H62B 108.3 . . ? P6 C62 H62B 108.3 . . ? H62A C62 H62B 107.4 . . ? C62 C65 H65A 109.5 . . ? C62 C65 H65B 109.5 . . ? H65A C65 H65B 109.5 . . ? C62 C65 H65C 109.5 . . ? H65A C65 H65C 109.5 . . ? H65B C65 H65C 109.5 . . ? C66 C63 P6 114.4(13) . . ? C66 C63 H63A 108.7 . . ? P6 C63 H63A 108.7 . . ? C66 C63 H63B 108.7 . . ? P6 C63 H63B 108.7 . . ? H63A C63 H63B 107.6 . . ? C63 C66 H66A 109.5 . . ? C63 C66 H66B 109.5 . . ? H66A C66 H66B 109.5 . . ? C63 C66 H66C 109.5 . . ? H66A C66 H66C 109.5 . . ? H66B C66 H66C 109.5 . . ? F11 Sb1 F11 180.0(9) 2_447 . ? F11 Sb1 F14 89.4(11) 2_447 2_447 ? F11 Sb1 F14 90.6(11) . 2_447 ? F11 Sb1 F14 90.6(11) 2_447 . ? F11 Sb1 F14 89.4(11) . . ? F14 Sb1 F14 180.000(4) 2_447 . ? F11 Sb1 F15 84.2(10) 2_447 . ? F11 Sb1 F15 95.8(10) . . ? F14 Sb1 F15 95.9(16) 2_447 . ? F14 Sb1 F15 84.1(16) . . ? F11 Sb1 F15 95.8(10) 2_447 2_447 ? F11 Sb1 F15 84.2(10) . 2_447 ? F14 Sb1 F15 84.1(16) 2_447 2_447 ? F14 Sb1 F15 95.9(16) . 2_447 ? F15 Sb1 F15 180.0(8) . 2_447 ? F11 Sb1 F12 89.0(9) 2_447 2_447 ? F11 Sb1 F12 91.0(9) . 2_447 ? F14 Sb1 F12 35.4(12) 2_447 2_447 ? F14 Sb1 F12 144.6(12) . 2_447 ? F15 Sb1 F12 131.0(13) . 2_447 ? F15 Sb1 F12 49.0(13) 2_447 2_447 ? F11 Sb1 F12 91.0(9) 2_447 . ? F11 Sb1 F12 89.0(9) . . ? F14 Sb1 F12 144.6(12) 2_447 . ? F14 Sb1 F12 35.4(12) . . ? F15 Sb1 F12 49.0(13) . . ? F15 Sb1 F12 131.0(13) 2_447 . ? F12 Sb1 F12 180(2) 2_447 . ? F11 Sb1 F13 96.9(9) 2_447 2_447 ? F11 Sb1 F13 83.1(9) . 2_447 ? F14 Sb1 F13 55.3(14) 2_447 2_447 ? F14 Sb1 F13 124.7(14) . 2_447 ? F15 Sb1 F13 42.9(12) . 2_447 ? F15 Sb1 F13 137.1(12) 2_447 2_447 ? F12 Sb1 F13 90.5(13) 2_447 2_447 ? F12 Sb1 F13 89.5(13) . 2_447 ? F11 Sb1 F13 83.1(9) 2_447 . ? F11 Sb1 F13 96.9(9) . . ? F14 Sb1 F13 124.7(14) 2_447 . ? F14 Sb1 F13 55.3(14) . . ? F15 Sb1 F13 137.1(12) . . ? F15 Sb1 F13 42.9(12) 2_447 . ? F12 Sb1 F13 89.5(13) 2_447 . ? F12 Sb1 F13 90.5(13) . . ? F13 Sb1 F13 180.000(4) 2_447 . ? F214 Sb21 F215 90(2) . . ? F214 Sb21 F211 93.7(15) . . ? F215 Sb21 F211 94(2) . . ? F214 Sb21 F216 88.4(17) . . ? F215 Sb21 F216 176.4(19) . . ? F211 Sb21 F216 89.8(15) . . ? F214 Sb21 F213 93.9(13) . . ? F215 Sb21 F213 92.5(16) . . ? F211 Sb21 F213 170.3(13) . . ? F216 Sb21 F213 84.5(13) . . ? F214 Sb21 F212 173(2) . . ? F215 Sb21 F212 84(2) . . ? F211 Sb21 F212 90.0(18) . . ? F216 Sb21 F212 98(2) . . ? F213 Sb21 F212 83.1(14) . . ? F226 Sb22 F223 87(3) . . ? F226 Sb22 F221 99(2) . . ? F223 Sb22 F221 173(3) . . ? F226 Sb22 F224 100(3) . . ? F223 Sb22 F224 94(2) . . ? F221 Sb22 F224 89.3(18) . . ? F226 Sb22 F225 174(3) . . ? F223 Sb22 F225 98(3) . . ? F221 Sb22 F225 76(3) . . ? F224 Sb22 F225 83(3) . . ? F226 Sb22 F222 82(3) . . ? F223 Sb22 F222 102(3) . . ? F221 Sb22 F222 75(3) . . ? F224 Sb22 F222 165(3) . . ? F225 Sb22 F222 94(4) . . ? loop_ _geom_torsion_atom_site_label_1 _geom_torsion_atom_site_label_2 _geom_torsion_atom_site_label_3 _geom_torsion_atom_site_label_4 _geom_torsion _geom_torsion_site_symmetry_1 _geom_torsion_site_symmetry_2 _geom_torsion_site_symmetry_3 _geom_torsion_site_symmetry_4 _geom_torsion_publ_flag N1 Re1 Re2 N2 1.7(4) . . . . ? Se9 Re1 Re2 N2 -126.8(3) . . . . ? Se8 Re1 Re2 N2 55.3(3) . . . . ? Se14 Re1 Re2 N2 126.2(3) . . . . ? Se7 Re1 Re2 N2 -56.7(3) . . . . ? Re5 Re1 Re2 N2 124.3(3) . . . . ? Re3 Re1 Re2 N2 -125.8(3) . . . . ? Re6 Re1 Re2 N2 179.4(3) . . . . ? N1 Re1 Re2 Se8 -53.6(3) . . . . ? Se9 Re1 Re2 Se8 177.95(6) . . . . ? Se14 Re1 Re2 Se8 70.89(6) . . . . ? Se7 Re1 Re2 Se8 -111.94(6) . . . . ? Re5 Re1 Re2 Se8 69.03(4) . . . . ? Re3 Re1 Re2 Se8 178.93(5) . . . . ? Re6 Re1 Re2 Se8 124.15(5) . . . . ? N1 Re1 Re2 Se12 -123.8(3) . . . . ? Se9 Re1 Re2 Se12 107.75(7) . . . . ? Se8 Re1 Re2 Se12 -70.20(6) . . . . ? Se14 Re1 Re2 Se12 0.69(8) . . . . ? Se7 Re1 Re2 Se12 177.86(7) . . . . ? Re5 Re1 Re2 Se12 -1.17(5) . . . . ? Re3 Re1 Re2 Se12 108.73(5) . . . . ? Re6 Re1 Re2 Se12 53.95(6) . . . . ? N1 Re1 Re2 Se11 128.8(3) . . . . ? Se9 Re1 Re2 Se11 0.32(7) . . . . ? Se8 Re1 Re2 Se11 -177.63(6) . . . . ? Se14 Re1 Re2 Se11 -106.74(7) . . . . ? Se7 Re1 Re2 Se11 70.43(6) . . . . ? Re5 Re1 Re2 Se11 -108.59(5) . . . . ? Re3 Re1 Re2 Se11 1.30(5) . . . . ? Re6 Re1 Re2 Se11 -53.48(5) . . . . ? N1 Re1 Re2 Se7 58.3(3) . . . . ? Se9 Re1 Re2 Se7 -70.11(6) . . . . ? Se8 Re1 Re2 Se7 111.94(6) . . . . ? Se14 Re1 Re2 Se7 -177.17(7) . . . . ? Re5 Re1 Re2 Se7 -179.03(5) . . . . ? Re3 Re1 Re2 Se7 -69.13(5) . . . . ? Re6 Re1 Re2 Se7 -123.91(5) . . . . ? N1 Re1 Re2 Re3 127.5(3) . . . . ? Se9 Re1 Re2 Re3 -0.98(5) . . . . ? Se8 Re1 Re2 Re3 -178.93(5) . . . . ? Se14 Re1 Re2 Re3 -108.04(5) . . . . ? Se7 Re1 Re2 Re3 69.13(5) . . . . ? Re5 Re1 Re2 Re3 -109.90(3) . . . . ? Re6 Re1 Re2 Re3 -54.78(2) . . . . ? N1 Re1 Re2 Re4 -177.4(3) . . . . ? Se9 Re1 Re2 Re4 54.10(5) . . . . ? Se8 Re1 Re2 Re4 -123.85(5) . . . . ? Se14 Re1 Re2 Re4 -52.96(6) . . . . ? Se7 Re1 Re2 Re4 124.21(5) . . . . ? Re5 Re1 Re2 Re4 -54.82(3) . . . . ? Re3 Re1 Re2 Re4 55.08(2) . . . . ? Re6 Re1 Re2 Re4 0.29(3) . . . . ? N1 Re1 Re2 Re5 -122.6(3) . . . . ? Se9 Re1 Re2 Re5 108.91(5) . . . . ? Se8 Re1 Re2 Re5 -69.03(4) . . . . ? Se14 Re1 Re2 Re5 1.86(5) . . . . ? Se7 Re1 Re2 Re5 179.03(5) . . . . ? Re3 Re1 Re2 Re5 109.90(3) . . . . ? Re6 Re1 Re2 Re5 55.11(3) . . . . ? P4 Re4 Re2 N2 -0.2(4) . . . . ? Se12 Re4 Re2 N2 -55.3(3) . . . . ? Se10 Re4 Re2 N2 127.2(3) . . . . ? Se13 Re4 Re2 N2 -125.9(3) . . . . ? Se11 Re4 Re2 N2 56.8(3) . . . . ? Re6 Re4 Re2 N2 -179.4(3) . . . . ? Re5 Re4 Re2 N2 -124.6(3) . . . . ? Re3 Re4 Re2 N2 125.9(3) . . . . ? P4 Re4 Re2 Se8 125.08(16) . . . . ? Se12 Re4 Re2 Se8 69.94(7) . . . . ? Se10 Re4 Re2 Se8 -107.50(7) . . . . ? Se13 Re4 Re2 Se8 -0.64(7) . . . . ? Se11 Re4 Re2 Se8 -177.95(6) . . . . ? Re6 Re4 Re2 Se8 -54.17(5) . . . . ? Re5 Re4 Re2 Se8 0.69(5) . . . . ? Re3 Re4 Re2 Se8 -108.80(5) . . . . ? P4 Re4 Re2 Se12 55.14(16) . . . . ? Se10 Re4 Re2 Se12 -177.44(7) . . . . ? Se13 Re4 Re2 Se12 -70.58(7) . . . . ? Se11 Re4 Re2 Se12 112.11(7) . . . . ? Re6 Re4 Re2 Se12 -124.12(5) . . . . ? Re5 Re4 Re2 Se12 -69.25(5) . . . . ? Re3 Re4 Re2 Se12 -178.74(6) . . . . ? P4 Re4 Re2 Se11 -56.97(16) . . . . ? Se12 Re4 Re2 Se11 -112.11(7) . . . . ? Se10 Re4 Re2 Se11 70.45(6) . . . . ? Se13 Re4 Re2 Se11 177.31(6) . . . . ? Re6 Re4 Re2 Se11 123.77(5) . . . . ? Re5 Re4 Re2 Se11 178.64(5) . . . . ? Re3 Re4 Re2 Se11 69.15(5) . . . . ? P4 Re4 Re2 Se7 -127.17(16) . . . . ? Se12 Re4 Re2 Se7 177.68(7) . . . . ? Se10 Re4 Re2 Se7 0.24(8) . . . . ? Se13 Re4 Re2 Se7 107.10(7) . . . . ? Se11 Re4 Re2 Se7 -70.21(6) . . . . ? Re6 Re4 Re2 Se7 53.57(6) . . . . ? Re5 Re4 Re2 Se7 108.43(5) . . . . ? Re3 Re4 Re2 Se7 -1.06(5) . . . . ? P4 Re4 Re2 Re1 178.96(15) . . . . ? Se12 Re4 Re2 Re1 123.82(5) . . . . ? Se10 Re4 Re2 Re1 -53.62(6) . . . . ? Se13 Re4 Re2 Re1 53.24(5) . . . . ? Se11 Re4 Re2 Re1 -124.07(5) . . . . ? Re6 Re4 Re2 Re1 -0.29(3) . . . . ? Re5 Re4 Re2 Re1 54.57(2) . . . . ? Re3 Re4 Re2 Re1 -54.92(3) . . . . ? P4 Re4 Re2 Re3 -126.12(15) . . . . ? Se12 Re4 Re2 Re3 178.74(6) . . . . ? Se10 Re4 Re2 Re3 1.30(5) . . . . ? Se13 Re4 Re2 Re3 108.16(5) . . . . ? Se11 Re4 Re2 Re3 -69.15(5) . . . . ? Re6 Re4 Re2 Re3 54.62(3) . . . . ? Re5 Re4 Re2 Re3 109.49(3) . . . . ? P4 Re4 Re2 Re5 124.39(15) . . . . ? Se12 Re4 Re2 Re5 69.25(5) . . . . ? Se10 Re4 Re2 Re5 -108.19(5) . . . . ? Se13 Re4 Re2 Re5 -1.33(5) . . . . ? Se11 Re4 Re2 Re5 -178.64(5) . . . . ? Re6 Re4 Re2 Re5 -54.87(2) . . . . ? Re3 Re4 Re2 Re5 -109.49(3) . . . . ? N2 Re2 Re3 P3 -0.5(4) . . . . ? Se8 Re2 Re3 P3 -127.33(16) . . . . ? Se12 Re2 Re3 P3 125.54(16) . . . . ? Se11 Re2 Re3 P3 55.06(16) . . . . ? Se7 Re2 Re3 P3 -56.77(16) . . . . ? Re1 Re2 Re3 P3 -126.28(15) . . . . ? Re4 Re2 Re3 P3 124.32(15) . . . . ? Re5 Re2 Re3 P3 179.24(15) . . . . ? N2 Re2 Re3 Se11 -55.6(3) . . . . ? Se8 Re2 Re3 Se11 177.62(6) . . . . ? Se12 Re2 Re3 Se11 70.49(7) . . . . ? Se7 Re2 Re3 Se11 -111.82(6) . . . . ? Re1 Re2 Re3 Se11 178.66(5) . . . . ? Re4 Re2 Re3 Se11 69.26(5) . . . . ? Re5 Re2 Re3 Se11 124.19(5) . . . . ? N2 Re2 Re3 Se7 56.3(3) . . . . ? Se8 Re2 Re3 Se7 -70.56(6) . . . . ? Se12 Re2 Re3 Se7 -177.69(7) . . . . ? Se11 Re2 Re3 Se7 111.82(6) . . . . ? Re1 Re2 Re3 Se7 -69.52(5) . . . . ? Re4 Re2 Re3 Se7 -178.91(5) . . . . ? Re5 Re2 Re3 Se7 -123.99(5) . . . . ? N2 Re2 Re3 Se10 -126.1(3) . . . . ? Se8 Re2 Re3 Se10 107.06(7) . . . . ? Se12 Re2 Re3 Se10 -0.07(8) . . . . ? Se11 Re2 Re3 Se10 -70.56(7) . . . . ? Se7 Re2 Re3 Se10 177.62(7) . . . . ? Re1 Re2 Re3 Se10 108.10(5) . . . . ? Re4 Re2 Re3 Se10 -1.30(5) . . . . ? Re5 Re2 Re3 Se10 53.63(6) . . . . ? N2 Re2 Re3 Se9 126.8(3) . . . . ? Se8 Re2 Re3 Se9 -0.07(7) . . . . ? Se12 Re2 Re3 Se9 -107.20(7) . . . . ? Se11 Re2 Re3 Se9 -177.69(6) . . . . ? Se7 Re2 Re3 Se9 70.49(6) . . . . ? Re1 Re2 Re3 Se9 0.97(5) . . . . ? Re4 Re2 Re3 Se9 -108.43(5) . . . . ? Re5 Re2 Re3 Se9 -53.50(5) . . . . ? N2 Re2 Re3 Re1 125.8(3) . . . . ? Se8 Re2 Re3 Re1 -1.04(5) . . . . ? Se12 Re2 Re3 Re1 -108.17(6) . . . . ? Se11 Re2 Re3 Re1 -178.66(5) . . . . ? Se7 Re2 Re3 Re1 69.52(5) . . . . ? Re4 Re2 Re3 Re1 -109.40(3) . . . . ? Re5 Re2 Re3 Re1 -54.47(3) . . . . ? N2 Re2 Re3 Re6 -179.5(3) . . . . ? Se8 Re2 Re3 Re6 53.62(5) . . . . ? Se12 Re2 Re3 Re6 -53.51(6) . . . . ? Se11 Re2 Re3 Re6 -123.99(5) . . . . ? Se7 Re2 Re3 Re6 124.18(5) . . . . ? Re1 Re2 Re3 Re6 54.67(3) . . . . ? Re4 Re2 Re3 Re6 -54.73(3) . . . . ? Re5 Re2 Re3 Re6 0.19(3) . . . . ? N2 Re2 Re3 Re4 -124.8(3) . . . . ? Se8 Re2 Re3 Re4 108.36(5) . . . . ? Se12 Re2 Re3 Re4 1.22(5) . . . . ? Se11 Re2 Re3 Re4 -69.26(5) . . . . ? Se7 Re2 Re3 Re4 178.91(5) . . . . ? Re1 Re2 Re3 Re4 109.40(3) . . . . ? Re5 Re2 Re3 Re4 54.92(3) . . . . ? N1 Re1 Re3 P3 4.0(4) . . . . ? Se9 Re1 Re3 P3 -53.54(15) . . . . ? Se8 Re1 Re3 P3 128.50(15) . . . . ? Se14 Re1 Re3 P3 -123.72(15) . . . . ? Se7 Re1 Re3 P3 58.03(15) . . . . ? Re2 Re1 Re3 P3 127.46(14) . . . . ? Re5 Re1 Re3 P3 -177.69(14) . . . . ? Re6 Re1 Re3 P3 -122.90(14) . . . . ? N1 Re1 Re3 Se11 -124.8(3) . . . . ? Se9 Re1 Re3 Se11 177.70(6) . . . . ? Se8 Re1 Re3 Se11 -0.25(7) . . . . ? Se14 Re1 Re3 Se11 107.53(6) . . . . ? Se7 Re1 Re3 Se11 -70.73(6) . . . . ? Re2 Re1 Re3 Se11 -1.29(5) . . . . ? Re5 Re1 Re3 Se11 53.56(5) . . . . ? Re6 Re1 Re3 Se11 108.35(5) . . . . ? N1 Re1 Re3 Se7 -54.1(3) . . . . ? Se9 Re1 Re3 Se7 -111.57(6) . . . . ? Se8 Re1 Re3 Se7 70.48(6) . . . . ? Se14 Re1 Re3 Se7 178.26(6) . . . . ? Re2 Re1 Re3 Se7 69.44(5) . . . . ? Re5 Re1 Re3 Se7 124.29(5) . . . . ? Re6 Re1 Re3 Se7 179.07(5) . . . . ? N1 Re1 Re3 Se10 128.8(3) . . . . ? Se9 Re1 Re3 Se10 71.28(6) . . . . ? Se8 Re1 Re3 Se10 -106.67(6) . . . . ? Se14 Re1 Re3 Se10 1.11(7) . . . . ? Se7 Re1 Re3 Se10 -177.15(6) . . . . ? Re2 Re1 Re3 Se10 -107.71(5) . . . . ? Re5 Re1 Re3 Se10 -52.86(5) . . . . ? Re6 Re1 Re3 Se10 1.93(5) . . . . ? N1 Re1 Re3 Se9 57.5(3) . . . . ? Se8 Re1 Re3 Se9 -177.95(6) . . . . ? Se14 Re1 Re3 Se9 -70.17(6) . . . . ? Se7 Re1 Re3 Se9 111.57(6) . . . . ? Re2 Re1 Re3 Se9 -178.99(5) . . . . ? Re5 Re1 Re3 Se9 -124.14(5) . . . . ? Re6 Re1 Re3 Se9 -69.35(4) . . . . ? N1 Re1 Re3 Re2 -123.5(3) . . . . ? Se9 Re1 Re3 Re2 178.99(5) . . . . ? Se8 Re1 Re3 Re2 1.04(5) . . . . ? Se14 Re1 Re3 Re2 108.82(5) . . . . ? Se7 Re1 Re3 Re2 -69.44(5) . . . . ? Re5 Re1 Re3 Re2 54.85(2) . . . . ? Re6 Re1 Re3 Re2 109.64(3) . . . . ? N1 Re1 Re3 Re6 126.9(3) . . . . ? Se9 Re1 Re3 Re6 69.35(4) . . . . ? Se8 Re1 Re3 Re6 -108.60(5) . . . . ? Se14 Re1 Re3 Re6 -0.82(5) . . . . ? Se7 Re1 Re3 Re6 -179.07(5) . . . . ? Re2 Re1 Re3 Re6 -109.64(3) . . . . ? Re5 Re1 Re3 Re6 -54.79(3) . . . . ? N1 Re1 Re3 Re4 -178.2(3) . . . . ? Se9 Re1 Re3 Re4 124.33(5) . . . . ? Se8 Re1 Re3 Re4 -53.62(5) . . . . ? Se14 Re1 Re3 Re4 54.16(5) . . . . ? Se7 Re1 Re3 Re4 -124.10(5) . . . . ? Re2 Re1 Re3 Re4 -54.66(2) . . . . ? Re5 Re1 Re3 Re4 0.19(3) . . . . ? Re6 Re1 Re3 Re4 54.98(2) . . . . ? P4 Re4 Re3 P3 0.4(2) . . . . ? Se12 Re4 Re3 P3 -128.76(15) . . . . ? Se10 Re4 Re3 P3 53.80(14) . . . . ? Se13 Re4 Re3 P3 124.54(14) . . . . ? Se11 Re4 Re3 P3 -58.27(14) . . . . ? Re2 Re4 Re3 P3 -127.54(14) . . . . ? Re6 Re4 Re3 P3 122.95(14) . . . . ? Re5 Re4 Re3 P3 177.74(14) . . . . ? P4 Re4 Re3 Se11 58.69(16) . . . . ? Se12 Re4 Re3 Se11 -70.48(7) . . . . ? Se10 Re4 Re3 Se11 112.08(7) . . . . ? Se13 Re4 Re3 Se11 -177.19(7) . . . . ? Re2 Re4 Re3 Se11 -69.27(5) . . . . ? Re6 Re4 Re3 Se11 -178.78(5) . . . . ? Re5 Re4 Re3 Se11 -123.98(5) . . . . ? P4 Re4 Re3 Se7 129.01(15) . . . . ? Se12 Re4 Re3 Se7 -0.16(8) . . . . ? Se10 Re4 Re3 Se7 -177.60(7) . . . . ? Se13 Re4 Re3 Se7 -106.86(7) . . . . ? Se11 Re4 Re3 Se7 70.32(7) . . . . ? Re2 Re4 Re3 Se7 1.05(5) . . . . ? Re6 Re4 Re3 Se7 -108.46(5) . . . . ? Re5 Re4 Re3 Se7 -53.66(5) . . . . ? P4 Re4 Re3 Se10 -53.39(16) . . . . ? Se12 Re4 Re3 Se10 177.44(7) . . . . ? Se13 Re4 Re3 Se10 70.74(7) . . . . ? Se11 Re4 Re3 Se10 -112.08(7) . . . . ? Re2 Re4 Re3 Se10 178.65(5) . . . . ? Re6 Re4 Re3 Se10 69.15(5) . . . . ? Re5 Re4 Re3 Se10 123.94(5) . . . . ? P4 Re4 Re3 Se9 -124.44(15) . . . . ? Se12 Re4 Re3 Se9 106.39(7) . . . . ? Se10 Re4 Re3 Se9 -71.05(7) . . . . ? Se13 Re4 Re3 Se9 -0.31(7) . . . . ? Se11 Re4 Re3 Se9 176.87(7) . . . . ? Re2 Re4 Re3 Se9 107.61(5) . . . . ? Re6 Re4 Re3 Se9 -1.90(5) . . . . ? Re5 Re4 Re3 Se9 52.89(5) . . . . ? P4 Re4 Re3 Re2 127.95(15) . . . . ? Se12 Re4 Re3 Re2 -1.21(5) . . . . ? Se10 Re4 Re3 Re2 -178.65(5) . . . . ? Se13 Re4 Re3 Re2 -107.92(6) . . . . ? Se11 Re4 Re3 Re2 69.27(5) . . . . ? Re6 Re4 Re3 Re2 -109.51(3) . . . . ? Re5 Re4 Re3 Re2 -54.72(3) . . . . ? P4 Re4 Re3 Re1 -177.52(15) . . . . ? Se12 Re4 Re3 Re1 53.31(6) . . . . ? Se10 Re4 Re3 Re1 -124.13(5) . . . . ? Se13 Re4 Re3 Re1 -53.39(6) . . . . ? Se11 Re4 Re3 Re1 123.80(5) . . . . ? Re2 Re4 Re3 Re1 54.53(3) . . . . ? Re6 Re4 Re3 Re1 -54.98(3) . . . . ? Re5 Re4 Re3 Re1 -0.19(3) . . . . ? P4 Re4 Re3 Re6 -122.54(15) . . . . ? Se12 Re4 Re3 Re6 108.29(6) . . . . ? Se10 Re4 Re3 Re6 -69.15(5) . . . . ? Se13 Re4 Re3 Re6 1.59(5) . . . . ? Se11 Re4 Re3 Re6 178.78(5) . . . . ? Re2 Re4 Re3 Re6 109.51(3) . . . . ? Re5 Re4 Re3 Re6 54.79(3) . . . . ? N1 Re1 Re6 P6 0.0(4) . . . . ? Se9 Re1 Re6 P6 58.25(15) . . . . ? Se8 Re1 Re6 P6 -123.99(15) . . . . ? Se14 Re1 Re6 P6 -53.21(15) . . . . ? Se7 Re1 Re6 P6 128.53(15) . . . . ? Re2 Re1 Re6 P6 -177.62(15) . . . . ? Re5 Re1 Re6 P6 -122.45(15) . . . . ? Re3 Re1 Re6 P6 127.63(15) . . . . ? N1 Re1 Re6 Se14 53.2(3) . . . . ? Se9 Re1 Re6 Se14 111.47(6) . . . . ? Se8 Re1 Re6 Se14 -70.78(7) . . . . ? Se7 Re1 Re6 Se14 -178.25(6) . . . . ? Re2 Re1 Re6 Se14 -124.40(5) . . . . ? Re5 Re1 Re6 Se14 -69.24(5) . . . . ? Re3 Re1 Re6 Se14 -179.15(5) . . . . ? N1 Re1 Re6 Se10 -129.5(3) . . . . ? Se9 Re1 Re6 Se10 -71.31(6) . . . . ? Se8 Re1 Re6 Se10 106.45(7) . . . . ? Se14 Re1 Re6 Se10 177.22(6) . . . . ? Se7 Re1 Re6 Se10 -1.03(7) . . . . ? Re2 Re1 Re6 Se10 52.82(5) . . . . ? Re5 Re1 Re6 Se10 107.98(5) . . . . ? Re3 Re1 Re6 Se10 -1.93(5) . . . . ? N1 Re1 Re6 Se9 -58.2(3) . . . . ? Se8 Re1 Re6 Se9 177.76(7) . . . . ? Se14 Re1 Re6 Se9 -111.47(6) . . . . ? Se7 Re1 Re6 Se9 70.28(6) . . . . ? Re2 Re1 Re6 Se9 124.13(5) . . . . ? Re5 Re1 Re6 Se9 179.30(5) . . . . ? Re3 Re1 Re6 Se9 69.38(5) . . . . ? N1 Re1 Re6 Se13 124.1(3) . . . . ? Se9 Re1 Re6 Se13 -177.66(7) . . . . ? Se8 Re1 Re6 Se13 0.10(8) . . . . ? Se14 Re1 Re6 Se13 70.87(6) . . . . ? Se7 Re1 Re6 Se13 -107.38(7) . . . . ? Re2 Re1 Re6 Se13 -53.53(6) . . . . ? Re5 Re1 Re6 Se13 1.63(5) . . . . ? Re3 Re1 Re6 Se13 -108.28(5) . . . . ? N1 Re1 Re6 Re3 -127.6(3) . . . . ? Se9 Re1 Re6 Re3 -69.38(5) . . . . ? Se8 Re1 Re6 Re3 108.38(5) . . . . ? Se14 Re1 Re6 Re3 179.15(5) . . . . ? Se7 Re1 Re6 Re3 0.90(5) . . . . ? Re2 Re1 Re6 Re3 54.75(2) . . . . ? Re5 Re1 Re6 Re3 109.91(3) . . . . ? N1 Re1 Re6 Re4 177.4(3) . . . . ? Se9 Re1 Re6 Re4 -124.43(5) . . . . ? Se8 Re1 Re6 Re4 53.33(6) . . . . ? Se14 Re1 Re6 Re4 124.11(5) . . . . ? Se7 Re1 Re6 Re4 -54.15(5) . . . . ? Re2 Re1 Re6 Re4 -0.29(3) . . . . ? Re5 Re1 Re6 Re4 54.87(3) . . . . ? Re3 Re1 Re6 Re4 -55.04(2) . . . . ? N1 Re1 Re6 Re5 122.5(3) . . . . ? Se9 Re1 Re6 Re5 -179.30(5) . . . . ? Se8 Re1 Re6 Re5 -1.54(5) . . . . ? Se14 Re1 Re6 Re5 69.24(5) . . . . ? Se7 Re1 Re6 Re5 -109.02(5) . . . . ? Re2 Re1 Re6 Re5 -55.16(3) . . . . ? Re3 Re1 Re6 Re5 -109.91(3) . . . . ? P3 Re3 Re6 P6 0.0(2) . . . . ? Se11 Re3 Re6 P6 125.72(16) . . . . ? Se7 Re3 Re6 P6 -127.35(16) . . . . ? Se10 Re3 Re6 P6 55.55(16) . . . . ? Se9 Re3 Re6 P6 -57.42(16) . . . . ? Re2 Re3 Re6 P6 179.14(15) . . . . ? Re1 Re3 Re6 P6 -126.45(15) . . . . ? Re4 Re3 Re6 P6 124.54(15) . . . . ? P3 Re3 Re6 Se14 127.31(15) . . . . ? Se11 Re3 Re6 Se14 -107.01(7) . . . . ? Se7 Re3 Re6 Se14 -0.08(7) . . . . ? Se10 Re3 Re6 Se14 -177.18(6) . . . . ? Se9 Re3 Re6 Se14 69.85(6) . . . . ? Re2 Re3 Re6 Se14 -53.59(5) . . . . ? Re1 Re3 Re6 Se14 0.82(5) . . . . ? Re4 Re3 Re6 Se14 -108.19(5) . . . . ? P3 Re3 Re6 Se10 -55.51(15) . . . . ? Se11 Re3 Re6 Se10 70.17(6) . . . . ? Se7 Re3 Re6 Se10 177.10(6) . . . . ? Se9 Re3 Re6 Se10 -112.97(6) . . . . ? Re2 Re3 Re6 Se10 123.60(5) . . . . ? Re1 Re3 Re6 Se10 178.00(5) . . . . ? Re4 Re3 Re6 Se10 68.99(5) . . . . ? P3 Re3 Re6 Se9 57.46(15) . . . . ? Se11 Re3 Re6 Se9 -176.85(7) . . . . ? Se7 Re3 Re6 Se9 -69.92(6) . . . . ? Se10 Re3 Re6 Se9 112.97(6) . . . . ? Re2 Re3 Re6 Se9 -123.43(5) . . . . ? Re1 Re3 Re6 Se9 -69.02(5) . . . . ? Re4 Re3 Re6 Se9 -178.04(5) . . . . ? P3 Re3 Re6 Se13 -126.08(15) . . . . ? Se11 Re3 Re6 Se13 -0.40(8) . . . . ? Se7 Re3 Re6 Se13 106.53(7) . . . . ? Se10 Re3 Re6 Se13 -70.57(6) . . . . ? Se9 Re3 Re6 Se13 176.46(7) . . . . ? Re2 Re3 Re6 Se13 53.02(5) . . . . ? Re1 Re3 Re6 Se13 107.43(5) . . . . ? Re4 Re3 Re6 Se13 -1.58(5) . . . . ? P3 Re3 Re6 Re1 126.49(15) . . . . ? Se11 Re3 Re6 Re1 -107.83(5) . . . . ? Se7 Re3 Re6 Re1 -0.90(5) . . . . ? Se10 Re3 Re6 Re1 -178.00(5) . . . . ? Se9 Re3 Re6 Re1 69.02(5) . . . . ? Re2 Re3 Re6 Re1 -54.41(3) . . . . ? Re4 Re3 Re6 Re1 -109.02(3) . . . . ? P3 Re3 Re6 Re4 -124.50(15) . . . . ? Se11 Re3 Re6 Re4 1.19(5) . . . . ? Se7 Re3 Re6 Re4 108.12(5) . . . . ? Se10 Re3 Re6 Re4 -68.99(5) . . . . ? Se9 Re3 Re6 Re4 178.04(5) . . . . ? Re2 Re3 Re6 Re4 54.61(3) . . . . ? Re1 Re3 Re6 Re4 109.02(3) . . . . ? P3 Re3 Re6 Re5 -179.30(14) . . . . ? Se11 Re3 Re6 Re5 -53.61(6) . . . . ? Se7 Re3 Re6 Re5 53.32(5) . . . . ? Se10 Re3 Re6 Re5 -123.79(5) . . . . ? Se9 Re3 Re6 Re5 123.24(5) . . . . ? Re2 Re3 Re6 Re5 -0.19(3) . . . . ? Re1 Re3 Re6 Re5 54.22(3) . . . . ? Re4 Re3 Re6 Re5 -54.80(3) . . . . ? P4 Re4 Re6 P6 -1.6(2) . . . . ? Se12 Re4 Re6 P6 124.39(15) . . . . ? Se10 Re4 Re6 P6 -58.53(15) . . . . ? Se13 Re4 Re6 P6 53.85(15) . . . . ? Se11 Re4 Re6 P6 -128.98(15) . . . . ? Re2 Re4 Re6 P6 177.68(14) . . . . ? Re5 Re4 Re6 P6 122.83(15) . . . . ? Re3 Re4 Re6 P6 -127.79(15) . . . . ? P4 Re4 Re6 Se14 -125.62(15) . . . . ? Se12 Re4 Re6 Se14 0.39(7) . . . . ? Se10 Re4 Re6 Se14 177.47(6) . . . . ? Se13 Re4 Re6 Se14 -70.15(6) . . . . ? Se11 Re4 Re6 Se14 107.02(6) . . . . ? Re2 Re4 Re6 Se14 53.68(5) . . . . ? Re5 Re4 Re6 Se14 -1.17(5) . . . . ? Re3 Re4 Re6 Se14 108.20(5) . . . . ? P4 Re4 Re6 Se10 56.91(15) . . . . ? Se12 Re4 Re6 Se10 -177.08(6) . . . . ? Se13 Re4 Re6 Se10 112.38(6) . . . . ? Se11 Re4 Re6 Se10 -70.45(6) . . . . ? Re2 Re4 Re6 Se10 -123.79(5) . . . . ? Re5 Re4 Re6 Se10 -178.64(5) . . . . ? Re3 Re4 Re6 Se10 -69.26(4) . . . . ? P4 Re4 Re6 Se9 128.07(15) . . . . ? Se12 Re4 Re6 Se9 -105.91(7) . . . . ? Se10 Re4 Re6 Se9 71.16(6) . . . . ? Se13 Re4 Re6 Se9 -176.46(7) . . . . ? Se11 Re4 Re6 Se9 0.72(7) . . . . ? Re2 Re4 Re6 Se9 -52.62(5) . . . . ? Re5 Re4 Re6 Se9 -107.47(5) . . . . ? Re3 Re4 Re6 Se9 1.90(5) . . . . ? P4 Re4 Re6 Se13 -55.47(15) . . . . ? Se12 Re4 Re6 Se13 70.55(7) . . . . ? Se10 Re4 Re6 Se13 -112.38(6) . . . . ? Se11 Re4 Re6 Se13 177.18(7) . . . . ? Re2 Re4 Re6 Se13 123.84(5) . . . . ? Re5 Re4 Re6 Se13 68.99(5) . . . . ? Re3 Re4 Re6 Se13 178.36(5) . . . . ? P4 Re4 Re6 Re1 -179.01(14) . . . . ? Se12 Re4 Re6 Re1 -53.00(5) . . . . ? Se10 Re4 Re6 Re1 124.08(5) . . . . ? Se13 Re4 Re6 Re1 -123.55(5) . . . . ? Se11 Re4 Re6 Re1 53.63(5) . . . . ? Re2 Re4 Re6 Re1 0.29(3) . . . . ? Re5 Re4 Re6 Re1 -54.56(2) . . . . ? Re3 Re4 Re6 Re1 54.81(3) . . . . ? P4 Re4 Re6 Re3 126.17(14) . . . . ? Se12 Re4 Re6 Re3 -107.81(5) . . . . ? Se10 Re4 Re6 Re3 69.26(4) . . . . ? Se13 Re4 Re6 Re3 -178.36(5) . . . . ? Se11 Re4 Re6 Re3 -1.18(5) . . . . ? Re2 Re4 Re6 Re3 -54.52(3) . . . . ? Re5 Re4 Re6 Re3 -109.37(3) . . . . ? P4 Re4 Re6 Re5 -124.46(14) . . . . ? Se12 Re4 Re6 Re5 1.56(5) . . . . ? Se10 Re4 Re6 Re5 178.64(5) . . . . ? Se13 Re4 Re6 Re5 -68.99(5) . . . . ? Se11 Re4 Re6 Re5 108.19(5) . . . . ? Re2 Re4 Re6 Re5 54.85(2) . . . . ? Re3 Re4 Re6 Re5 109.37(3) . . . . ? N1 Re1 Re5 P5 -0.7(3) . . . . ? Se9 Re1 Re5 P5 126.89(15) . . . . ? Se8 Re1 Re5 P5 -55.38(15) . . . . ? Se14 Re1 Re5 P5 57.37(15) . . . . ? Se7 Re1 Re5 P5 -125.48(15) . . . . ? Re2 Re1 Re5 P5 -124.53(15) . . . . ? Re3 Re1 Re5 P5 -179.16(15) . . . . ? Re6 Re1 Re5 P5 126.20(15) . . . . ? N1 Re1 Re5 Se8 54.7(3) . . . . ? Se9 Re1 Re5 Se8 -177.73(7) . . . . ? Se14 Re1 Re5 Se8 112.76(7) . . . . ? Se7 Re1 Re5 Se8 -70.10(7) . . . . ? Re2 Re1 Re5 Se8 -69.15(5) . . . . ? Re3 Re1 Re5 Se8 -123.77(5) . . . . ? Re6 Re1 Re5 Se8 -178.42(5) . . . . ? N1 Re1 Re5 Se13 -128.6(3) . . . . ? Se9 Re1 Re5 Se13 -0.96(8) . . . . ? Se8 Re1 Re5 Se13 176.77(7) . . . . ? Se14 Re1 Re5 Se13 -70.48(7) . . . . ? Se7 Re1 Re5 Se13 106.67(7) . . . . ? Re2 Re1 Re5 Se13 107.62(6) . . . . ? Re3 Re1 Re5 Se13 53.00(6) . . . . ? Re6 Re1 Re5 Se13 -1.65(5) . . . . ? N1 Re1 Re5 Se14 -58.1(3) . . . . ? Se9 Re1 Re5 Se14 69.51(7) . . . . ? Se8 Re1 Re5 Se14 -112.76(7) . . . . ? Se7 Re1 Re5 Se14 177.14(7) . . . . ? Re2 Re1 Re5 Se14 178.09(5) . . . . ? Re3 Re1 Re5 Se14 123.47(5) . . . . ? Re6 Re1 Re5 Se14 68.82(5) . . . . ? N1 Re1 Re5 Se12 125.0(3) . . . . ? Se9 Re1 Re5 Se12 -107.43(7) . . . . ? Se8 Re1 Re5 Se12 70.31(7) . . . . ? Se14 Re1 Re5 Se12 -176.94(7) . . . . ? Se7 Re1 Re5 Se12 0.21(7) . . . . ? Re2 Re1 Re5 Se12 1.16(5) . . . . ? Re3 Re1 Re5 Se12 -53.47(6) . . . . ? Re6 Re1 Re5 Se12 -108.11(6) . . . . ? N1 Re1 Re5 Re2 123.8(3) . . . . ? Se9 Re1 Re5 Re2 -108.58(6) . . . . ? Se8 Re1 Re5 Re2 69.15(5) . . . . ? Se14 Re1 Re5 Re2 -178.09(5) . . . . ? Se7 Re1 Re5 Re2 -0.95(5) . . . . ? Re3 Re1 Re5 Re2 -54.62(3) . . . . ? Re6 Re1 Re5 Re2 -109.27(3) . . . . ? N1 Re1 Re5 Re6 -126.9(3) . . . . ? Se9 Re1 Re5 Re6 0.69(5) . . . . ? Se8 Re1 Re5 Re6 178.42(5) . . . . ? Se14 Re1 Re5 Re6 -68.82(5) . . . . ? Se7 Re1 Re5 Re6 108.32(5) . . . . ? Re2 Re1 Re5 Re6 109.27(3) . . . . ? Re3 Re1 Re5 Re6 54.65(3) . . . . ? N1 Re1 Re5 Re4 178.3(3) . . . . ? Se9 Re1 Re5 Re4 -54.15(6) . . . . ? Se8 Re1 Re5 Re4 123.58(5) . . . . ? Se14 Re1 Re5 Re4 -123.66(5) . . . . ? Se7 Re1 Re5 Re4 53.48(5) . . . . ? Re2 Re1 Re5 Re4 54.44(3) . . . . ? Re3 Re1 Re5 Re4 -0.19(3) . . . . ? Re6 Re1 Re5 Re4 -54.83(3) . . . . ? N2 Re2 Re5 P5 -4.7(4) . . . . ? Se8 Re2 Re5 P5 51.30(18) . . . . ? Se12 Re2 Re5 P5 -60.32(18) . . . . ? Se11 Re2 Re5 P5 -130.74(18) . . . . ? Se7 Re2 Re5 P5 121.83(18) . . . . ? Re1 Re2 Re5 P5 120.88(18) . . . . ? Re3 Re2 Re5 P5 175.55(17) . . . . ? Re4 Re2 Re5 P5 -129.42(18) . . . . ? N2 Re2 Re5 Se8 -56.0(3) . . . . ? Se12 Re2 Re5 Se8 -111.62(6) . . . . ? Se11 Re2 Re5 Se8 177.96(6) . . . . ? Se7 Re2 Re5 Se8 70.53(6) . . . . ? Re1 Re2 Re5 Se8 69.59(5) . . . . ? Re3 Re2 Re5 Se8 124.25(5) . . . . ? Re4 Re2 Re5 Se8 179.29(5) . . . . ? N2 Re2 Re5 Se13 126.0(3) . . . . ? Se8 Re2 Re5 Se13 -177.95(6) . . . . ? Se12 Re2 Re5 Se13 70.43(7) . . . . ? Se11 Re2 Re5 Se13 0.01(7) . . . . ? Se7 Re2 Re5 Se13 -107.42(7) . . . . ? Re1 Re2 Re5 Se13 -108.37(5) . . . . ? Re3 Re2 Re5 Se13 -53.70(5) . . . . ? Re4 Re2 Re5 Se13 1.33(5) . . . . ? N2 Re2 Re5 Se14 -127.4(3) . . . . ? Se8 Re2 Re5 Se14 -71.43(7) . . . . ? Se12 Re2 Re5 Se14 176.95(7) . . . . ? Se11 Re2 Re5 Se14 106.53(7) . . . . ? Se7 Re2 Re5 Se14 -0.90(8) . . . . ? Re1 Re2 Re5 Se14 -1.85(5) . . . . ? Re3 Re2 Re5 Se14 52.82(6) . . . . ? Re4 Re2 Re5 Se14 107.85(5) . . . . ? N2 Re2 Re5 Se12 55.6(3) . . . . ? Se8 Re2 Re5 Se12 111.62(6) . . . . ? Se11 Re2 Re5 Se12 -70.42(7) . . . . ? Se7 Re2 Re5 Se12 -177.85(7) . . . . ? Re1 Re2 Re5 Se12 -178.80(5) . . . . ? Re3 Re2 Re5 Se12 -124.13(5) . . . . ? Re4 Re2 Re5 Se12 -69.10(5) . . . . ? N2 Re2 Re5 Re1 -125.6(3) . . . . ? Se8 Re2 Re5 Re1 -69.59(5) . . . . ? Se12 Re2 Re5 Re1 178.80(5) . . . . ? Se11 Re2 Re5 Re1 108.37(5) . . . . ? Se7 Re2 Re5 Re1 0.95(5) . . . . ? Re3 Re2 Re5 Re1 54.67(3) . . . . ? Re4 Re2 Re5 Re1 109.70(3) . . . . ? N2 Re2 Re5 Re6 179.6(3) . . . . ? Se8 Re2 Re5 Re6 -124.44(5) . . . . ? Se12 Re2 Re5 Re6 123.94(5) . . . . ? Se11 Re2 Re5 Re6 53.52(5) . . . . ? Se7 Re2 Re5 Re6 -53.91(5) . . . . ? Re1 Re2 Re5 Re6 -54.86(3) . . . . ? Re3 Re2 Re5 Re6 -0.19(3) . . . . ? Re4 Re2 Re5 Re6 54.84(3) . . . . ? N2 Re2 Re5 Re4 124.7(3) . . . . ? Se8 Re2 Re5 Re4 -179.29(5) . . . . ? Se12 Re2 Re5 Re4 69.10(5) . . . . ? Se11 Re2 Re5 Re4 -1.32(5) . . . . ? Se7 Re2 Re5 Re4 -108.75(5) . . . . ? Re1 Re2 Re5 Re4 -109.70(3) . . . . ? Re3 Re2 Re5 Re4 -55.03(3) . . . . ? P6 Re6 Re5 P5 5.2(2) . . . . ? Se14 Re6 Re5 P5 -51.54(18) . . . . ? Se10 Re6 Re5 P5 130.98(18) . . . . ? Se9 Re6 Re5 P5 -121.78(18) . . . . ? Se13 Re6 Re5 P5 60.60(18) . . . . ? Re1 Re6 Re5 P5 -121.10(18) . . . . ? Re3 Re6 Re5 P5 -175.47(18) . . . . ? Re4 Re6 Re5 P5 129.66(18) . . . . ? P6 Re6 Re5 Se8 127.79(15) . . . . ? Se14 Re6 Re5 Se8 71.10(6) . . . . ? Se10 Re6 Re5 Se8 -106.38(7) . . . . ? Se9 Re6 Re5 Se8 0.86(8) . . . . ? Se13 Re6 Re5 Se8 -176.76(7) . . . . ? Re1 Re6 Re5 Se8 1.54(5) . . . . ? Re3 Re6 Re5 Se8 -52.83(6) . . . . ? Re4 Re6 Re5 Se8 -107.69(5) . . . . ? P6 Re6 Re5 Se13 -55.44(15) . . . . ? Se14 Re6 Re5 Se13 -112.14(6) . . . . ? Se10 Re6 Re5 Se13 70.39(6) . . . . ? Se9 Re6 Re5 Se13 177.62(7) . . . . ? Re1 Re6 Re5 Se13 178.30(5) . . . . ? Re3 Re6 Re5 Se13 123.93(5) . . . . ? Re4 Re6 Re5 Se13 69.07(5) . . . . ? P6 Re6 Re5 Se14 56.70(15) . . . . ? Se10 Re6 Re5 Se14 -177.48(6) . . . . ? Se9 Re6 Re5 Se14 -70.24(6) . . . . ? Se13 Re6 Re5 Se14 112.14(6) . . . . ? Re1 Re6 Re5 Se14 -69.56(5) . . . . ? Re3 Re6 Re5 Se14 -123.93(5) . . . . ? Re4 Re6 Re5 Se14 -178.79(5) . . . . ? P6 Re6 Re5 Se12 -126.06(15) . . . . ? Se14 Re6 Re5 Se12 177.24(6) . . . . ? Se10 Re6 Re5 Se12 -0.23(7) . . . . ? Se9 Re6 Re5 Se12 107.00(7) . . . . ? Se13 Re6 Re5 Se12 -70.62(7) . . . . ? Re1 Re6 Re5 Se12 107.68(5) . . . . ? Re3 Re6 Re5 Se12 53.31(5) . . . . ? Re4 Re6 Re5 Se12 -1.55(5) . . . . ? P6 Re6 Re5 Re1 126.26(14) . . . . ? Se14 Re6 Re5 Re1 69.56(5) . . . . ? Se10 Re6 Re5 Re1 -107.91(5) . . . . ? Se9 Re6 Re5 Re1 -0.68(5) . . . . ? Se13 Re6 Re5 Re1 -178.30(5) . . . . ? Re3 Re6 Re5 Re1 -54.37(3) . . . . ? Re4 Re6 Re5 Re1 -109.23(3) . . . . ? P6 Re6 Re5 Re2 -179.18(14) . . . . ? Se14 Re6 Re5 Re2 124.12(5) . . . . ? Se10 Re6 Re5 Re2 -53.36(5) . . . . ? Se9 Re6 Re5 Re2 53.88(5) . . . . ? Se13 Re6 Re5 Re2 -123.74(5) . . . . ? Re1 Re6 Re5 Re2 54.56(3) . . . . ? Re3 Re6 Re5 Re2 0.19(3) . . . . ? Re4 Re6 Re5 Re2 -54.67(3) . . . . ? P6 Re6 Re5 Re4 -124.51(14) . . . . ? Se14 Re6 Re5 Re4 178.79(5) . . . . ? Se10 Re6 Re5 Re4 1.32(5) . . . . ? Se9 Re6 Re5 Re4 108.55(5) . . . . ? Se13 Re6 Re5 Re4 -69.07(5) . . . . ? Re1 Re6 Re5 Re4 109.23(3) . . . . ? Re3 Re6 Re5 Re4 54.87(3) . . . . ? P4 Re4 Re5 P5 -3.6(2) . . . . ? Se12 Re4 Re5 P5 55.34(17) . . . . ? Se10 Re4 Re5 P5 -127.59(17) . . . . ? Se13 Re4 Re5 P5 -56.87(17) . . . . ? Se11 Re4 Re5 P5 125.82(17) . . . . ? Re2 Re4 Re5 P5 124.51(17) . . . . ? Re6 Re4 Re5 P5 -126.27(17) . . . . ? Re3 Re4 Re5 P5 179.04(16) . . . . ? P4 Re4 Re5 Se8 -128.77(15) . . . . ? Se12 Re4 Re5 Se8 -69.86(6) . . . . ? Se10 Re4 Re5 Se8 107.21(6) . . . . ? Se13 Re4 Re5 Se8 177.93(6) . . . . ? Se11 Re4 Re5 Se8 0.62(7) . . . . ? Re2 Re4 Re5 Se8 -0.69(5) . . . . ? Re6 Re4 Re5 Se8 108.53(5) . . . . ? Re3 Re4 Re5 Se8 53.84(5) . . . . ? P4 Re4 Re5 Se13 53.30(15) . . . . ? Se12 Re4 Re5 Se13 112.21(6) . . . . ? Se10 Re4 Re5 Se13 -70.72(6) . . . . ? Se11 Re4 Re5 Se13 -177.31(6) . . . . ? Re2 Re4 Re5 Se13 -178.62(5) . . . . ? Re6 Re4 Re5 Se13 -69.40(5) . . . . ? Re3 Re4 Re5 Se13 -124.09(5) . . . . ? P4 Re4 Re5 Se14 123.86(15) . . . . ? Se12 Re4 Re5 Se14 -177.23(6) . . . . ? Se10 Re4 Re5 Se14 -0.16(7) . . . . ? Se13 Re4 Re5 Se14 70.56(6) . . . . ? Se11 Re4 Re5 Se14 -106.75(6) . . . . ? Re2 Re4 Re5 Se14 -108.06(5) . . . . ? Re6 Re4 Re5 Se14 1.16(5) . . . . ? Re3 Re4 Re5 Se14 -53.53(5) . . . . ? P4 Re4 Re5 Se12 -58.91(15) . . . . ? Se10 Re4 Re5 Se12 177.07(6) . . . . ? Se13 Re4 Re5 Se12 -112.21(6) . . . . ? Se11 Re4 Re5 Se12 70.48(6) . . . . ? Re2 Re4 Re5 Se12 69.17(5) . . . . ? Re6 Re4 Re5 Se12 178.39(5) . . . . ? Re3 Re4 Re5 Se12 123.70(5) . . . . ? P4 Re4 Re5 Re1 177.58(15) . . . . ? Se12 Re4 Re5 Re1 -123.51(5) . . . . ? Se10 Re4 Re5 Re1 53.56(5) . . . . ? Se13 Re4 Re5 Re1 124.28(5) . . . . ? Se11 Re4 Re5 Re1 -53.03(5) . . . . ? Re2 Re4 Re5 Re1 -54.34(2) . . . . ? Re6 Re4 Re5 Re1 54.88(2) . . . . ? Re3 Re4 Re5 Re1 0.19(3) . . . . ? P4 Re4 Re5 Re2 -128.08(15) . . . . ? Se12 Re4 Re5 Re2 -69.17(5) . . . . ? Se10 Re4 Re5 Re2 107.90(5) . . . . ? Se13 Re4 Re5 Re2 178.62(5) . . . . ? Se11 Re4 Re5 Re2 1.31(5) . . . . ? Re6 Re4 Re5 Re2 109.22(3) . . . . ? Re3 Re4 Re5 Re2 54.53(3) . . . . ? P4 Re4 Re5 Re6 122.70(15) . . . . ? Se12 Re4 Re5 Re6 -178.39(5) . . . . ? Se10 Re4 Re5 Re6 -1.32(5) . . . . ? Se13 Re4 Re5 Re6 69.40(5) . . . . ? Se11 Re4 Re5 Re6 -107.91(5) . . . . ? Re2 Re4 Re5 Re6 -109.22(3) . . . . ? Re3 Re4 Re5 Re6 -54.69(2) . . . . ? P3 Re3 Se7 Re2 144.93(11) . . . . ? Se11 Re3 Se7 Re2 52.26(5) . . . . ? Se10 Re3 Se7 Re2 -32.0(9) . . . . ? Se9 Re3 Se7 Re2 -123.67(5) . . . . ? Re1 Re3 Se7 Re2 -71.36(3) . . . . ? Re6 Re3 Se7 Re2 -70.45(5) . . . . ? Re4 Re3 Se7 Re2 -1.07(5) . . . . ? P3 Re3 Se7 Re1 -143.71(11) . . . . ? Se11 Re3 Se7 Re1 123.63(5) . . . . ? Se10 Re3 Se7 Re1 39.3(9) . . . . ? Se9 Re3 Se7 Re1 -52.30(4) . . . . ? Re2 Re3 Se7 Re1 71.36(3) . . . . ? Re6 Re3 Se7 Re1 0.91(5) . . . . ? Re4 Re3 Se7 Re1 70.30(5) . . . . ? N2 Re2 Se7 Re3 -144.1(2) . . . . ? Se8 Re2 Se7 Re3 124.31(5) . . . . ? Se12 Re2 Se7 Re3 37.5(11) . . . . ? Se11 Re2 Se7 Re3 -52.39(5) . . . . ? Re1 Re2 Se7 Re3 71.90(4) . . . . ? Re4 Re2 Se7 Re3 1.08(5) . . . . ? Re5 Re2 Se7 Re3 70.94(5) . . . . ? N2 Re2 Se7 Re1 144.0(2) . . . . ? Se8 Re2 Se7 Re1 52.41(5) . . . . ? Se12 Re2 Se7 Re1 -34.4(11) . . . . ? Se11 Re2 Se7 Re1 -124.29(5) . . . . ? Re3 Re2 Se7 Re1 -71.90(4) . . . . ? Re4 Re2 Se7 Re1 -70.82(5) . . . . ? Re5 Re2 Se7 Re1 -0.96(5) . . . . ? N1 Re1 Se7 Re3 146.1(2) . . . . ? Se9 Re1 Se7 Re3 52.62(5) . . . . ? Se8 Re1 Se7 Re3 -124.18(5) . . . . ? Se14 Re1 Se7 Re3 -26.3(9) . . . . ? Re2 Re1 Se7 Re3 -71.90(4) . . . . ? Re5 Re1 Se7 Re3 -70.93(5) . . . . ? Re6 Re1 Se7 Re3 -0.91(5) . . . . ? N1 Re1 Se7 Re2 -142.0(2) . . . . ? Se9 Re1 Se7 Re2 124.51(5) . . . . ? Se8 Re1 Se7 Re2 -52.29(5) . . . . ? Se14 Re1 Se7 Re2 45.6(9) . . . . ? Re5 Re1 Se7 Re2 0.97(5) . . . . ? Re3 Re1 Se7 Re2 71.90(4) . . . . ? Re6 Re1 Se7 Re2 70.98(4) . . . . ? N2 Re2 Se8 Re5 143.6(2) . . . . ? Se12 Re2 Se8 Re5 52.47(5) . . . . ? Se11 Re2 Se8 Re5 -32.7(10) . . . . ? Se7 Re2 Se8 Re5 -124.20(5) . . . . ? Re1 Re2 Se8 Re5 -71.73(3) . . . . ? Re3 Re2 Se8 Re5 -70.67(4) . . . . ? Re4 Re2 Se8 Re5 -0.71(5) . . . . ? N2 Re2 Se8 Re1 -144.6(2) . . . . ? Se12 Re2 Se8 Re1 124.20(5) . . . . ? Se11 Re2 Se8 Re1 39.0(10) . . . . ? Se7 Re2 Se8 Re1 -52.48(4) . . . . ? Re3 Re2 Se8 Re1 1.06(5) . . . . ? Re4 Re2 Se8 Re1 71.02(4) . . . . ? Re5 Re2 Se8 Re1 71.73(3) . . . . ? P5 Re5 Se8 Re2 -146.21(12) . . . . ? Se13 Re5 Se8 Re2 26.6(9) . . . . ? Se14 Re5 Se8 Re2 123.39(5) . . . . ? Se12 Re5 Se8 Re2 -52.23(5) . . . . ? Re1 Re5 Se8 Re2 71.44(4) . . . . ? Re6 Re5 Se8 Re2 69.88(5) . . . . ? Re4 Re5 Se8 Re2 0.70(5) . . . . ? P5 Re5 Se8 Re1 142.34(12) . . . . ? Se13 Re5 Se8 Re1 -44.8(9) . . . . ? Se14 Re5 Se8 Re1 51.95(5) . . . . ? Se12 Re5 Se8 Re1 -123.67(5) . . . . ? Re2 Re5 Se8 Re1 -71.44(4) . . . . ? Re6 Re5 Se8 Re1 -1.56(5) . . . . ? Re4 Re5 Se8 Re1 -70.74(5) . . . . ? N1 Re1 Se8 Re2 144.4(2) . . . . ? Se9 Re1 Se8 Re2 -34.1(10) . . . . ? Se14 Re1 Se8 Re2 -124.17(5) . . . . ? Se7 Re1 Se8 Re2 52.40(5) . . . . ? Re5 Re1 Se8 Re2 -72.32(4) . . . . ? Re3 Re1 Se8 Re2 -1.06(5) . . . . ? Re6 Re1 Se8 Re2 -70.76(5) . . . . ? N1 Re1 Se8 Re5 -143.3(2) . . . . ? Se9 Re1 Se8 Re5 38.2(10) . . . . ? Se14 Re1 Se8 Re5 -51.85(5) . . . . ? Se7 Re1 Se8 Re5 124.72(5) . . . . ? Re2 Re1 Se8 Re5 72.32(4) . . . . ? Re3 Re1 Se8 Re5 71.27(5) . . . . ? Re6 Re1 Se8 Re5 1.57(5) . . . . ? N1 Re1 Se9 Re3 -144.4(2) . . . . ? Se8 Re1 Se9 Re3 34.1(10) . . . . ? Se14 Re1 Se9 Re3 124.16(5) . . . . ? Se7 Re1 Se9 Re3 -52.44(5) . . . . ? Re2 Re1 Se9 Re3 1.00(5) . . . . ? Re5 Re1 Se9 Re3 71.14(5) . . . . ? Re6 Re1 Se9 Re3 71.84(4) . . . . ? N1 Re1 Se9 Re6 143.7(2) . . . . ? Se8 Re1 Se9 Re6 -37.8(10) . . . . ? Se14 Re1 Se9 Re6 52.32(5) . . . . ? Se7 Re1 Se9 Re6 -124.28(5) . . . . ? Re2 Re1 Se9 Re6 -70.85(5) . . . . ? Re5 Re1 Se9 Re6 -0.70(5) . . . . ? Re3 Re1 Se9 Re6 -71.84(4) . . . . ? P3 Re3 Se9 Re1 145.92(10) . . . . ? Se11 Re3 Se9 Re1 -29.6(8) . . . . ? Se7 Re3 Se9 Re1 52.54(4) . . . . ? Se10 Re3 Se9 Re1 -123.49(5) . . . . ? Re2 Re3 Se9 Re1 -0.98(5) . . . . ? Re6 Re3 Se9 Re1 -71.92(3) . . . . ? Re4 Re3 Se9 Re1 -69.98(5) . . . . ? P3 Re3 Se9 Re6 -142.17(10) . . . . ? Se11 Re3 Se9 Re6 42.3(8) . . . . ? Se7 Re3 Se9 Re6 124.46(5) . . . . ? Se10 Re3 Se9 Re6 -51.58(5) . . . . ? Re2 Re3 Se9 Re6 70.93(4) . . . . ? Re1 Re3 Se9 Re6 71.92(3) . . . . ? Re4 Re3 Se9 Re6 1.93(5) . . . . ? P6 Re6 Se9 Re1 -143.62(11) . . . . ? Se14 Re6 Se9 Re1 -52.56(5) . . . . ? Se10 Re6 Se9 Re1 123.43(5) . . . . ? Se13 Re6 Se9 Re1 27.5(8) . . . . ? Re3 Re6 Se9 Re1 71.74(4) . . . . ? Re4 Re6 Se9 Re1 69.81(5) . . . . ? Re5 Re6 Se9 Re1 0.69(5) . . . . ? P6 Re6 Se9 Re3 144.64(11) . . . . ? Se14 Re6 Se9 Re3 -124.30(5) . . . . ? Se10 Re6 Se9 Re3 51.69(5) . . . . ? Se13 Re6 Se9 Re3 -44.2(8) . . . . ? Re1 Re6 Se9 Re3 -71.74(4) . . . . ? Re4 Re6 Se9 Re3 -1.93(5) . . . . ? Re5 Re6 Se9 Re3 -71.05(5) . . . . ? P4 Re4 Se10 Re6 -142.32(11) . . . . ? Se12 Re4 Se10 Re6 38.6(8) . . . . ? Se13 Re4 Se10 Re6 -52.06(5) . . . . ? Se11 Re4 Se10 Re6 123.80(5) . . . . ? Re2 Re4 Se10 Re6 70.47(5) . . . . ? Re5 Re4 Se10 Re6 1.34(5) . . . . ? Re3 Re4 Se10 Re6 71.79(4) . . . . ? P4 Re4 Se10 Re3 145.89(11) . . . . ? Se12 Re4 Se10 Re3 -33.2(8) . . . . ? Se13 Re4 Se10 Re3 -123.85(5) . . . . ? Se11 Re4 Se10 Re3 52.00(5) . . . . ? Re2 Re4 Se10 Re3 -1.32(5) . . . . ? Re6 Re4 Se10 Re3 -71.79(4) . . . . ? Re5 Re4 Se10 Re3 -70.45(5) . . . . ? P6 Re6 Se10 Re4 142.41(10) . . . . ? Se14 Re6 Se10 Re4 -33.8(8) . . . . ? Se9 Re6 Se10 Re4 -123.71(5) . . . . ? Se13 Re6 Se10 Re4 51.83(4) . . . . ? Re1 Re6 Se10 Re4 -70.09(4) . . . . ? Re3 Re6 Se10 Re4 -72.04(3) . . . . ? Re5 Re6 Se10 Re4 -1.34(5) . . . . ? P6 Re6 Se10 Re3 -145.55(10) . . . . ? Se14 Re6 Se10 Re3 38.2(8) . . . . ? Se9 Re6 Se10 Re3 -51.67(4) . . . . ? Se13 Re6 Se10 Re3 123.88(5) . . . . ? Re1 Re6 Se10 Re3 1.96(5) . . . . ? Re4 Re6 Se10 Re3 72.04(3) . . . . ? Re5 Re6 Se10 Re3 70.70(4) . . . . ? P3 Re3 Se10 Re4 -144.79(11) . . . . ? Se11 Re3 Se10 Re4 -52.13(5) . . . . ? Se7 Re3 Se10 Re4 32.2(9) . . . . ? Se9 Re3 Se10 Re4 123.77(5) . . . . ? Re2 Re3 Se10 Re4 1.32(5) . . . . ? Re1 Re3 Se10 Re4 70.08(5) . . . . ? Re6 Re3 Se10 Re4 72.04(4) . . . . ? P3 Re3 Se10 Re6 143.16(11) . . . . ? Se11 Re3 Se10 Re6 -124.17(5) . . . . ? Se7 Re3 Se10 Re6 -39.9(9) . . . . ? Se9 Re3 Se10 Re6 51.73(4) . . . . ? Re2 Re3 Se10 Re6 -70.72(5) . . . . ? Re1 Re3 Se10 Re6 -1.96(5) . . . . ? Re4 Re3 Se10 Re6 -72.04(4) . . . . ? N2 Re2 Se11 Re3 144.5(2) . . . . ? Se8 Re2 Se11 Re3 -39.2(10) . . . . ? Se12 Re2 Se11 Re3 -124.33(5) . . . . ? Se7 Re2 Se11 Re3 52.35(4) . . . . ? Re1 Re2 Se11 Re3 -1.33(5) . . . . ? Re4 Re2 Se11 Re3 -72.18(3) . . . . ? Re5 Re2 Se11 Re3 -70.84(4) . . . . ? N2 Re2 Se11 Re4 -143.3(2) . . . . ? Se8 Re2 Se11 Re4 33.0(10) . . . . ? Se12 Re2 Se11 Re4 -52.14(5) . . . . ? Se7 Re2 Se11 Re4 124.53(5) . . . . ? Re1 Re2 Se11 Re4 70.86(4) . . . . ? Re3 Re2 Se11 Re4 72.18(3) . . . . ? Re5 Re2 Se11 Re4 1.35(5) . . . . ? P3 Re3 Se11 Re2 -145.75(10) . . . . ? Se7 Re3 Se11 Re2 -52.37(4) . . . . ? Se10 Re3 Se11 Re2 123.68(5) . . . . ? Se9 Re3 Se11 Re2 29.8(8) . . . . ? Re1 Re3 Se11 Re2 1.31(5) . . . . ? Re6 Re3 Se11 Re2 70.51(5) . . . . ? Re4 Re3 Se11 Re2 71.71(4) . . . . ? P3 Re3 Se11 Re4 142.53(10) . . . . ? Se7 Re3 Se11 Re4 -124.09(5) . . . . ? Se10 Re3 Se11 Re4 51.97(5) . . . . ? Se9 Re3 Se11 Re4 -41.9(8) . . . . ? Re2 Re3 Se11 Re4 -71.71(4) . . . . ? Re1 Re3 Se11 Re4 -70.40(5) . . . . ? Re6 Re3 Se11 Re4 -1.21(5) . . . . ? P4 Re4 Se11 Re2 145.05(11) . . . . ? Se12 Re4 Se11 Re2 52.09(5) . . . . ? Se10 Re4 Se11 Re2 -123.80(5) . . . . ? Se13 Re4 Se11 Re2 -34.9(8) . . . . ? Re6 Re4 Se11 Re2 -70.49(5) . . . . ? Re5 Re4 Se11 Re2 -1.34(5) . . . . ? Re3 Re4 Se11 Re2 -71.69(4) . . . . ? P4 Re4 Se11 Re3 -143.26(11) . . . . ? Se12 Re4 Se11 Re3 123.78(5) . . . . ? Se10 Re4 Se11 Re3 -52.11(5) . . . . ? Se13 Re4 Se11 Re3 36.7(8) . . . . ? Re2 Re4 Se11 Re3 71.69(4) . . . . ? Re6 Re4 Se11 Re3 1.20(5) . . . . ? Re5 Re4 Se11 Re3 70.35(5) . . . . ? N2 Re2 Se12 Re4 144.1(2) . . . . ? Se8 Re2 Se12 Re4 -124.41(5) . . . . ? Se11 Re2 Se12 Re4 52.29(5) . . . . ? Se7 Re2 Se12 Re4 -37.5(11) . . . . ? Re1 Re2 Se12 Re4 -70.92(5) . . . . ? Re3 Re2 Se12 Re4 -1.25(6) . . . . ? Re5 Re2 Se12 Re4 -72.11(4) . . . . ? N2 Re2 Se12 Re5 -143.8(2) . . . . ? Se8 Re2 Se12 Re5 -52.30(5) . . . . ? Se11 Re2 Se12 Re5 124.40(5) . . . . ? Se7 Re2 Se12 Re5 34.6(11) . . . . ? Re1 Re2 Se12 Re5 1.18(5) . . . . ? Re3 Re2 Se12 Re5 70.86(5) . . . . ? Re4 Re2 Se12 Re5 72.11(4) . . . . ? P4 Re4 Se12 Re2 -145.93(11) . . . . ? Se10 Re4 Se12 Re2 33.2(8) . . . . ? Se13 Re4 Se12 Re2 123.82(5) . . . . ? Se11 Re4 Se12 Re2 -52.05(5) . . . . ? Re6 Re4 Se12 Re2 70.28(5) . . . . ? Re5 Re4 Se12 Re2 71.87(4) . . . . ? Re3 Re4 Se12 Re2 1.23(5) . . . . ? P4 Re4 Se12 Re5 142.20(11) . . . . ? Se10 Re4 Se12 Re5 -38.7(8) . . . . ? Se13 Re4 Se12 Re5 51.95(5) . . . . ? Se11 Re4 Se12 Re5 -123.91(5) . . . . ? Re2 Re4 Se12 Re5 -71.87(4) . . . . ? Re6 Re4 Se12 Re5 -1.58(5) . . . . ? Re3 Re4 Se12 Re5 -70.64(5) . . . . ? P5 Re5 Se12 Re2 141.64(12) . . . . ? Se8 Re5 Se12 Re2 52.27(5) . . . . ? Se13 Re5 Se12 Re2 -123.77(5) . . . . ? Se14 Re5 Se12 Re2 -37.8(8) . . . . ? Re1 Re5 Se12 Re2 -1.17(5) . . . . ? Re6 Re5 Se12 Re2 -70.20(5) . . . . ? Re4 Re5 Se12 Re2 -71.78(4) . . . . ? P5 Re5 Se12 Re4 -146.58(12) . . . . ? Se8 Re5 Se12 Re4 124.05(5) . . . . ? Se13 Re5 Se12 Re4 -51.99(5) . . . . ? Se14 Re5 Se12 Re4 33.9(8) . . . . ? Re1 Re5 Se12 Re4 70.60(5) . . . . ? Re2 Re5 Se12 Re4 71.78(4) . . . . ? Re6 Re5 Se12 Re4 1.58(5) . . . . ? P5 Re5 Se13 Re4 145.86(12) . . . . ? Se8 Re5 Se13 Re4 -27.0(9) . . . . ? Se14 Re5 Se13 Re4 -123.75(5) . . . . ? Se12 Re5 Se13 Re4 51.88(5) . . . . ? Re1 Re5 Se13 Re4 -70.16(5) . . . . ? Re2 Re5 Se13 Re4 -1.35(5) . . . . ? Re6 Re5 Se13 Re4 -71.83(4) . . . . ? P5 Re5 Se13 Re6 -142.30(12) . . . . ? Se8 Re5 Se13 Re6 44.9(9) . . . . ? Se14 Re5 Se13 Re6 -51.92(5) . . . . ? Se12 Re5 Se13 Re6 123.71(5) . . . . ? Re1 Re5 Se13 Re6 1.68(5) . . . . ? Re2 Re5 Se13 Re6 70.48(5) . . . . ? Re4 Re5 Se13 Re6 71.83(4) . . . . ? P4 Re4 Se13 Re5 -145.03(10) . . . . ? Se12 Re4 Se13 Re5 -52.08(5) . . . . ? Se10 Re4 Se13 Re5 123.80(5) . . . . ? Se11 Re4 Se13 Re5 35.0(8) . . . . ? Re2 Re4 Se13 Re5 1.36(5) . . . . ? Re6 Re4 Se13 Re5 71.90(4) . . . . ? Re3 Re4 Se13 Re5 70.29(5) . . . . ? P4 Re4 Se13 Re6 143.06(11) . . . . ? Se12 Re4 Se13 Re6 -123.98(5) . . . . ? Se10 Re4 Se13 Re6 51.90(5) . . . . ? Se11 Re4 Se13 Re6 -36.9(8) . . . . ? Re2 Re4 Se13 Re6 -70.55(5) . . . . ? Re5 Re4 Se13 Re6 -71.90(4) . . . . ? Re3 Re4 Se13 Re6 -1.61(5) . . . . ? P6 Re6 Se13 Re5 143.14(11) . . . . ? Se14 Re6 Se13 Re5 52.05(5) . . . . ? Se10 Re6 Se13 Re5 -123.95(5) . . . . ? Se9 Re6 Se13 Re5 -28.0(8) . . . . ? Re1 Re6 Se13 Re5 -1.66(5) . . . . ? Re3 Re6 Se13 Re5 -70.47(5) . . . . ? Re4 Re6 Se13 Re5 -72.08(4) . . . . ? P6 Re6 Se13 Re4 -144.78(11) . . . . ? Se14 Re6 Se13 Re4 124.13(5) . . . . ? Se10 Re6 Se13 Re4 -51.87(5) . . . . ? Se9 Re6 Se13 Re4 44.1(8) . . . . ? Re1 Re6 Se13 Re4 70.42(5) . . . . ? Re3 Re6 Se13 Re4 1.62(5) . . . . ? Re5 Re6 Se13 Re4 72.08(4) . . . . ? P6 Re6 Se14 Re5 -142.49(10) . . . . ? Se10 Re6 Se14 Re5 33.7(8) . . . . ? Se9 Re6 Se14 Re5 123.67(5) . . . . ? Se13 Re6 Se14 Re5 -51.92(5) . . . . ? Re1 Re6 Se14 Re5 71.39(3) . . . . ? Re3 Re6 Se14 Re5 70.56(4) . . . . ? Re4 Re6 Se14 Re5 1.19(5) . . . . ? P6 Re6 Se14 Re1 146.12(10) . . . . ? Se10 Re6 Se14 Re1 -37.7(8) . . . . ? Se9 Re6 Se14 Re1 52.28(4) . . . . ? Se13 Re6 Se14 Re1 -123.31(5) . . . . ? Re3 Re6 Se14 Re1 -0.83(5) . . . . ? Re4 Re6 Se14 Re1 -70.20(4) . . . . ? Re5 Re6 Se14 Re1 -71.39(3) . . . . ? P5 Re5 Se14 Re6 146.78(12) . . . . ? Se8 Re5 Se14 Re6 -123.81(5) . . . . ? Se13 Re5 Se14 Re6 52.19(5) . . . . ? Se12 Re5 Se14 Re6 -33.7(8) . . . . ? Re1 Re5 Se14 Re6 -71.92(3) . . . . ? Re2 Re5 Se14 Re6 -70.05(5) . . . . ? Re4 Re5 Se14 Re6 -1.18(5) . . . . ? P5 Re5 Se14 Re1 -141.30(12) . . . . ? Se8 Re5 Se14 Re1 -51.89(5) . . . . ? Se13 Re5 Se14 Re1 124.11(5) . . . . ? Se12 Re5 Se14 Re1 38.2(8) . . . . ? Re2 Re5 Se14 Re1 1.87(5) . . . . ? Re6 Re5 Se14 Re1 71.92(3) . . . . ? Re4 Re5 Se14 Re1 70.73(5) . . . . ? N1 Re1 Se14 Re6 -146.2(2) . . . . ? Se9 Re1 Se14 Re6 -52.66(5) . . . . ? Se8 Re1 Se14 Re6 124.13(5) . . . . ? Se7 Re1 Se14 Re6 26.2(9) . . . . ? Re2 Re1 Se14 Re6 70.44(5) . . . . ? Re5 Re1 Se14 Re6 72.33(4) . . . . ? Re3 Re1 Se14 Re6 0.84(5) . . . . ? N1 Re1 Se14 Re5 141.5(2) . . . . ? Se9 Re1 Se14 Re5 -124.99(5) . . . . ? Se8 Re1 Se14 Re5 51.80(5) . . . . ? Se7 Re1 Se14 Re5 -46.1(9) . . . . ? Re2 Re1 Se14 Re5 -1.89(5) . . . . ? Re3 Re1 Se14 Re5 -71.50(5) . . . . ? Re6 Re1 Se14 Re5 -72.33(4) . . . . ? Se9 Re1 N1 C11 -129.3(4) . . . . ? Se8 Re1 N1 C11 50.8(4) . . . . ? Se14 Re1 N1 C11 -39.6(4) . . . . ? Se7 Re1 N1 C11 140.8(4) . . . . ? Re2 Re1 N1 C11 94.1(5) . . . . ? Re5 Re1 N1 C11 6.8(6) . . . . ? Re3 Re1 N1 C11 -175.5(3) . . . . ? Re6 Re1 N1 C11 -82.6(5) . . . . ? Se9 Re1 N1 C15 58.4(4) . . . . ? Se8 Re1 N1 C15 -121.5(4) . . . . ? Se14 Re1 N1 C15 148.1(4) . . . . ? Se7 Re1 N1 C15 -31.5(4) . . . . ? Re2 Re1 N1 C15 -78.1(5) . . . . ? Re5 Re1 N1 C15 -165.5(4) . . . . ? Re3 Re1 N1 C15 12.2(6) . . . . ? Re6 Re1 N1 C15 105.1(4) . . . . ? C15 N1 C11 C12 0.0 . . . . ? Re1 N1 C11 C12 -172.3(6) . . . . ? N1 C11 C12 C13 0.0 . . . . ? C11 C12 C13 C14 0.0 . . . . ? C11 C12 C13 C161 176.3(11) . . . . ? C12 C13 C14 C15 0.0 . . . . ? C161 C13 C14 C15 -176.0(12) . . . . ? C13 C14 C15 N1 0.0 . . . . ? C11 N1 C15 C14 0.0 . . . . ? Re1 N1 C15 C14 172.2(6) . . . . ? C14 C13 C161 O111 -149.9(14) . . . . ? C12 C13 C161 O111 34(2) . . . . ? C14 C13 C161 N121 26(2) . . . . ? C12 C13 C161 N121 -150.6(12) . . . . ? Se8 Re2 N2 C21 39.2(4) . . . . ? Se12 Re2 N2 C21 128.9(4) . . . . ? Se11 Re2 N2 C21 -141.0(4) . . . . ? Se7 Re2 N2 C21 -51.0(4) . . . . ? Re1 Re2 N2 C21 -5.4(6) . . . . ? Re3 Re2 N2 C21 -96.2(5) . . . . ? Re4 Re2 N2 C21 173.4(3) . . . . ? Re5 Re2 N2 C21 84.1(5) . . . . ? Se8 Re2 N2 C25 -137.5(5) . . . . ? Se12 Re2 N2 C25 -47.8(5) . . . . ? Se11 Re2 N2 C25 42.3(5) . . . . ? Se7 Re2 N2 C25 132.3(5) . . . . ? Re1 Re2 N2 C25 177.9(4) . . . . ? Re3 Re2 N2 C25 87.0(5) . . . . ? Re4 Re2 N2 C25 -3.3(6) . . . . ? Re5 Re2 N2 C25 -92.6(5) . . . . ? C25 N2 C21 C22 0.0 . . . . ? Re2 N2 C21 C22 -176.8(6) . . . . ? N2 C21 C22 C23 0.0 . . . . ? C21 C22 C23 C24 0.0 . . . . ? C21 C22 C23 C261 -179.3(11) . . . . ? C22 C23 C24 C25 0.0 . . . . ? C261 C23 C24 C25 179.4(10) . . . . ? C23 C24 C25 N2 0.0 . . . . ? C21 N2 C25 C24 0.0 . . . . ? Re2 N2 C25 C24 176.7(6) . . . . ? C24 C23 C261 N211 -45(2) . . . . ? C22 C23 C261 N211 133.9(16) . . . . ? C24 C23 C261 O221 146.4(19) . . . . ? C22 C23 C261 O221 -34(2) . . . . ? Se11 Re3 P3 C33 -40.5(6) . . . . ? Se7 Re3 P3 C33 -130.5(6) . . . . ? Se10 Re3 P3 C33 49.3(6) . . . . ? Se9 Re3 P3 C33 139.8(6) . . . . ? Re2 Re3 P3 C33 -84.8(6) . . . . ? Re1 Re3 P3 C33 -177.0(6) . . . . ? Re6 Re3 P3 C33 93.9(6) . . . . ? Re4 Re3 P3 C33 6.0(6) . . . . ? Se11 Re3 P3 C32 -162.9(7) . . . . ? Se7 Re3 P3 C32 107.1(7) . . . . ? Se10 Re3 P3 C32 -73.1(7) . . . . ? Se9 Re3 P3 C32 17.4(7) . . . . ? Re2 Re3 P3 C32 152.8(6) . . . . ? Re1 Re3 P3 C32 60.6(7) . . . . ? Re6 Re3 P3 C32 -28.6(7) . . . . ? Re4 Re3 P3 C32 -116.4(6) . . . . ? Se11 Re3 P3 C31 78.4(7) . . . . ? Se7 Re3 P3 C31 -11.6(7) . . . . ? Se10 Re3 P3 C31 168.2(7) . . . . ? Se9 Re3 P3 C31 -101.3(7) . . . . ? Re2 Re3 P3 C31 34.0(7) . . . . ? Re1 Re3 P3 C31 -58.1(7) . . . . ? Re6 Re3 P3 C31 -147.3(6) . . . . ? Re4 Re3 P3 C31 124.9(6) . . . . ? C33 P3 C31 C34 54.6(16) . . . . ? C32 P3 C31 C34 164.5(15) . . . . ? Re3 P3 C31 C34 -69.3(15) . . . . ? C33 P3 C32 C35 -60.1(15) . . . . ? C31 P3 C32 C35 -168.6(14) . . . . ? Re3 P3 C32 C35 66.2(15) . . . . ? C32 P3 C33 C36 -47.9(16) . . . . ? C31 P3 C33 C36 59.5(15) . . . . ? Re3 P3 C33 C36 -175.9(12) . . . . ? Se12 Re4 P4 C43 -11.2(5) . . . . ? Se10 Re4 P4 C43 168.9(5) . . . . ? Se13 Re4 P4 C43 78.8(5) . . . . ? Se11 Re4 P4 C43 -101.2(5) . . . . ? Re2 Re4 P4 C43 -55.6(6) . . . . ? Re6 Re4 P4 C43 123.4(5) . . . . ? Re5 Re4 P4 C43 35.8(6) . . . . ? Re3 Re4 P4 C43 -148.0(5) . . . . ? Se12 Re4 P4 C41 -131.7(7) . . . . ? Se10 Re4 P4 C41 48.4(7) . . . . ? Se13 Re4 P4 C41 -41.8(7) . . . . ? Se11 Re4 P4 C41 138.2(7) . . . . ? Re2 Re4 P4 C41 -176.1(6) . . . . ? Re6 Re4 P4 C41 2.9(7) . . . . ? Re5 Re4 P4 C41 -84.8(7) . . . . ? Re3 Re4 P4 C41 91.5(7) . . . . ? Se12 Re4 P4 C42 107.5(6) . . . . ? Se10 Re4 P4 C42 -72.4(6) . . . . ? Se13 Re4 P4 C42 -162.5(6) . . . . ? Se11 Re4 P4 C42 17.5(6) . . . . ? Re2 Re4 P4 C42 63.1(6) . . . . ? Re6 Re4 P4 C42 -117.9(6) . . . . ? Re5 Re4 P4 C42 154.5(6) . . . . ? Re3 Re4 P4 C42 -29.3(7) . . . . ? C43 P4 C41 C44 43.7(16) . . . . ? C42 P4 C41 C44 -63.9(16) . . . . ? Re4 P4 C41 C44 169.7(12) . . . . ? C43 P4 C42 C45 -172.4(14) . . . . ? C41 P4 C42 C45 -63.3(15) . . . . ? Re4 P4 C42 C45 62.5(15) . . . . ? C41 P4 C43 C46 60.0(16) . . . . ? C42 P4 C43 C46 169.0(14) . . . . ? Re4 P4 C43 C46 -65.6(15) . . . . ? Se8 Re5 P5 C53 71.4(9) . . . . ? Se13 Re5 P5 C53 -108.1(9) . . . . ? Se14 Re5 P5 C53 162.0(9) . . . . ? Se12 Re5 P5 C53 -18.0(9) . . . . ? Re1 Re5 P5 C53 116.0(9) . . . . ? Re2 Re5 P5 C53 29.8(9) . . . . ? Re6 Re5 P5 C53 -156.3(9) . . . . ? Re4 Re5 P5 C53 -62.5(9) . . . . ? Se8 Re5 P5 C52 -46.4(9) . . . . ? Se13 Re5 P5 C52 134.1(9) . . . . ? Se14 Re5 P5 C52 44.2(9) . . . . ? Se12 Re5 P5 C52 -135.8(9) . . . . ? Re1 Re5 P5 C52 -1.8(9) . . . . ? Re2 Re5 P5 C52 -88.0(9) . . . . ? Re6 Re5 P5 C52 85.9(9) . . . . ? Re4 Re5 P5 C52 179.7(8) . . . . ? Se8 Re5 P5 C51 -166.3(8) . . . . ? Se13 Re5 P5 C51 14.2(8) . . . . ? Se14 Re5 P5 C51 -75.7(8) . . . . ? Se12 Re5 P5 C51 104.3(8) . . . . ? Re1 Re5 P5 C51 -121.7(8) . . . . ? Re2 Re5 P5 C51 152.1(7) . . . . ? Re6 Re5 P5 C51 -34.0(8) . . . . ? Re4 Re5 P5 C51 59.8(8) . . . . ? C53 P5 C51 C54 -168.4(16) . . . . ? C52 P5 C51 C54 -61.5(17) . . . . ? Re5 P5 C51 C54 64.0(17) . . . . ? C53 P5 C52 C55 53(2) . . . . ? C51 P5 C52 C55 -55(2) . . . . ? Re5 P5 C52 C55 177(2) . . . . ? C52 P5 C53 C56 -149(3) . . . . ? C51 P5 C53 C56 -42(3) . . . . ? Re5 P5 C53 C56 87(3) . . . . ? Se14 Re6 P6 C63 162.2(6) . . . . ? Se10 Re6 P6 C63 -17.6(6) . . . . ? Se9 Re6 P6 C63 -108.3(6) . . . . ? Se13 Re6 P6 C63 72.4(6) . . . . ? Re1 Re6 P6 C63 -154.7(6) . . . . ? Re3 Re6 P6 C63 -62.3(6) . . . . ? Re4 Re6 P6 C63 29.0(7) . . . . ? Re5 Re6 P6 C63 116.8(6) . . . . ? Se14 Re6 P6 C62 -73.4(6) . . . . ? Se10 Re6 P6 C62 106.9(6) . . . . ? Se9 Re6 P6 C62 16.1(6) . . . . ? Se13 Re6 P6 C62 -163.2(6) . . . . ? Re1 Re6 P6 C62 -30.3(6) . . . . ? Re3 Re6 P6 C62 62.1(6) . . . . ? Re4 Re6 P6 C62 153.4(6) . . . . ? Re5 Re6 P6 C62 -118.8(6) . . . . ? Se14 Re6 P6 C61 45.8(6) . . . . ? Se10 Re6 P6 C61 -133.9(6) . . . . ? Se9 Re6 P6 C61 135.3(6) . . . . ? Se13 Re6 P6 C61 -44.0(6) . . . . ? Re1 Re6 P6 C61 88.9(6) . . . . ? Re3 Re6 P6 C61 -178.7(6) . . . . ? Re4 Re6 P6 C61 -87.4(6) . . . . ? Re5 Re6 P6 C61 0.4(7) . . . . ? C63 P6 C61 C64 59.8(16) . . . . ? C62 P6 C61 C64 -49.8(16) . . . . ? Re6 P6 C61 C64 -175.4(12) . . . . ? C63 P6 C62 C65 -163.2(14) . . . . ? C61 P6 C62 C65 -56.3(15) . . . . ? Re6 P6 C62 C65 66.9(14) . . . . ? C62 P6 C63 C66 -41.8(17) . . . . ? C61 P6 C63 C66 -150.5(15) . . . . ? Re6 P6 C63 C66 87.6(16) . . . . ? loop_ _geom_hbond_atom_site_label_D _geom_hbond_atom_site_label_H _geom_hbond_atom_site_label_A _geom_hbond_distance_DH _geom_hbond_distance_HA _geom_hbond_distance_DA _geom_hbond_angle_DHA _geom_hbond_site_symmetry_A N121 H12B O111 0.88 1.95 2.816(18) 167.3 2_646 N121 H12C F211 0.88 2.13 2.92(3) 148.4 2_646 N213 H21D O223 0.88 1.98 2.86(2) 177.1 2_755