Supplementary Material (ESI) for Dalton Transactions This journal is (c) The Royal Society of Chemistry 2002 data_dhb107 _database_code_CSD 160382 # 2. EXPERIMENTAL DATA #--------------------- _chemical_formula_sum 'C26 H42 F6 N4 O3 P1 Rh1' _chemical_formula_moiety ? _chemical_formula_weight 706.52 _chemical_melting_point ? _symmetry_cell_setting triclinic _symmetry_space_group_name_H-M P_-1 _symmetry_space_group_name_Hall -p_1 loop_ _symmetry_equiv_pos_as_xyz +x,+y,+z -x,-y,-z _cell_length_a 10.3790(10) _cell_length_b 10.6920(10) _cell_length_c 15.714(2) _cell_angle_alpha 104.826(2) _cell_angle_beta 92.569(2) _cell_angle_gamma 118.094(2) _cell_volume 1458.9(3) _cell_formula_units_Z 2 _exptl_crystal_density_diffrn 1.608 _exptl_crystal_density_meas ? _exptl_crystal_density_method ? _diffrn_radiation_type 'Mo K\a' _diffrn_radiation_wavelength .71073 _cell_measurement_reflns_used 8192 _cell_measurement_theta_min 3.0 _cell_measurement_theta_max 24.8 _cell_measurement_temperature 153 _exptl_absorpt_coefficient_mu .714 _exptl_crystal_description prism _exptl_crystal_size_max .3 _exptl_crystal_size_mid .3 _exptl_crystal_size_min .12 _exptl_crystal_size_rad ? _exptl_crystal_colour yellow _diffrn_measurement_device_type ; Bruker SMART CCD diffractometer ; _diffrn_measurement_method '\w scans' _diffrn_detector_area_resol_mean ? _exptl_absorpt_correction_type multi-scan _exptl_absorpt_process_details ; SADABS; Sheldrick, 1996 ; _exptl_absorpt_correction_T_min .69 _exptl_absorpt_correction_T_max .84 _diffrn_reflns_number 29011 _reflns_number_total 14718 _reflns_Friedel_coverage 0 _reflns_number_gt 12801 _reflns_threshold_expression 'F > 4.00 sig(F )' _diffrn_reflns_theta_max 37.58 _diffrn_reflns_theta_full ? _diffrn_measured_fraction_theta_max ? _diffrn_measured_fraction_theta_full ? _diffrn_reflns_av_R_equivalents .027 _diffrn_reflns_limit_h_min -17 _diffrn_reflns_limit_h_max 17 _diffrn_reflns_limit_k_min -18 _diffrn_reflns_limit_k_max 17 _diffrn_reflns_limit_l_min 0 _diffrn_reflns_limit_l_max 26 _diffrn_standards_number ? _diffrn_standards_interval_count ? _diffrn_standards_interval_time ? _diffrn_standards_decay_% 0 _refine_ls_structure_factor_coef F _refine_ls_R_factor_gt .033 _refine_ls_wR_factor_ref .045 _refine_ls_goodness_of_fit_ref 1.259 _refine_ls_number_reflns 12801 _refine_ls_number_parameters 538 _refine_ls_weighting_scheme calc _refine_ls_weighting_details ? _refine_ls_hydrogen_treatment refall _refine_ls_shift/su_max .028 _refine_diff_density_min -1.351 _refine_diff_density_max 1.907 _refine_ls_extinction_method ? _refine_ls_extinction_coef ? _refine_ls_abs_structure_details ? _refine_ls_abs_structure_Flack ? # 3. Information for the "methods" section #----------------------------------------- _computing_data_collection 'Siemens SMART (Siemens, 1995)' _computing_cell_refinement 'Siemens SAINT (Siemens, 1995)' _computing_data_reduction 'xtal ADDREF SORTRF' _computing_structure_solution xtal _computing_structure_refinement 'xtal CRYLSQ' _computing_molecular_graphics xtal _computing_publication_material 'xtal BONDLA CIFIO' # 4. Supplementary data for validation and tables #------------------------------------------------ loop_ _atom_type_symbol _atom_type_description _atom_type_oxidation_number _atom_type_number_in_cell _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source C ? 0 52 .002 .002 'Int Tables Vol IV Tables 2.2B and 2.3.1' H ? 0 84 0 0 'Int Tables Vol IV Tables 2.2B and 2.3.1' F ? 0 12 .014 .01 'Int Tables Vol IV Tables 2.2B and 2.3.1' N ? 0 8 .004 .003 'Int Tables Vol IV Tables 2.2B and 2.3.1' O ? 0 6 .008 .006 'Int Tables Vol IV Tables 2.2B and 2.3.1' P ? 0 2 .09 .095 'Int Tables Vol IV Tables 2.2B and 2.3.1' Rh ? 0 2 -1.287 .919 'Int Tables Vol IV Tables 2.2B and 2.3.1' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_calc_flag _atom_site_calc_attached_atom _atom_site_occupancy _atom_site_disorder_assembly _atom_site_disorder_group Rh .165503(12) 1.096459(13) .224200(7) .01327(4) Uani ? ? 1.00000 ? ? N1 .13352(14) .96734(15) .31938(9) .0160(3) Uani ? ? 1.00000 ? ? C11 .00330(18) .81253(18) .28343(11) .0187(4) Uani ? ? 1.00000 ? ? C12 -.00570(18) .71040(19) .33867(12) .0211(5) Uani ? ? 1.00000 ? ? C13 -.1662(2) .5873(2) .32791(14) .0262(6) Uani ? ? 1.00000 ? ? C14 -.18124(18) .49061(18) .38291(12) .0206(5) Uani ? ? 1.00000 ? ? C15 -.19558(17) .40863(18) .42593(11) .0194(4) Uani ? ? 1.00000 ? ? C16 -.2127(2) .3059(2) .47624(14) .0258(5) Uani ? ? 1.00000 ? ? C2 .27483(18) .96365(19) .33058(12) .0199(5) Uani ? ? 1.00000 ? ? C3 .40916(18) 1.11801(19) .34850(11) .0196(4) Uani ? ? 1.00000 ? ? N4 .39253(14) 1.19887(15) .28683(9) .0170(4) Uani ? ? 1.00000 ? ? C41 .49346(18) 1.2063(2) .22042(12) .0216(5) Uani ? ? 1.00000 ? ? C42 .4443(2) 1.0569(2) .14859(12) .0233(5) Uani ? ? 1.00000 ? ? C43 .3275(2) 1.0169(2) .06716(11) .0220(5) Uani ? ? 1.00000 ? ? C5 .42989(18) 1.35439(18) .33809(11) .0200(4) Uani ? ? 1.00000 ? ? C6 .31598(18) 1.35366(19) .39571(11) .0208(4) Uani ? ? 1.00000 ? ? N7 .15958(15) 1.25161(15) .34230(9) .0175(4) Uani ? ? 1.00000 ? ? C71 .0983(2) 1.3443(2) .32120(12) .0226(5) Uani ? ? 1.00000 ? ? C72 -.0460(2) 1.2604(2) .25105(12) .0248(5) Uani ? ? 1.00000 ? ? C73 -.0261(2) 1.2242(2) .15353(12) .0252(5) Uani ? ? 1.00000 ? ? C8 .06466(19) 1.15699(19) .39420(11) .0202(4) Uani ? ? 1.00000 ? ? C9 .1142(2) 1.0490(2) .40626(11) .0202(4) Uani ? ? 1.00000 ? ? C01 .04826(18) .89966(18) .08696(10) .0189(4) Uani ? ? 1.00000 ? ? O01 .01233(16) .76452(15) .06672(9) .0253(4) Uani ? ? 1.00000 ? ? C02 .19327(18) 1.02736(18) .08964(10) .0177(4) Uani ? ? 1.00000 ? ? C03 .17884(18) 1.15969(18) .10736(10) .0187(4) Uani ? ? 1.00000 ? ? C031 .2847(2) 1.3072(2) .09569(13) .0257(6) Uani ? ? 1.00000 ? ? C04 .03358(18) 1.11948(19) .12850(10) .0183(4) Uani ? ? 1.00000 ? ? C05 -.04143(18) .96654(18) .12461(10) .0188(4) Uani ? ? 1.00000 ? ? C051 -.1981(2) .8772(2) .13687(12) .0247(5) Uani ? ? 1.00000 ? ? P .55427(5) .79540(5) .34892(3) .02213(14) Uani ? ? 1.00000 ? ? F1 .73205(16) .89069(19) .37511(12) .0475(6) Uani ? ? 1.00000 ? ? F2 .5554(2) .8899(2) .28495(12) .0491(7) Uani ? ? 1.00000 ? ? F3 .37671(16) .6981(2) .32339(13) .0520(7) Uani ? ? 1.00000 ? ? F4 .55440(17) .70095(15) .41401(9) .0359(5) Uani ? ? 1.00000 ? ? F5 .5649(2) .67807(18) .26789(10) .0427(6) Uani ? ? 1.00000 ? ? F6 .5439(2) .91139(17) .43071(11) .0478(6) Uani ? ? 1.00000 ? ? C0 .2001(3) .5888(3) .0439(2) .0431(10) Uani ? ? 1.00000 ? ? N0 .2531(5) .6082(4) -.0384(3) .089(2) Uani ? ? 1.00000 ? ? O1 .3779(7) .6484(12) -.0387(6) .281(7) Uani ? ? 1.00000 ? ? O2 .1680(8) .5830(6) -.1027(3) .158(3) Uani ? ? 1.00000 ? ? H11a .005(3) .767(3) .2217(16) .018(5) Uiso ? ? 1.00000 ? ? H11b -.082(3) .825(3) .2867(18) .026(6) Uiso ? ? 1.00000 ? ? H12a .029(3) .771(3) .4004(18) .026(6) Uiso ? ? 1.00000 ? ? H12b .059(3) .663(3) .318(2) .038(8) Uiso ? ? 1.00000 ? ? H13a -.204(3) .529(3) .266(2) .034(7) Uiso ? ? 1.00000 ? ? H13b -.230(3) .623(3) .338(2) .036(7) Uiso ? ? 1.00000 ? ? H16a -.237(4) .215(4) .439(2) .060(10) Uiso ? ? 1.00000 ? ? H16b -.285(4) .293(4) .511(2) .047(9) Uiso ? ? 1.00000 ? ? H16c -.125(4) .347(4) .517(2) .044(8) Uiso ? ? 1.00000 ? ? H2a .267(3) .889(3) .2731(15) .014(5) Uiso ? ? 1.00000 ? ? H2b .282(3) .931(3) .3805(17) .024(6) Uiso ? ? 1.00000 ? ? H3a .495(3) 1.110(3) .3413(17) .025(6) Uiso ? ? 1.00000 ? ? H3b .428(3) 1.182(3) .4089(17) .023(6) Uiso ? ? 1.00000 ? ? H41a .592(3) 1.243(3) .2558(19) .031(7) Uiso ? ? 1.00000 ? ? H41b .500(3) 1.278(3) .1930(18) .026(6) Uiso ? ? 1.00000 ? ? H42a .406(3) .972(3) .1735(17) .021(6) Uiso ? ? 1.00000 ? ? H42b .536(3) 1.061(3) .126(2) .034(7) Uiso ? ? 1.00000 ? ? H43a .295(3) .912(3) .029(2) .038(8) Uiso ? ? 1.00000 ? ? H43b .379(3) 1.086(3) .0319(19) .031(7) Uiso ? ? 1.00000 ? ? H5a .427(3) 1.397(3) .2922(18) .029(7) Uiso ? ? 1.00000 ? ? H5b .529(3) 1.410(3) .3759(17) .024(6) Uiso ? ? 1.00000 ? ? H6a .334(3) 1.452(3) .4146(17) .022(6) Uiso ? ? 1.00000 ? ? H6b .327(3) 1.323(3) .4472(16) .020(6) Uiso ? ? 1.00000 ? ? H71a .172(3) 1.417(3) .2977(18) .029(7) Uiso ? ? 1.00000 ? ? H71b .081(3) 1.393(3) .3780(17) .023(6) Uiso ? ? 1.00000 ? ? H72a -.089(4) 1.325(4) .262(2) .044(8) Uiso ? ? 1.00000 ? ? H72b -.122(3) 1.165(3) .2626(17) .024(6) Uiso ? ? 1.00000 ? ? H73a .044(3) 1.322(3) .142(2) .040(8) Uiso ? ? 1.00000 ? ? H73b -.125(3) 1.177(3) .1119(18) .030(7) Uiso ? ? 1.00000 ? ? H8a -.037(3) 1.103(3) .3597(17) .023(6) Uiso ? ? 1.00000 ? ? H8b .067(3) 1.219(3) .4534(18) .026(6) Uiso ? ? 1.00000 ? ? H9a .204(3) 1.099(3) .4477(17) .025(6) Uiso ? ? 1.00000 ? ? H9b .035(3) .973(3) .4291(17) .027(6) Uiso ? ? 1.00000 ? ? H031a .381(3) 1.312(3) .081(2) .034(7) Uiso ? ? 1.00000 ? ? H031b .305(3) 1.391(3) .149(2) .032(7) Uiso ? ? 1.00000 ? ? H031c .239(3) 1.318(3) .048(2) .038(8) Uiso ? ? 1.00000 ? ? H051a -.269(4) .877(4) .094(2) .050(9) Uiso ? ? 1.00000 ? ? H051b -.217(4) .916(4) .200(2) .050(9) Uiso ? ? 1.00000 ? ? H051c -.219(3) .773(3) .1250(19) .032(7) Uiso ? ? 1.00000 ? ? H0a .158(3) .656(4) .053(2) .042(8) Uiso ? ? 1.00000 ? ? H0b .311(5) .637(5) .089(3) .077(13) Uiso ? ? 1.00000 ? ? H0c .123(4) .475(4) .028(2) .060(10) Uiso ? ? 1.00000 ? ? loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Rh .01512(5) .01412(5) .01154(4) .00775(3) .00290(3) .00461(3) N1 .0166(5) .0168(5) .0152(5) .0077(4) .0031(4) .0070(4) C11 .0189(6) .0176(6) .0195(6) .0075(5) .0021(5) .0092(5) C12 .0202(6) .0201(6) .0242(7) .0081(5) .0039(5) .0126(6) C13 .0212(7) .0255(8) .0341(9) .0085(6) .0032(6) .0194(7) C14 .0181(6) .0196(6) .0246(7) .0084(5) .0043(5) .0096(6) C15 .0179(6) .0183(6) .0218(6) .0082(5) .0035(5) .0077(5) C16 .0253(7) .0229(7) .0294(8) .0091(6) .0021(6) .0148(7) C2 .0183(6) .0212(6) .0229(7) .0105(5) .0024(5) .0104(6) C3 .0178(6) .0224(7) .0192(6) .0102(5) .0015(5) .0079(5) N4 .0164(5) .0167(5) .0172(5) .0074(4) .0036(4) .0059(4) C41 .0178(6) .0243(7) .0215(7) .0092(5) .0062(5) .0075(6) C42 .0223(7) .0291(8) .0218(7) .0160(6) .0057(6) .0064(6) C43 .0241(7) .0290(8) .0169(6) .0166(6) .0083(5) .0060(6) C5 .0178(6) .0170(6) .0210(6) .0066(5) .0035(5) .0037(5) C6 .0200(6) .0178(6) .0187(6) .0071(5) .0022(5) .0014(5) N7 .0179(5) .0169(5) .0173(5) .0087(4) .0034(4) .0047(4) C71 .0263(7) .0206(7) .0235(7) .0148(6) .0048(6) .0049(6) C72 .0289(8) .0296(8) .0229(7) .0212(7) .0054(6) .0059(6) C73 .0339(8) .0315(8) .0218(7) .0249(7) .0058(6) .0089(6) C8 .0215(6) .0220(7) .0179(6) .0107(5) .0076(5) .0069(5) C9 .0235(7) .0226(7) .0152(6) .0109(6) .0058(5) .0080(5) C01 .0222(6) .0201(6) .0142(5) .0113(5) .0023(5) .0039(5) O01 .0300(6) .0194(5) .0241(6) .0126(5) .0023(5) .0032(4) C02 .0222(6) .0219(6) .0129(5) .0137(5) .0055(5) .0054(5) C03 .0236(6) .0209(6) .0148(6) .0125(5) .0043(5) .0078(5) C031 .0328(8) .0234(7) .0230(7) .0130(7) .0068(6) .0125(6) C04 .0229(6) .0236(7) .0139(5) .0155(6) .0040(5) .0064(5) C05 .0198(6) .0227(7) .0148(6) .0114(5) .0015(5) .0057(5) C051 .0200(6) .0302(8) .0218(7) .0112(6) .0020(5) .0078(6) P .02336(18) .02090(19) .0274(2) .01287(16) .00957(16) .01138(16) F1 .0239(6) .0462(8) .0649(10) .0087(6) .0120(6) .0228(8) F2 .0721(11) .0566(10) .0560(9) .0480(9) .0303(8) .0409(8) F3 .0245(6) .0583(10) .0654(11) .0136(7) .0034(7) .0227(9) F4 .0491(8) .0293(6) .0325(6) .0183(6) .0074(6) .0170(5) F5 .0658(10) .0427(8) .0319(7) .0376(8) .0127(7) .0091(6) F6 .0690(11) .0371(7) .0486(9) .0342(8) .0296(8) .0127(7) C0 .0404(12) .0325(11) .0631(17) .0210(10) .0134(11) .0192(11) N0 .117(3) .080(2) .127(4) .068(2) .087(3) .071(3) O1 .132(5) .444(13) .323(10) .131(7) .179(6) .211(10) O2 .356(8) .210(5) .079(2) .246(6) .104(4) .089(3) # 5. Molecular Geometry #---------------------- loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_1 _geom_bond_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag #<< enter YES for value to be published Rh N1 . . 2.2187(16) ? Rh N4 . . 2.1284(14) ? Rh N7 . . 2.1750(15) ? Rh C01 . . 2.3643(14) ? Rh C02 . . 2.1344(16) ? Rh C03 . . 2.1017(19) ? Rh C04 . . 2.126(2) ? Rh C05 . . 2.1835(15) ? N1 C11 . . 1.4938(17) ? N1 C2 . . 1.489(3) ? N1 C9 . . 1.499(2) ? C11 C12 . . 1.533(3) ? C11 H11a . . .97(2) ? C11 H11b . . .96(4) ? C12 C13 . . 1.527(2) ? C12 H12a . . .96(2) ? C12 H12b . . 1.03(4) ? C13 C14 . . 1.469(3) ? C13 H13a . . .96(3) ? C13 H13b . . .90(4) ? C14 C15 . . 1.199(3) ? C15 C16 . . 1.462(3) ? C16 H16a . . .90(4) ? C16 H16b . . .93(4) ? C16 H16c . . .93(3) ? C2 C3 . . 1.519(2) ? C2 H2a . . 1.01(2) ? C2 H2b . . .95(3) ? C3 N4 . . 1.507(3) ? C3 H3a . . .94(3) ? C3 H3b . . .97(2) ? N4 C41 . . 1.502(2) ? N4 C5 . . 1.498(2) ? C41 C42 . . 1.531(3) ? C41 H41a . . .98(3) ? C41 H41b . . .95(4) ? C42 C43 . . 1.544(3) ? C42 H42a . . .99(3) ? C42 H42b . . 1.01(4) ? C43 C02 . . 1.500(3) ? C43 H43a . . 1.01(3) ? C43 H43b . . 1.00(3) ? C5 C6 . . 1.519(3) ? C5 H5a . . .95(3) ? C5 H5b . . .97(2) ? C6 N7 . . 1.5070(19) ? C6 H6a . . .94(3) ? C6 H6b . . .97(3) ? N7 C71 . . 1.497(3) ? N7 C8 . . 1.488(2) ? C71 C72 . . 1.530(3) ? C71 H71a . . .97(3) ? C71 H71b . . .98(3) ? C72 C73 . . 1.530(3) ? C72 H72a . . .97(4) ? C72 H72b . . 1.02(3) ? C73 C04 . . 1.497(4) ? C73 H73a . . 1.03(3) ? C73 H73b . . 1.01(3) ? C8 C9 . . 1.515(3) ? C8 H8a . . .98(3) ? C8 H8b . . .99(3) ? C9 H9a . . .94(3) ? C9 H9b . . 1.01(3) ? C01 O01 . . 1.255(2) ? C01 C02 . . 1.470(2) ? C01 C05 . . 1.479(3) ? C02 C03 . . 1.450(3) ? C03 C031 . . 1.504(3) ? C03 C04 . . 1.441(3) ? C031 H031a . . 1.01(4) ? C031 H031b . . .99(3) ? C031 H031c . . .93(4) ? C04 C05 . . 1.425(3) ? C05 C051 . . 1.501(2) ? C051 H051a . . .97(4) ? C051 H051b . . 1.04(4) ? C051 H051c . . .99(4) ? P F1 . . 1.5996(14) ? P F2 . . 1.594(2) ? P F3 . . 1.5980(15) ? P F4 . . 1.6112(19) ? P F5 . . 1.5916(19) ? P F6 . . 1.589(2) ? C0 N0 . . 1.454(6) ? C0 H0a . . .99(4) ? C0 H0b . . 1.13(4) ? C0 H0c . . 1.05(3) ? N0 O1 . . 1.158(9) ? N0 O2 . . 1.195(8) ? loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_2 _geom_angle_site_symmetry_3 _geom_angle _geom_angle_publ_flag #<< enter YES for value to be published N1 Rh N4 . . . 81.89(5) ? N1 Rh N7 . . . 80.72(6) ? N1 Rh C01 . . . 100.36(6) ? N1 Rh C02 . . . 124.49(7) ? N1 Rh C03 . . . 163.61(6) ? N1 Rh C04 . . . 138.68(6) ? N1 Rh C05 . . . 104.63(6) ? N4 Rh N7 . . . 83.08(6) ? N4 Rh C01 . . . 125.41(6) ? N4 Rh C02 . . . 96.96(6) ? N4 Rh C03 . . . 103.31(6) ? N4 Rh C04 . . . 139.20(6) ? N4 Rh C05 . . . 162.19(6) ? N7 Rh C01 . . . 151.48(6) ? N7 Rh C02 . . . 154.65(7) ? N7 Rh C03 . . . 115.13(7) ? N7 Rh C04 . . . 97.34(7) ? N7 Rh C05 . . . 114.12(7) ? C01 Rh C02 . . . 37.71(5) ? C01 Rh C03 . . . 63.84(6) ? C01 Rh C04 . . . 62.93(7) ? C01 Rh C05 . . . 37.69(7) ? C02 Rh C03 . . . 40.03(8) ? C02 Rh C04 . . . 66.18(8) ? C02 Rh C05 . . . 65.58(6) ? C03 Rh C04 . . . 39.85(7) ? C03 Rh C05 . . . 66.06(6) ? C04 Rh C05 . . . 38.58(7) ? Rh N1 C11 . . . 112.48(11) ? Rh N1 C2 . . . 103.29(10) ? Rh N1 C9 . . . 109.16(12) ? C11 N1 C2 . . . 110.57(15) ? C11 N1 C9 . . . 109.94(12) ? C2 N1 C9 . . . 111.25(13) ? N1 C11 C12 . . . 114.10(14) ? N1 C11 H11a . . . 110.0(13) ? N1 C11 H11b . . . 104.9(14) ? C12 C11 H11a . . . 109.1(19) ? C12 C11 H11b . . . 107.7(19) ? H11a C11 H11b . . . 111(2) ? C11 C12 C13 . . . 111.03(17) ? C11 C12 H12a . . . 107(2) ? C11 C12 H12b . . . 109(2) ? C13 C12 H12a . . . 108.4(16) ? C13 C12 H12b . . . 109.6(14) ? H12a C12 H12b . . . 111(3) ? C12 C13 C14 . . . 113.00(18) ? C12 C13 H13a . . . 108.6(17) ? C12 C13 H13b . . . 113.0(17) ? C14 C13 H13a . . . 110(2) ? C14 C13 H13b . . . 111(2) ? H13a C13 H13b . . . 100(3) ? C13 C14 C15 . . . 178.36(15) ? C14 C15 C16 . . . 178.4(2) ? C15 C16 H16a . . . 111(3) ? C15 C16 H16b . . . 113(3) ? C15 C16 H16c . . . 109(2) ? H16a C16 H16b . . . 108(3) ? H16a C16 H16c . . . 111(4) ? H16b C16 H16c . . . 104(3) ? N1 C2 C3 . . . 111.10(17) ? N1 C2 H2a . . . 104.9(16) ? N1 C2 H2b . . . 110(2) ? C3 C2 H2a . . . 113.1(12) ? C3 C2 H2b . . . 107.5(12) ? H2a C2 H2b . . . 111(2) ? C2 C3 N4 . . . 112.87(14) ? C2 C3 H3a . . . 109.8(16) ? C2 C3 H3b . . . 112.3(15) ? N4 C3 H3a . . . 108(2) ? N4 C3 H3b . . . 106(2) ? H3a C3 H3b . . . 107(2) ? Rh N4 C3 . . . 110.44(9) ? Rh N4 C41 . . . 112.76(9) ? Rh N4 C5 . . . 103.34(12) ? C3 N4 C41 . . . 109.80(17) ? C3 N4 C5 . . . 111.42(13) ? C41 N4 C5 . . . 108.94(13) ? N4 C41 C42 . . . 114.40(13) ? N4 C41 H41a . . . 105.9(18) ? N4 C41 H41b . . . 108(2) ? C42 C41 H41a . . . 110(2) ? C42 C41 H41b . . . 110.2(15) ? H41a C41 H41b . . . 109(2) ? C41 C42 C43 . . . 114.9(2) ? C41 C42 H42a . . . 112.3(14) ? C41 C42 H42b . . . 108.0(14) ? C43 C42 H42a . . . 108.5(14) ? C43 C42 H42b . . . 108.4(17) ? H42a C42 H42b . . . 104(3) ? C42 C43 C02 . . . 115.24(15) ? C42 C43 H43a . . . 107(2) ? C42 C43 H43b . . . 107.3(16) ? C02 C43 H43a . . . 110(2) ? C02 C43 H43b . . . 109(2) ? H43a C43 H43b . . . 108(3) ? N4 C5 C6 . . . 111.35(13) ? N4 C5 H5a . . . 103.6(17) ? N4 C5 H5b . . . 111(2) ? C6 C5 H5a . . . 110(2) ? C6 C5 H5b . . . 109.5(17) ? H5a C5 H5b . . . 111(2) ? C5 C6 N7 . . . 111.17(13) ? C5 C6 H6a . . . 105.8(17) ? C5 C6 H6b . . . 111.1(19) ? N7 C6 H6a . . . 109.3(17) ? N7 C6 H6b . . . 109.1(12) ? H6a C6 H6b . . . 110(2) ? Rh N7 C6 . . . 108.21(12) ? Rh N7 C71 . . . 113.84(10) ? Rh N7 C8 . . . 105.31(10) ? C6 N7 C71 . . . 108.95(13) ? C6 N7 C8 . . . 110.13(14) ? C71 N7 C8 . . . 110.32(16) ? N7 C71 C72 . . . 116.12(15) ? N7 C71 H71a . . . 107(2) ? N7 C71 H71b . . . 106(2) ? C72 C71 H71a . . . 106.5(17) ? C72 C71 H71b . . . 108.8(16) ? H71a C71 H71b . . . 112(2) ? C71 C72 C73 . . . 114.97(18) ? C71 C72 H72a . . . 105.0(16) ? C71 C72 H72b . . . 111.4(17) ? C73 C72 H72a . . . 110(2) ? C73 C72 H72b . . . 109.8(14) ? H72a C72 H72b . . . 105(3) ? C72 C73 C04 . . . 114.6(2) ? C72 C73 H73a . . . 108.4(17) ? C72 C73 H73b . . . 109.8(18) ? C04 C73 H73a . . . 109(2) ? C04 C73 H73b . . . 107(2) ? H73a C73 H73b . . . 108(3) ? N7 C8 C9 . . . 110.92(16) ? N7 C8 H8a . . . 106.3(17) ? N7 C8 H8b . . . 111.0(16) ? C9 C8 H8a . . . 110(2) ? C9 C8 H8b . . . 110(2) ? H8a C8 H8b . . . 109(2) ? N1 C9 C8 . . . 111.76(15) ? N1 C9 H9a . . . 109(2) ? N1 C9 H9b . . . 108.2(16) ? C8 C9 H9a . . . 111(2) ? C8 C9 H9b . . . 108(2) ? H9a C9 H9b . . . 109(2) ? Rh C01 O01 . . . 131.37(14) ? Rh C01 C02 . . . 62.63(7) ? Rh C01 C05 . . . 64.51(7) ? O01 C01 C02 . . . 128.0(2) ? O01 C01 C05 . . . 126.68(15) ? C02 C01 C05 . . . 104.94(15) ? Rh C02 C43 . . . 122.94(12) ? Rh C02 C01 . . . 79.66(9) ? Rh C02 C03 . . . 68.77(9) ? C43 C02 C01 . . . 124.83(18) ? C43 C02 C03 . . . 126.21(14) ? C01 C02 C03 . . . 108.62(17) ? Rh C03 C02 . . . 71.20(10) ? Rh C03 C031 . . . 128.48(10) ? Rh C03 C04 . . . 70.98(11) ? C02 C03 C031 . . . 127.71(18) ? C02 C03 C04 . . . 107.13(14) ? C031 C03 C04 . . . 124.8(2) ? C03 C031 H031a . . . 112(2) ? C03 C031 H031b . . . 111.1(18) ? C03 C031 H031c . . . 107.8(17) ? H031a C031 H031b . . . 111(2) ? H031a C031 H031c . . . 108(3) ? H031b C031 H031c . . . 107(3) ? Rh C04 C73 . . . 122.59(11) ? Rh C04 C03 . . . 69.17(11) ? Rh C04 C05 . . . 72.90(12) ? C73 C04 C03 . . . 124.98(16) ? C73 C04 C05 . . . 125.71(16) ? C03 C04 C05 . . . 109.28(19) ? Rh C05 C01 . . . 77.80(9) ? Rh C05 C04 . . . 68.52(9) ? Rh C05 C051 . . . 129.36(12) ? C01 C05 C04 . . . 108.21(15) ? C01 C05 C051 . . . 123.78(16) ? C04 C05 C051 . . . 126.8(2) ? C05 C051 H051a . . . 111(2) ? C05 C051 H051b . . . 114.4(16) ? C05 C051 H051c . . . 106.6(18) ? H051a C051 H051b . . . 106(3) ? H051a C051 H051c . . . 108(3) ? H051b C051 H051c . . . 110(3) ? F1 P F2 . . . 90.19(11) ? F1 P F3 . . . 179.04(14) ? F1 P F4 . . . 89.41(10) ? F1 P F5 . . . 89.86(10) ? F1 P F6 . . . 90.06(10) ? F2 P F3 . . . 90.73(11) ? F2 P F4 . . . 179.56(8) ? F2 P F5 . . . 90.46(11) ? F2 P F6 . . . 90.32(11) ? F3 P F4 . . . 89.67(10) ? F3 P F5 . . . 89.86(10) ? F3 P F6 . . . 90.21(10) ? F4 P F5 . . . 89.72(10) ? F4 P F6 . . . 89.50(10) ? F5 P F6 . . . 179.22(11) ? N0 C0 H0a . . . 99(2) ? N0 C0 H0b . . . 98(2) ? N0 C0 H0c . . . 105(2) ? H0a C0 H0b . . . 114(3) ? H0a C0 H0c . . . 116(3) ? H0b C0 H0c . . . 119(4) ? C0 N0 O1 . . . 117.9(7) ? C0 N0 O2 . . . 119.6(5) ? O1 N0 O2 . . . 122.5(8) ? 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_site_symmetry_1 _geom_torsion_site_symmetry_2 _geom_torsion_site_symmetry_3 _geom_torsion_site_symmetry_4 _geom_torsion _geom_torsion_publ_flag #<< enter YES for value to be published ? ? ? ? ? ? ? ? ? ? loop_ _geom_hbond_atom_site_label_D _geom_hbond_atom_site_label_H _geom_hbond_atom_site_label_A _geom_hbond_site_symmetry_D _geom_hbond_site_symmetry_H _geom_hbond_site_symmetry_A _geom_hbond_distance_DH _geom_hbond_distance_HA _geom_hbond_distance_DA _geom_hbond_angle_DHA _geom_hbond_publ_flag #<< enter YES for value to be published ? ? ? ? ? ? ? ? ? ? ? #-------------------------------------------------------------------------- # Special items requested by author for inclusion in paper #-------------------------------------------------------------------------- loop_ _publ_manuscript_incl_extra_item _publ_manuscript_incl_extra_defn ? ? #-------------------------------------------------------------------------- # Items which are non-mandatory for Acta C submissions #-------------------------------------------------------------------------- loop_ _geom_contact_atom_site_label_1 _geom_contact_atom_site_label_2 _geom_contact_distance _geom_contact_site_symmetry_1 _geom_contact_site_symmetry_2 _geom_contact_publ_flag Rh C11 3.1127(18) . . ? Rh C2 2.943(2) . . ? Rh C3 3.007(2) . . ? Rh C41 3.0427(18) . . ? Rh C42 3.342(2) . . ? Rh C43 3.207(2) . . ? Rh C5 2.8714(13) . . ? Rh C6 3.0083(15) . . ? Rh C71 3.099(2) . . ? Rh C72 3.376(3) . . ? Rh C73 3.192(3) . . ? Rh C8 2.9419(18) . . ? Rh C9 3.0580(18) . . ? Rh O01 3.3296(12) . . ? Rh C031 3.258(2) . . ? Rh C051 3.3432(17) . . ? Rh H5a 2.93(2) . . ? N1 C12 2.540(2) . . ? N1 C3 2.481(2) . . ? N1 N4 2.8496(18) . . ? N1 C6 3.461(2) . . ? N1 N7 2.846(2) . . ? N1 C8 2.495(3) . . ? N1 C01 3.521(2) . . ? N1 O01 3.8243(18) . . ? N1 C05 3.484(2) . . ? N1 F1 4.035(2) . '1 455' ? N1 H11a 2.04(2) . . ? N1 H11b 1.97(2) . . ? N1 H12a 2.56(3) . . ? N1 H12b 2.96(4) . . ? N1 H2a 2.00(3) . . ? N1 H2b 2.02(3) . . ? N1 H3b 2.82(2) . . ? N1 H8a 2.77(4) . . ? N1 H9a 2.01(2) . . ? N1 H9b 2.05(3) . . ? C11 C13 2.523(3) . . ? C11 C2 2.452(2) . . ? C11 C9 2.450(2) . . ? C11 O01 3.324(2) . . ? C11 F1 3.559(3) . '1 455' ? C11 H12a 2.03(3) . . ? C11 H12b 2.11(4) . . ? C11 H2a 2.49(3) . . ? C11 H9b 2.39(3) . . ? C12 C14 2.498(3) . . ? C12 C2 2.934(2) . . ? C12 H11a 2.07(3) . . ? C12 H11b 2.04(4) . . ? C12 H13a 2.05(2) . . ? C12 H13b 2.06(3) . . ? C13 C15 2.668(3) . . ? C13 F5 3.522(4) . '1 455' ? C13 O2 3.537(5) . '2 565' ? C13 H12a 2.04(2) . . ? C13 H12b 2.11(3) . . ? C14 C16 2.660(3) . . ? C14 H13a 2.02(4) . . ? C14 H13b 1.98(4) . . ? C15 H16a 1.98(5) . . ? C15 H16b 2.02(4) . . ? C15 H16c 1.97(4) . . ? C16 F3 3.646(3) . '2 566' ? C16 F6 3.598(2) . '1 445' ? C2 N4 2.521(2) . . ? C2 C9 2.466(3) . . ? C2 F2 3.417(3) . . ? C2 F3 3.444(3) . . ? C2 F6 3.480(3) . . ? C2 H3a 2.04(2) . . ? C2 H3b 2.09(2) . . ? C2 H9a 2.40(3) . . ? C3 C41 2.461(3) . . ? C3 C5 2.483(3) . . ? C3 N7 3.506(3) . . ? C3 F2 3.409(3) . . ? C3 F4 3.648(2) . '2 676' ? C3 F6 3.595(3) . '2 676' ? C3 F6 3.565(3) . . ? C3 H2a 2.13(2) . . ? C3 H2b 2.02(3) . . ? N4 C42 2.549(3) . . ? N4 C43 3.358(2) . . ? N4 C6 2.492(3) . . ? N4 N7 2.854(2) . . ? N4 C9 3.479(2) . . ? N4 C02 3.1916(19) . . ? N4 C03 3.318(2) . . ? N4 F2 4.357(3) . . ? N4 H2a 2.87(3) . . ? N4 H3a 2.01(4) . . ? N4 H3b 2.00(3) . . ? N4 H41a 2.01(3) . . ? N4 H41b 2.01(3) . . ? N4 H42a 2.68(3) . . ? N4 H5a 1.96(3) . . ? N4 H5b 2.06(2) . . ? N4 H6b 2.80(3) . . ? C41 C43 2.591(2) . . ? C41 C5 2.441(3) . . ? C41 O1 3.607(11) . '2 675' ? C41 H3a 2.38(3) . . ? C41 H42a 2.12(3) . . ? C41 H42b 2.08(3) . . ? C41 H5a 2.48(4) . . ? C42 C02 2.570(3) . . ? C42 F2 3.575(4) . . ? C42 H41a 2.08(2) . . ? C42 H41b 2.06(3) . . ? C42 H43a 2.08(3) . . ? C42 H43b 2.07(3) . . ? C43 C01 2.632(3) . . ? C43 O01 3.108(2) . . ? C43 C03 2.631(3) . . ? C43 O1 3.604(9) . '2 675' ? C43 H42a 2.08(3) . . ? C43 H42b 2.10(3) . . ? C5 N7 2.497(2) . . ? C5 F4 3.148(2) . '1 565' ? C5 F5 3.561(3) . '1 565' ? C5 H3b 2.37(3) . . ? C5 H41b 2.48(3) . . ? C5 H6a 1.99(3) . . ? C5 H6b 2.08(3) . . ? C6 C71 2.445(3) . . ? C6 C8 2.455(2) . . ? C6 C9 2.985(2) . . ? C6 F4 3.516(3) . '2 676' ? C6 F4 3.276(2) . '1 565' ? C6 H5a 2.06(3) . . ? C6 H5b 2.06(3) . . ? N7 C72 2.569(3) . . ? N7 C73 3.333(3) . . ? N7 C9 2.474(3) . . ? N7 C03 3.610(2) . . ? N7 C04 3.230(2) . . ? N7 C05 3.6578(18) . . ? N7 F3 4.314(3) . '1 565' ? N7 H5a 2.74(3) . . ? N7 H6a 2.02(2) . . ? N7 H6b 2.04(3) . . ? N7 H71a 2.01(4) . . ? N7 H71b 2.01(3) . . ? N7 H72b 2.74(3) . . ? N7 H8a 2.00(2) . . ? N7 H8b 2.06(3) . . ? N7 H9a 2.77(3) . . ? C71 C73 2.581(2) . . ? C71 C8 2.450(3) . . ? C71 F3 3.506(2) . '1 565' ? C71 H6a 2.37(3) . . ? C71 H72a 2.01(4) . . ? C71 H72b 2.13(2) . . ? C72 C04 2.548(3) . . ? C72 O2 3.684(8) . '2 575' ? C72 H71a 2.03(2) . . ? C72 H71b 2.07(2) . . ? C72 H73a 2.09(3) . . ? C72 H73b 2.10(3) . . ? C73 O01 3.501(3) . '2 575' ? C73 C03 2.606(3) . . ? C73 C05 2.600(3) . . ? C73 O2 3.264(9) . '2 575' ? C73 H72a 2.07(4) . . ? C73 H72b 2.11(3) . . ? C8 F1 3.214(2) . '1 455' ? C8 H6b 2.40(2) . . ? C8 H9a 2.05(4) . . ? C8 H9b 2.06(3) . . ? C9 F1 3.489(3) . '2 676' ? C9 F1 3.452(2) . '1 455' ? C9 H11b 2.49(2) . . ? C9 H8a 2.07(4) . . ? C9 H8b 2.07(4) . . ? C01 C03 2.372(2) . . ? C01 C04 2.352(3) . . ? C01 C051 2.628(3) . . ? O01 C02 2.451(2) . . ? O01 C03 3.590(2) . . ? O01 C031 3.560(3) . '2 575' ? O01 C04 3.564(3) . . ? O01 C04 3.681(3) . '2 575' ? O01 C05 2.445(3) . . ? O01 C051 3.074(3) . . ? O01 C0 3.259(4) . . ? O01 C0 3.256(3) . '2 565' ? O01 N0 3.509(4) . '2 565' ? O01 N0 3.829(6) . . ? O01 O1 4.254(8) . '2 565' ? O01 O2 3.763(7) . . ? O01 O2 3.499(6) . '2 565' ? O01 H11a 2.43(3) . . ? O01 H43a 2.78(3) . . ? O01 H73a 3.12(3) . '2 575' ? O01 H73b 3.19(3) . '2 575' ? O01 H031c 2.72(3) . '2 575' ? O01 H051c 2.64(4) . . ? O01 H0a 2.29(4) . . ? O01 H0c 2.28(3) . '2 565' ? C02 C031 2.652(3) . . ? C02 C04 2.326(3) . . ? C02 C05 2.339(3) . . ? C02 H43a 2.07(4) . . ? C02 H43b 2.06(3) . . ? C03 C05 2.337(2) . . ? C03 H031a 2.10(3) . . ? C03 H031b 2.08(3) . . ? C03 H031c 2.00(4) . . ? C031 C04 2.609(2) . . ? C031 O1 3.496(9) . '2 675' ? C04 C051 2.616(2) . . ? C04 H73a 2.08(4) . . ? C04 H73b 2.03(4) . . ? C05 H051a 2.06(4) . . ? C05 H051b 2.15(4) . . ? C05 H051c 2.02(3) . . ? C051 F2 3.561(3) . '1 455' ? C051 F5 3.548(3) . '1 455' ? F1 F2 2.262(3) . . ? F1 F3 3.198(2) . . ? F1 F4 2.259(2) . . ? F1 F5 2.2538(18) . . ? F1 F6 2.256(3) . . ? F1 H11b 2.68(3) . '1 655' ? F1 H13b 2.99(4) . '1 655' ? F1 H8a 2.48(2) . '1 655' ? F1 H9a 2.79(3) . '2 676' ? F1 H9b 2.85(3) . '1 655' ? F1 H051b 2.88(4) . '1 655' ? F2 F3 2.272(3) . . ? F2 F4 3.205(3) . . ? F2 F5 2.262(3) . . ? F2 F6 2.257(3) . . ? F2 H2a 2.99(3) . . ? F2 H3a 2.67(3) . . ? F2 H42a 2.84(3) . . ? F2 H051b 2.70(4) . '1 655' ? F3 F4 2.263(3) . . ? F3 F5 2.253(3) . . ? F3 F6 2.258(2) . . ? F3 H12b 3.14(4) . . ? F3 H16b 2.80(4) . '2 566' ? F3 H2a 3.00(3) . . ? F3 H2b 3.04(4) . . ? F3 H71a 2.65(3) . '1 545' ? F4 F5 2.259(2) . . ? F4 F6 2.253(3) . . ? F4 H13b 2.94(4) . '1 655' ? F4 H16b 3.10(4) . '2 566' ? F4 H3b 2.70(3) . '2 676' ? F4 H5a 2.92(3) . '1 545' ? F4 H5b 2.89(3) . '1 545' ? F4 H6a 2.57(2) . '1 545' ? F4 H6b 2.58(3) . '2 676' ? F4 H9a 2.77(2) . '2 676' ? F5 F6 3.180(3) . . ? F5 H13b 2.72(4) . '1 655' ? F5 H5a 2.79(3) . '1 545' ? F5 H031b 3.00(2) . '1 545' ? F5 H051b 2.99(4) . '1 655' ? F6 F6 2.975(3) . '2 676' ? F6 H16a 2.92(4) . '1 665' ? F6 H16b 2.92(3) . '2 566' ? F6 H2b 2.91(3) . . ? F6 H2b 3.00(2) . '2 676' ? F6 H3a 3.04(4) . . ? F6 H3b 2.99(3) . '2 676' ? C0 O1 2.242(9) . . ? C0 O2 2.293(6) . . ? C0 O2 3.660(8) . '2 565' ? N0 H43a 2.95(4) . . ? N0 H0a 1.88(4) . . ? N0 H0b 1.96(5) . . ? N0 H0c 2.00(4) . . ? O1 O2 2.063(11) . . ? O1 H41b 2.90(3) . '2 675' ? O1 H43b 2.74(3) . '2 675' ? O1 H031a 2.49(3) . '2 675' ? O1 H0a 2.78(4) . . ? O1 H0b 2.17(5) . . ? O1 H0c 2.85(4) . . ? O2 H13a 2.66(3) . '2 565' ? O2 H43a 3.17(3) . . ? O2 H72a 3.12(4) . '2 575' ? O2 H73a 2.92(4) . '2 575' ? O2 H73b 2.85(4) . '2 575' ? O2 H0a 2.40(3) . . ? O2 H0b 3.08(5) . . ? O2 H0c 2.56(4) . . ? O2 H0c 3.14(4) . '2 565' ? H11a H11b 1.59(4) . . ? H12a H12b 1.64(5) . . ? H13a H13b 1.43(5) . . ? H16a H16b 1.48(6) . . ? H16a H16c 1.51(4) . . ? H16b H16c 1.47(5) . . ? H2a H2b 1.61(3) . . ? H3a H3b 1.54(4) . . ? H41a H41b 1.57(5) . . ? H42a H42b 1.58(4) . . ? H43a H43b 1.62(5) . . ? H5a H5b 1.59(4) . . ? H6a H6b 1.57(5) . . ? H71a H71b 1.61(4) . . ? H72a H72b 1.58(5) . . ? H73a H73b 1.64(3) . . ? H8a H8b 1.59(3) . . ? H9a H9b 1.59(3) . . ? H031a H031b 1.65(5) . . ? H031a H031c 1.58(5) . . ? H031b H031c 1.54(4) . . ? H051a H051b 1.60(5) . . ? H051a H051c 1.59(6) . . ? H051b H051c 1.67(5) . . ? H0a H0b 1.77(7) . . ? H0a H0c 1.73(6) . . ? H0b H0c 1.88(4) . . ? _atom_sites_solution_primary ? _atom_sites_solution_secondary ? _atom_sites_solution_hydrogens ? _geom_special_details ? _cell_special_details ; ? ; _exptl_special_details ; ? ; _diffrn_special_details ; ? ; _chemical_compound_source ? _chemical_name_systematic ? _chemical_name_common ? _chemical_formula_analytical ? _chemical_formula_structural ? _exptl_crystal_F_000 728 loop_ _diffrn_standard_refln_index_h _diffrn_standard_refln_index_k _diffrn_standard_refln_index_l ? ? ? loop_ _diffrn_attenuator_code _diffrn_attenuator_scale ? ? _reflns_limit_h_min 0 _reflns_limit_h_max 17 _reflns_limit_k_min -18 _reflns_limit_k_max 16 _reflns_limit_l_min -26 _reflns_limit_l_max 26 _reflns_number_observed ? _reflns_d_resolution_high .583 _reflns_d_resolution_low 9.014 _diffrn_reflns_av_sigmaI/netI .036 _diffrn_reflns_theta_min 2.26 _diffrn_reflns_reduction_process ? _diffrn_ambient_temperature 153 _diffrn_radiation_source 'sealed tube' _diffrn_radiation_monochromator graphite _diffrn_radiation_detector 'CCD area detector' _refine_ls_extinction_expression ? _refine_ls_matrix_type full _refine_ls_number_restraints 0 _refine_ls_number_constraints 0 _refine_ls_R_factor_all .043 _refine_ls_wR_factor_all .047 _refine_ls_goodness_of_fit_all 1.215 _refine_ls_shift/su_mean .001 #========================================================================== # Structure Factor lists should be submitted as separate files #========================================================================== #data_ # but for xtal use the refln data is needed in same block loop_ _refln_index_h _refln_index_k _refln_index_l _refln_F_meas _refln_F_calc _refln_F_sigma _refln_F_squared_meas _refln_F_squared_calc _refln_F_squared_sigma _refln_observed_status _refln_F_meas_friedel _refln_F_sigma_friedel _refln_F_squared_meas_friedel _refln_F_squared_sigma_friedel ? ? ? ? ? ? ? ? ? ? ? ? ? ? #-end-end-end-end-end-end-end-end-end-end-end-end-end-end-end-end-end-end