#------------------------------------------------------------------------------ #$Date: 2010-01-30 13:59:17 +0000 (Sat, 30 Jan 2010) $ #$Revision: 966 $ #$URL: svn://www.crystallography.net/cod/cif/2/2010373.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_2010373 _journal_name_full 'Acta Crystallographica Section C' _journal_year 1995 _journal_volume 51 _journal_page_first 20 _journal_page_last 23 _publ_section_title ; cis-trans-[{N~3~P~3~Cl~4~(C~6~H~5~)(PPh~2~)}Mn(CO)~2~(bipy) {P(OPh)~3~}]PF~6~. A Cationic Manganese--Carbonyl Complex with a Phosphazenylphosphine Ligand ; loop_ _publ_author_name 'Gabino A. Carriedo' 'Luc\'ia Fern\'andez' 'Paloma G\'omez' 'Santiago Garc\'ia-Granda' 'Amador Men\'endez Vel\'azquez' _chemical_formula_sum 'C48 H38 Cl4 F6 Mn N5 O5 P6' _chemical_formula_weight 1261.39 _symmetry_cell_setting Triclinic _symmetry_space_group_name_H-M 'P 1' loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' _cell_length_a 10.563(2) _cell_length_b 10.603(3) _cell_length_c 12.250(3) _cell_angle_alpha 97.68(4) _cell_angle_beta 99.34(3) _cell_angle_gamma 93.11(2) _cell_volume 1337.6(5) _cell_formula_units_Z 1 _cell_measurement_temperature 293 _exptl_crystal_density_diffrn 1.566 _diffrn_ambient_temperature 293 _refine_ls_R_factor_obs 0.0442 _refine_ls_wR_factor_obs 0.1082 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_thermal_displace_type _atom_site_calc_flag _atom_site_refinement_flags _atom_site_occupancy _atom_site_disorder_group _atom_site_type_symbol Mn1 0.0000 0.0000 0.0000 0.0295(2) Uani d . 1 . Mn Cl1 -0.4009(2) -0.4136(2) -0.2245(2) 0.0591(5) Uani d . 1 . Cl Cl2 -0.2239(2) -0.5486(2) -0.3713(2) 0.0771(7) Uani d . 1 . Cl Cl3 -0.3004(3) -0.2937(2) -0.6486(2) 0.0756(7) Uani d . 1 . Cl Cl4 -0.4416(2) -0.0979(2) -0.5158(2) 0.0705(6) Uani d . 1 . Cl P1 0.0908(2) 0.0135(2) 0.1773(2) 0.0373(4) Uani d . 1 . P P2 -0.0858(2) 0.0050(2) -0.1897(2) 0.0290(4) Uani d . 1 . P P3 -0.1010(2) -0.1726(2) -0.3148(2) 0.0299(4) Uani d . 1 . P P4 -0.2821(2) -0.3748(2) -0.3271(2) 0.0393(4) Uani d . 1 . P P5 -0.3084(2) -0.2227(2) -0.4901(2) 0.0398(4) Uani d . 1 . P P6 -0.5638(2) -0.5400(2) -0.9677(2) 0.0669(6) Uani d . 1 . P F1 -0.4183(7) -0.5677(8) -0.9821(8) 0.155(3) Uani d . 1 . F F2 -0.6994(6) -0.5224(8) -0.946(2) 0.203(5) Uani d . 1 . F F3 -0.5973(8) -0.6842(7) -0.9890(10) 0.169(4) Uani d . 1 . F F4 -0.5930(9) -0.552(2) -1.0960(8) 0.190(4) Uani d . 1 . F F5 -0.5210(10) -0.4030(8) -0.9504(13) 0.235(6) Uani d . 1 . F F6 -0.5200(10) -0.542(2) -0.8444(8) 0.233(6) Uani d . 1 . F O1 0.2605(5) -0.0284(5) -0.0491(5) 0.069(2) Uani d . 1 . O O2 0.0296(5) 0.2814(5) 0.0241(5) 0.060(2) Uani d . 1 . O O3 0.2038(5) 0.1263(5) 0.2105(4) 0.052(2) Uani d . 1 . O O4 0.0095(5) 0.0287(4) 0.2772(4) 0.046(2) Uani d . 1 . O O5 0.1699(5) -0.1026(5) 0.2091(4) 0.056(2) Uani d . 1 . O N1 -0.1835(5) -0.0043(5) 0.0354(4) 0.029(2) Uani d . 1 . N N2 -0.0391(5) -0.1909(4) 0.0028(4) 0.035(2) Uani d . 1 . N N3 -0.1656(5) -0.2856(5) -0.2601(5) 0.036(2) Uani d . 1 . N N4 -0.3641(6) -0.3313(6) -0.4320(5) 0.050(2) Uani d . 1 . N N5 -0.1757(5) -0.1483(5) -0.4326(5) 0.040(2) Uani d . 1 . N C1 0.1590(7) -0.0146(6) -0.0316(6) 0.037(2) Uani d . 1 . C C2 0.0189(6) 0.1727(7) 0.0131(5) 0.035(2) Uani d . 1 . C C12 -0.2360(6) -0.1209(7) 0.0464(6) 0.044(2) Uani d . 1 . C C13 -0.3598(7) -0.1367(8) 0.0713(7) 0.054(2) Uani d . 1 . C H13 -0.387(8) -0.241(9) 0.093(7) 0.09(3) Uiso d . 1 . H C14 -0.4305(7) -0.0337(9) 0.0807(7) 0.061(2) Uani d . 1 . C H14 -0.5144(7) -0.0440(9) 0.0939(7) 0.065(4) Uiso calc R 1 . H C15 -0.3798(7) 0.0855(8) 0.0708(6) 0.049(2) Uani d . 1 . C H15 -0.4272(7) 0.1566(8) 0.0784(6) 0.065(4) Uiso calc R 1 . H C16 -0.2548(6) 0.0955(7) 0.0490(5) 0.039(2) Uani d . 1 . C H16 -0.2187(6) 0.1759(7) 0.0436(5) 0.065(4) Uiso calc R 1 . H C22 -0.1533(7) -0.2281(6) 0.0289(6) 0.042(2) Uani d . 1 . C C23 -0.1885(8) -0.3503(7) 0.0377(8) 0.059(2) Uani d . 1 . C H23 -0.260(8) -0.379(7) 0.064(6) 0.05(2) Uiso d . 1 . H C24 -0.1024(9) -0.4425(8) 0.0228(8) 0.070(2) Uani d . 1 . C H24 -0.1241(9) -0.5267(8) 0.0305(8) 0.065(4) Uiso calc R 1 . H C25 0.0136(9) -0.4092(7) -0.0029(7) 0.061(2) Uani d . 1 . C H25 0.0717(9) -0.4704(7) -0.0148(7) 0.065(4) Uiso calc R 1 . H C26 0.0442(7) -0.2827(7) -0.0111(6) 0.049(2) Uani d . 1 . C H26 0.1248(7) -0.2596(7) -0.0268(6) 0.065(4) Uiso calc R 1 . H C31 0.2781(6) 0.1700(7) 0.3148(6) 0.047(2) Uani d . 1 . C C32 0.3497(7) 0.2833(7) 0.3180(7) 0.053(2) Uani d . 1 . C H32 0.3463(7) 0.3236(7) 0.2547(7) 0.065(4) Uiso calc R 1 . H C33 0.4257(8) 0.3347(8) 0.4163(8) 0.068(2) Uani d . 1 . C H33 0.4727(8) 0.4123(8) 0.4198(8) 0.065(4) Uiso calc R 1 . H C34 0.4355(8) 0.2757(9) 0.5110(8) 0.067(2) Uani d . 1 . C H34 0.4891(8) 0.3108(9) 0.5772(8) 0.065(4) Uiso calc R 1 . H C35 0.3622(9) 0.1629(9) 0.5024(7) 0.066(2) Uani d . 1 . C H35 0.3665(9) 0.1209(9) 0.5647(7) 0.065(4) Uiso calc R 1 . H C36 0.2841(8) 0.1107(8) 0.4073(6) 0.063(2) Uani d . 1 . C H36 0.2348(8) 0.0346(8) 0.4047(6) 0.065(4) Uiso calc R 1 . H C41 -0.0797(7) 0.1206(7) 0.2916(6) 0.046(2) Uani d . 1 . C C42 -0.0562(7) 0.2442(7) 0.2725(6) 0.049(2) Uani d . 1 . C H42 0.0197(7) 0.2707(7) 0.2501(6) 0.065(4) Uiso calc R 1 . H C43 -0.1499(9) 0.3265(7) 0.2878(6) 0.056(2) Uani d . 1 . C H43 -0.1367(9) 0.4100(7) 0.2742(6) 0.065(4) Uiso calc R 1 . H C44 -0.2610(10) 0.2914(9) 0.3220(7) 0.069(2) Uani d . 1 . C H44 -0.3230(10) 0.3496(9) 0.3307(7) 0.065(4) Uiso calc R 1 . H C45 -0.2809(8) 0.1674(9) 0.3437(7) 0.064(2) Uani d . 1 . C H45 -0.3558(8) 0.1429(9) 0.3687(7) 0.065(4) Uiso calc R 1 . H C46 -0.1910(7) 0.0804(7) 0.3287(6) 0.051(2) Uani d . 1 . C H46 -0.2042(7) -0.0029(7) 0.3429(6) 0.065(4) Uiso calc R 1 . H C51 0.1579(7) -0.2105(6) 0.2613(5) 0.043(2) Uani d . 1 . C C52 0.2609(9) -0.2807(8) 0.2678(8) 0.075(3) Uani d . 1 . C H52 0.3324(9) -0.2562(8) 0.2380(8) 0.065(4) Uiso calc R 1 . H C53 0.260(2) -0.3880(10) 0.319(2) 0.103(4) Uani d . 1 . C H53 0.331(2) -0.4370(10) 0.325(2) 0.065(4) Uiso calc R 1 . H C54 0.151(2) -0.4236(9) 0.3609(9) 0.093(3) Uani d . 1 . C H54 0.148(2) -0.4980(9) 0.3933(9) 0.065(4) Uiso calc R 1 . H C55 0.0486(9) -0.3518(8) 0.3561(8) 0.073(3) Uani d . 1 . C H55 -0.0225(9) -0.3747(8) 0.3871(8) 0.065(4) Uiso calc R 1 . H C56 0.0511(8) -0.2443(7) 0.3044(8) 0.064(2) Uani d . 1 . C H56 -0.0191(8) -0.1949(7) 0.2988(8) 0.065(4) Uiso calc R 1 . H C61 -0.2531(6) 0.0461(6) -0.2080(5) 0.032(2) Uani d . 1 . C C62 -0.3509(6) -0.0415(7) -0.2045(5) 0.040(2) Uani d . 1 . C H62 -0.3334(6) -0.1263(7) -0.2031(5) 0.065(4) Uiso calc R 1 . H C63 -0.4779(7) -0.0079(9) -0.2029(6) 0.057(2) Uani d . 1 . C H63 -0.5445(7) -0.0687(9) -0.2023(6) 0.065(4) Uiso calc R 1 . H C64 -0.4983(8) 0.118(2) -0.2022(7) 0.069(3) Uani d . 1 . C H64 -0.5807(8) 0.143(2) -0.1991(7) 0.065(4) Uiso calc R 1 . H C65 -0.4033(9) 0.2075(9) -0.2059(7) 0.066(2) Uani d . 1 . C H65 -0.4214(9) 0.2923(9) -0.2062(7) 0.065(4) Uiso calc R 1 . H C66 -0.2812(7) 0.1734(7) -0.2091(6) 0.045(2) Uani d . 1 . C H66 -0.2163(7) 0.2351(7) -0.2120(6) 0.065(4) Uiso calc R 1 . H C71 -0.0081(6) 0.1185(6) -0.2636(5) 0.031(2) Uani d . 1 . C C72 -0.0666(7) 0.1461(6) -0.3651(6) 0.042(2) Uani d . 1 . C H72 -0.1463(7) 0.1047(6) -0.3975(6) 0.065(4) Uiso calc R 1 . H C73 -0.0110(8) 0.2333(7) -0.4209(6) 0.049(2) Uani d . 1 . C H73 -0.0526(8) 0.2502(7) -0.4897(6) 0.065(4) Uiso calc R 1 . H C74 0.1086(8) 0.2957(7) -0.3725(7) 0.056(2) Uani d . 1 . C H74 0.1467(8) 0.3551(7) -0.4090(7) 0.065(4) Uiso calc R 1 . H C75 0.1695(7) 0.2703(7) -0.2728(7) 0.056(2) Uani d . 1 . C H75 0.2498(7) 0.3115(7) -0.2418(7) 0.065(4) Uiso calc R 1 . H C76 0.1127(7) 0.1825(7) -0.2157(6) 0.045(2) Uani d . 1 . C H76 0.1545(7) 0.1664(7) -0.1466(6) 0.065(4) Uiso calc R 1 . H C81 0.0608(6) -0.2053(6) -0.3295(6) 0.033(2) Uani d . 1 . C C82 0.1279(7) -0.1356(7) -0.3911(6) 0.045(2) Uani d . 1 . C H82 0.0918(7) -0.0684(7) -0.4233(6) 0.065(4) Uiso calc R 1 . H C83 0.2509(7) -0.1675(8) -0.4045(7) 0.059(2) Uani d . 1 . C H83 0.2983(7) -0.1193(8) -0.4442(7) 0.065(4) Uiso calc R 1 . H C84 0.3022(7) -0.2665(8) -0.3614(7) 0.060(2) Uani d . 1 . C H84 0.3831(7) -0.2880(8) -0.3747(7) 0.065(4) Uiso calc R 1 . H C85 0.2386(7) -0.3369(7) -0.2979(7) 0.055(2) Uani d . 1 . C H85 0.2767(7) -0.4032(7) -0.2657(7) 0.065(4) Uiso calc R 1 . H C86 0.1148(7) -0.3060(7) -0.2831(7) 0.053(2) Uani d . 1 . C H86 0.0687(7) -0.3534(7) -0.2419(7) 0.065(4) Uiso calc R 1 . H 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 Mn1 0.0264(5) 0.0267(5) 0.0354(5) 0.0025(4) 0.0048(4) 0.0051(4) Cl1 0.043(2) 0.065(2) 0.074(2) -0.0095(9) 0.0190(10) 0.0180(10) Cl2 0.076(2) 0.0340(10) 0.117(2) 0.0040(10) 0.025(2) -0.013(2) Cl3 0.086(2) 0.091(2) 0.042(2) -0.019(2) 0.0110(10) -0.013(2) Cl4 0.041(2) 0.092(2) 0.088(2) 0.020(2) 0.012(2) 0.039(2) P1 0.0360(10) 0.0410(10) 0.0360(10) 0.0003(8) 0.0022(8) 0.0125(8) P2 0.0264(9) 0.0290(8) 0.0308(9) 0.0004(7) 0.0042(7) 0.0025(7) P3 0.0236(9) 0.0296(9) 0.0361(9) 0.0019(7) 0.0071(7) 0.0013(7) P4 0.0340(10) 0.0316(9) 0.051(2) -0.0030(8) 0.0113(9) 0.0022(8) P5 0.0310(10) 0.048(2) 0.0390(10) -0.0037(8) 0.0050(8) 0.0021(8) P6 0.065(2) 0.069(2) 0.066(2) -0.017(2) 0.024(2) 0.002(2) F1 0.086(5) 0.181(8) 0.196(9) -0.013(5) 0.057(5) -0.007(6) F2 0.060(4) 0.145(7) 0.39(2) 0.012(4) 0.080(7) -0.055(8) F3 0.153(7) 0.089(5) 0.28(2) -0.010(5) 0.091(7) 0.012(6) F4 0.175(9) 0.24(2) 0.137(7) -0.029(8) -0.015(6) 0.035(7) F5 0.175(9) 0.090(6) 0.43(2) -0.051(6) 0.060(10) 0.023(8) F6 0.179(9) 0.40(2) 0.109(7) -0.060(10) 0.006(6) 0.061(9) O1 0.034(3) 0.076(4) 0.107(5) 0.014(3) 0.023(3) 0.033(4) O2 0.084(4) 0.025(3) 0.074(4) -0.004(3) 0.026(3) 0.006(2) O3 0.049(3) 0.058(3) 0.045(3) -0.016(2) -0.006(2) 0.015(2) O4 0.049(3) 0.048(3) 0.044(3) 0.004(2) 0.011(2) 0.012(2) O5 0.045(3) 0.070(3) 0.060(3) 0.021(3) 0.010(3) 0.031(3) N1 0.027(3) 0.029(3) 0.033(3) 0.000(2) 0.010(2) 0.001(2) N2 0.036(3) 0.024(3) 0.046(3) 0.001(3) 0.002(3) 0.012(2) N3 0.032(3) 0.032(3) 0.045(3) 0.000(2) 0.012(3) 0.008(2) N4 0.044(4) 0.049(4) 0.054(4) -0.015(3) 0.007(3) 0.003(3) N5 0.035(3) 0.035(3) 0.049(3) -0.004(2) 0.014(3) 0.001(3) C1 0.036(4) 0.037(4) 0.045(4) 0.007(3) 0.017(3) 0.013(3) C2 0.032(4) 0.040(4) 0.034(4) 0.005(3) 0.004(3) 0.009(3) C12 0.030(4) 0.063(5) 0.041(4) -0.001(4) 0.004(3) 0.015(4) C13 0.032(4) 0.059(5) 0.072(5) -0.006(4) 0.008(4) 0.022(4) C14 0.030(4) 0.090(7) 0.066(5) 0.006(4) 0.019(4) 0.009(5) C15 0.037(4) 0.073(5) 0.040(4) 0.018(4) 0.008(3) 0.006(4) C16 0.035(4) 0.052(4) 0.032(4) 0.008(3) 0.007(3) 0.003(3) C22 0.044(4) 0.040(4) 0.044(4) 0.000(3) 0.003(3) 0.021(3) C23 0.048(5) 0.035(4) 0.094(7) -0.011(4) 0.010(5) 0.020(4) C24 0.077(6) 0.040(5) 0.094(7) -0.005(5) 0.007(5) 0.029(4) C25 0.067(6) 0.035(4) 0.084(6) 0.011(4) 0.010(5) 0.022(4) C26 0.044(4) 0.043(4) 0.059(5) 0.010(4) -0.005(4) 0.012(4) C31 0.027(4) 0.051(4) 0.056(5) 0.001(3) -0.003(3) 0.001(4) C32 0.037(4) 0.057(5) 0.059(5) -0.003(4) -0.003(4) 0.008(4) C33 0.056(6) 0.052(5) 0.088(7) 0.001(4) -0.003(5) 0.002(5) C34 0.057(5) 0.072(6) 0.061(6) 0.008(5) -0.016(4) -0.003(5) C35 0.082(6) 0.072(6) 0.042(5) 0.012(5) -0.010(4) 0.014(4) C36 0.078(6) 0.060(5) 0.042(5) -0.018(4) -0.014(4) 0.022(4) C41 0.061(5) 0.042(4) 0.034(4) 0.000(4) 0.008(4) 0.000(3) C42 0.057(5) 0.051(5) 0.038(4) -0.006(4) 0.012(4) -0.001(3) C43 0.083(7) 0.043(4) 0.045(4) 0.016(5) 0.016(4) 0.001(4) C44 0.073(6) 0.075(7) 0.063(6) 0.025(5) 0.022(5) 0.002(5) C45 0.050(5) 0.076(6) 0.066(5) -0.005(5) 0.019(4) -0.002(5) C46 0.057(5) 0.044(4) 0.051(5) -0.007(4) 0.014(4) 0.008(4) C51 0.054(5) 0.035(4) 0.040(4) 0.002(4) 0.002(3) 0.010(3) C52 0.083(6) 0.065(6) 0.092(7) 0.033(5) 0.032(5) 0.037(5) C53 0.098(9) 0.072(7) 0.15(2) 0.036(6) 0.018(8) 0.047(7) C54 0.130(10) 0.051(6) 0.110(8) 0.012(6) 0.032(7) 0.039(5) C55 0.083(7) 0.052(5) 0.096(7) 0.009(5) 0.032(6) 0.031(5) C56 0.067(6) 0.038(4) 0.088(6) 0.008(4) 0.013(5) 0.015(4) C61 0.022(3) 0.044(4) 0.029(4) 0.012(3) 0.003(3) -0.004(3) C62 0.031(4) 0.047(4) 0.040(4) 0.013(3) 0.005(3) -0.009(3) C63 0.037(5) 0.087(7) 0.042(4) -0.005(4) 0.004(3) -0.008(4) C64 0.040(5) 0.117(8) 0.055(5) 0.027(5) 0.013(4) 0.017(5) C65 0.083(7) 0.068(6) 0.065(5) 0.044(5) 0.034(5) 0.034(5) C66 0.047(4) 0.047(4) 0.052(4) 0.027(4) 0.018(3) 0.024(3) C71 0.027(3) 0.029(3) 0.038(4) -0.002(3) 0.008(3) 0.004(3) C72 0.054(5) 0.036(4) 0.037(4) 0.004(3) 0.014(3) 0.001(3) C73 0.063(5) 0.044(4) 0.041(4) 0.007(4) 0.011(4) 0.011(3) C74 0.060(5) 0.054(5) 0.060(5) -0.002(4) 0.029(4) 0.016(4) C75 0.042(4) 0.059(5) 0.071(6) -0.015(4) 0.011(4) 0.025(4) C76 0.040(4) 0.046(4) 0.051(4) 0.004(3) 0.002(4) 0.014(4) C81 0.021(3) 0.036(4) 0.044(4) 0.003(3) 0.015(3) -0.003(3) C82 0.039(4) 0.049(4) 0.052(4) 0.013(3) 0.017(3) 0.012(4) C83 0.035(4) 0.062(5) 0.085(6) -0.004(4) 0.031(4) 0.002(5) C84 0.026(4) 0.064(5) 0.093(7) 0.005(4) 0.021(4) 0.002(5) C85 0.030(4) 0.061(5) 0.082(6) 0.027(4) 0.016(4) 0.022(4) C86 0.034(4) 0.052(5) 0.077(6) 0.005(4) 0.018(4) 0.014(4) loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag Mn1 C1 . 1.793(7) yes Mn1 C2 . 1.814(7) yes Mn1 N2 . 2.050(5) yes Mn1 N1 . 2.053(5) yes Mn1 P1 . 2.210(2) yes Mn1 P2 . 2.362(2) yes Cl1 P4 . 1.979(3) yes Cl2 P4 . 2.008(2) yes Cl3 P5 . 2.004(3) yes Cl4 P5 . 2.000(3) yes P1 O5 . 1.581(5) yes P1 O4 . 1.603(5) yes P1 O3 . 1.606(5) yes P2 C61 . 1.829(6) ? P2 C71 . 1.836(6) ? P2 P3 . 2.245(2) yes P3 N5 . 1.588(6) yes P3 N3 . 1.621(5) yes P3 C81 . 1.794(6) ? P4 N3 . 1.556(5) yes P4 N4 . 1.566(7) yes P5 N4 . 1.569(6) yes P5 N5 . 1.579(6) yes P6 F5 . 1.474(7) ? P6 F6 . 1.510(9) ? P6 F2 . 1.516(7) ? P6 F3 . 1.528(7) ? P6 F4 . 1.539(9) ? P6 F1 . 1.613(7) ? O1 C1 . 1.141(7) yes O2 C2 . 1.139(7) yes O3 C31 . 1.392(8) ? O4 C41 . 1.405(8) ? O5 C51 . 1.394(8) ? N1 C16 . 1.340(8) ? N1 C12 . 1.360(8) ? N2 C22 . 1.348(8) ? N2 C26 . 1.360(8) ? C12 C13 . 1.396(9) ? C12 C22 . 1.490(10) ? C13 C14 . 1.360(10) ? C14 C15 . 1.37(2) ? C15 C16 . 1.390(9) ? C22 C23 . 1.351(9) ? C23 C24 . 1.39(2) ? C24 C25 . 1.35(2) ? C25 C26 . 1.380(10) ? C31 C36 . 1.360(10) ? C31 C32 . 1.380(10) ? C32 C33 . 1.36(2) ? C33 C34 . 1.38(2) ? C34 C35 . 1.37(2) ? C35 C36 . 1.35(2) ? C41 C42 . 1.380(10) ? C41 C46 . 1.390(10) ? C42 C43 . 1.370(10) ? C43 C44 . 1.36(2) ? C44 C45 . 1.39(2) ? C45 C46 . 1.38(2) ? C51 C52 . 1.350(10) ? C51 C56 . 1.370(10) ? C52 C53 . 1.37(2) ? C53 C54 . 1.39(2) ? C54 C55 . 1.35(2) ? C55 C56 . 1.38(2) ? C61 C62 . 1.362(9) ? C61 C66 . 1.399(9) ? C62 C63 . 1.410(10) ? C63 C64 . 1.36(2) ? C64 C65 . 1.35(2) ? C65 C66 . 1.360(10) ? C71 C72 . 1.371(9) ? C71 C76 . 1.410(9) ? C72 C73 . 1.380(10) ? C73 C74 . 1.40(2) ? C74 C75 . 1.35(2) ? C75 C76 . 1.400(10) ? C81 C82 . 1.372(9) ? C81 C86 . 1.380(10) ? C82 C83 . 1.390(10) ? C83 C84 . 1.34(2) ? C84 C85 . 1.37(2) ? C85 C86 . 1.400(10) ? _cod_database_code 2010373