data_2008476 _journal_name_full 'Acta Crystallographica' _journal_year 1999 _journal_volume C55 _journal_page_first 733 _journal_page_last 739 _publ_section_title ; Salts of the bis(catecholato)borate anion with rhodium and iridium phosphine complex cations ; loop_ _publ_author_name 'Clegg, William' 'Elsegood, Mark R.J.' 'Scott, Andrew J.' 'Marder, Todd B.' 'Dai, Chaoyang' 'Norman, Nicholas C.' 'Pickett, Nigel L.' 'Robins, Edward G.' _chemical_formula_moiety '[RhClH(C26 H48 P2 )2 ] +, C12 H8 B O4 -, 4C H2 Cl2' _chemical_formula_sum 'C68 H113 B Cl9 O4 P4 Rh' _chemical_formula_weight 1551.23 _symmetry_cell_setting orthorhombic _symmetry_space_group_name_H-M 'P 21 21 21' loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x+1/2, -y, z+1/2' '-x, y+1/2, -z+1/2' 'x+1/2, -y+1/2, -z' _cell_length_a 13.9320(8) _cell_length_b 21.2938(10) _cell_length_c 25.5613(14) _cell_angle_alpha 90.00 _cell_angle_beta 90.00 _cell_angle_gamma 90.00 _cell_volume 7583.1(7) _cell_formula_units_Z 4 _cell_measurement_temperature 160(2) _exptl_crystal_density_diffrn 1.359 _diffrn_ambient_temperature 160(2) 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_refinement_flags _atom_site_occupancy _atom_site_disorder_assembly _atom_site_disorder_group _atom_site_type_symbol Rh .23507(4) .50214(3) .64559(2) .01258(12) Uani d . 1 . . Rh H1 .251(8) .478(4) .601(4) .05(3) Uiso d . 1 . . H Cl1 .22653(16) .53791(9) .73919(8) .0196(4) Uani d . 1 . . Cl P1 .33873(15) .59248(9) .64109(9) .0156(4) Uani d . 1 . . P C1 .2911(6) .6644(4) .6747(3) .0189(18) Uani d . 1 . . C H1A .2272 .6522 .6893 .023 Uiso calc R 1 . . H C2 .3519(8) .6857(4) .7222(4) .032(2) Uani d . 1 . . C H2A .3633 .6496 .7458 .039 Uiso calc R 1 . . H H2B .4148 .7016 .7101 .039 Uiso calc R 1 . . H C3 .2982(8) .7378(5) .7519(4) .040(3) Uani d . 1 . . C H3A .2374 .7206 .7660 .048 Uiso calc R 1 . . H H3B .3378 .7518 .7819 .048 Uiso calc R 1 . . H C4 .2760(8) .7936(5) .7175(5) .043(3) Uani d . 1 . . C H4A .3368 .8143 .7071 .052 Uiso calc R 1 . . H H4B .2375 .8244 .7376 .052 Uiso calc R 1 . . H C5 .2209(7) .7742(4) .6686(4) .028(2) Uani d . 1 . . C H5A .2136 .8110 .6453 .034 Uiso calc R 1 . . H H5B .1559 .7599 .6787 .034 Uiso calc R 1 . . H C6 .2720(6) .7215(4) .6390(4) .0254(19) Uani d . 1 . . C H6A .3338 .7374 .6251 .031 Uiso calc R 1 . . H H6B .2321 .7082 .6089 .031 Uiso calc R 1 . . H C7 .3943(6) .6208(4) .5790(3) .0177(18) Uani d . 1 . . C H7 .3467 .6511 .5644 .021 Uiso calc R 1 . . H C8 .4876(6) .6608(4) .5879(3) .0191(18) Uani d U 1 . . C H8A .4759 .6926 .6155 .023 Uiso calc R 1 . . H H8B .5406 .6332 .5997 .023 Uiso calc R 1 . . H C9 .5150(7) .6928(5) .5378(4) .033(2) Uani d . 1 . . C H9A .5758 .7160 .5432 .039 Uiso calc R 1 . . H H9B .4648 .7239 .5287 .039 Uiso calc R 1 . . H C10 .5275(7) .6476(5) .4925(4) .038(3) Uani d . 1 . . C H10A .5832 .6200 .4993 .046 Uiso calc R 1 . . H H10B .5405 .6716 .4601 .046 Uiso calc R 1 . . H C11 .4374(7) .6076(4) .4851(4) .026(2) Uani d . 1 . . C H11A .3835 .6348 .4739 .032 Uiso calc R 1 . . H H11B .4489 .5762 .4572 .032 Uiso calc R 1 . . H C12 .4104(6) .5739(4) .5357(4) .0205(19) Uani d . 1 . . C H12A .3512 .5490 .5302 .025 Uiso calc R 1 . . H H12B .4625 .5446 .5458 .025 Uiso calc R 1 . . H P2 .38201(15) .44718(9) .66374(8) .0132(4) Uani d . 1 . . P C13 .3956(5) .4172(3) .7325(3) .0115(15) Uani d . 1 . . C H13 .3493 .4424 .7538 .014 Uiso calc R 1 . . H C14 .3633(6) .3485(4) .7392(3) .0191(18) Uani d . 1 . . C H14A .2986 .3432 .7239 .023 Uiso calc R 1 . . H H14B .4080 .3206 .7201 .023 Uiso calc R 1 . . H C15 .3609(7) .3292(4) .7971(3) .024(2) Uani d . 1 . . C H15A .3115 .3541 .8157 .029 Uiso calc R 1 . . H H15B .3433 .2843 .8000 .029 Uiso calc R 1 . . H C16 .4576(7) .3398(5) .8226(4) .032(2) Uani d . 1 . . C H16A .5056 .3116 .8065 .038 Uiso calc R 1 . . H H16B .4533 .3295 .8603 .038 Uiso calc R 1 . . H C17 .4902(7) .4078(4) .8164(3) .022(2) Uani d . 1 . . C H17A .5547 .4127 .8321 .026 Uiso calc R 1 . . H H17B .4455 .4357 .8355 .026 Uiso calc R 1 . . H C18 .4940(6) .4278(4) .7584(3) .0211(19) Uani d . 1 . . C H18A .5117 .4727 .7560 .025 Uiso calc R 1 . . H H18B .5436 .4030 .7399 .025 Uiso calc R 1 . . H C19 .4241(6) .3841(4) .6194(3) .0186(18) Uani d . 1 . . C H19 .3786 .3481 .6233 .022 Uiso calc R 1 . . H C20 .5255(6) .3594(4) .6337(3) .0212(19) Uani d . 1 . . C H20A .5728 .3939 .6300 .025 Uiso calc R 1 . . H H20B .5260 .3454 .6706 .025 Uiso calc R 1 . . H C21 .5547(8) .3044(5) .5981(4) .031(2) Uani d . 1 . . C H21A .6201 .2902 .6074 .038 Uiso calc R 1 . . H H21B .5102 .2688 .6037 .038 Uiso calc R 1 . . H C22 .5526(7) .3234(5) .5408(4) .032(2) Uani d . 1 . . C H22A .5686 .2866 .5187 .038 Uiso calc R 1 . . H H22B .6013 .3563 .5344 .038 Uiso calc R 1 . . H C23 .4514(7) .3485(5) .5256(4) .029(2) Uani d . 1 . . C H23A .4520 .3629 .4888 .035 Uiso calc R 1 . . H H23B .4036 .3144 .5288 .035 Uiso calc R 1 . . H C24 .4233(6) .4029(4) .5613(3) .0221(19) Uani d . 1 . . C H24A .3583 .4176 .5517 .027 Uiso calc R 1 . . H H24B .4685 .4381 .5559 .027 Uiso calc R 1 . . H C25 .4429(6) .5680(4) .6791(4) .0202(19) Uani d . 1 . . C H25A .4941 .6000 .6764 .024 Uiso calc R 1 . . H H25B .4250 .5635 .7164 .024 Uiso calc R 1 . . H C26 .4788(5) .5057(4) .6580(3) .0130(15) Uani d . 1 . . C H26A .5356 .4918 .6781 .016 Uiso calc R 1 . . H H26B .4978 .5104 .6208 .016 Uiso calc R 1 . . H P3 .12825(15) .41628(10) .65756(8) .0141(4) Uani d . 1 . . P C27 .1651(6) .3345(3) .6415(3) .0162(16) Uani d . 1 . . C H27 .2280 .3271 .6594 .019 Uiso calc R 1 . . H C28 .0962(6) .2824(3) .6607(3) .0197(18) Uani d . 1 . . C H28A .0856 .2868 .6988 .024 Uiso calc R 1 . . H H28B .0334 .2866 .6429 .024 Uiso calc R 1 . . H C29 .1396(7) .2173(4) .6488(4) .030(2) Uani d . 1 . . C H29A .2001 .2122 .6687 .036 Uiso calc R 1 . . H H29B .0945 .1842 .6603 .036 Uiso calc R 1 . . H C30 .1599(7) .2095(4) .5906(3) .027(2) Uani d . 1 . . C H30A .1915 .1685 .5846 .032 Uiso calc R 1 . . H H30B .0986 .2097 .5711 .032 Uiso calc R 1 . . H C31 .2239(8) .2616(4) .5707(4) .034(2) Uani d . 1 . . C H31A .2320 .2570 .5324 .041 Uiso calc R 1 . . H H31B .2880 .2578 .5871 .041 Uiso calc R 1 . . H C32 .1832(7) .3262(4) .5823(3) .0192(18) Uani d . 1 . . C H32A .1222 .3318 .5630 .023 Uiso calc R 1 . . H H32B .2288 .3587 .5701 .023 Uiso calc R 1 . . H C33 .0724(6) .4211(4) .7231(3) .0146(17) Uani d U 1 . . C H33 .0671 .4672 .7301 .018 Uiso calc R 1 . . H C34 -.0310(6) .3964(4) .7299(3) .0189(18) Uani d . 1 . . C H34A -.0313 .3500 .7277 .023 Uiso calc R 1 . . H H34B -.0723 .4131 .7016 .023 Uiso calc R 1 . . H C35 -.0705(6) .4174(4) .7837(3) .0239(19) Uani d . 1 . . C H35A -.0726 .4638 .7852 .029 Uiso calc R 1 . . H H35B -.1367 .4014 .7881 .029 Uiso calc R 1 . . H C36 -.0075(7) .3926(5) .8277(4) .029(2) Uani d . 1 . . C H36A -.0092 .3461 .8278 .035 Uiso calc R 1 . . H H36B -.0327 .4075 .8617 .035 Uiso calc R 1 . . H C37 .0962(7) .4150(5) .8210(4) .029(2) Uani d . 1 . . C H37A .0986 .4613 .8247 .034 Uiso calc R 1 . . H H37B .1367 .3964 .8487 .034 Uiso calc R 1 . . H C38 .1354(7) .3965(4) .7679(4) .026(2) Uani d . 1 . . C H38A .1392 .3502 .7657 .031 Uiso calc R 1 . . H H38B .2011 .4135 .7640 .031 Uiso calc R 1 . . H P4 .09416(15) .54998(10) .61004(9) .0159(4) Uani d . 1 . . P C39 .0936(6) .5642(4) .5383(3) .0149(17) Uani d U 1 . . C H39 .0268 .5777 .5295 .018 Uiso calc R 1 . . H C40 .1128(7) .5056(4) .5058(3) .0253(18) Uani d . 1 . . C H40A .0637 .4734 .5138 .030 Uiso calc R 1 . . H H40B .1764 .4881 .5153 .030 Uiso calc R 1 . . H C41 .1108(7) .5204(4) .4469(3) .028(2) Uani d . 1 . . C H41A .1260 .4819 .4268 .033 Uiso calc R 1 . . H H41B .0457 .5345 .4367 .033 Uiso calc R 1 . . H C42 .1840(7) .5717(5) .4338(4) .032(2) Uani d . 1 . . C H42A .2493 .5571 .4429 .039 Uiso calc R 1 . . H H42B .1824 .5806 .3958 .039 Uiso calc R 1 . . H C43 .1614(8) .6305(5) .4637(4) .034(2) Uani d . 1 . . C H43A .0982 .6468 .4522 .040 Uiso calc R 1 . . H H43B .2103 .6628 .4556 .040 Uiso calc R 1 . . H C44 .1591(7) .6194(5) .5227(3) .026(2) Uani d . 1 . . C H44A .1363 .6581 .5402 .032 Uiso calc R 1 . . H H44B .2251 .6109 .5351 .032 Uiso calc R 1 . . H C45 .0443(6) .6238(4) .6377(3) .0167(17) Uani d . 1 . . C H45 .0970 .6557 .6369 .020 Uiso calc R 1 . . H C46 .0145(7) .6156(5) .6960(4) .030(2) Uani d . 1 . . C H46A -.0391 .5852 .6984 .036 Uiso calc R 1 . . H H46B .0693 .5985 .7162 .036 Uiso calc R 1 . . H C47 -.0165(7) .6780(5) .7195(4) .033(2) Uani d . 1 . . C H47A -.0378 .6713 .7560 .040 Uiso calc R 1 . . H H47B .0392 .7069 .7202 .040 Uiso calc R 1 . . H C48 -.0966(7) .7080(5) .6889(5) .039(3) Uani d . 1 . . C H48A -.1104 .7500 .7037 .047 Uiso calc R 1 . . H H48B -.1553 .6821 .6926 .047 Uiso calc R 1 . . H C49 -.0724(8) .7146(5) .6314(4) .042(3) Uani d . 1 . . C H49A -.0202 .7458 .6273 .050 Uiso calc R 1 . . H H49B -.1294 .7306 .6125 .050 Uiso calc R 1 . . H C50 -.0406(7) .6516(4) .6067(4) .030(2) Uani d . 1 . . C H50A -.0950 .6217 .6070 .036 Uiso calc R 1 . . H H50B -.0213 .6585 .5699 .036 Uiso calc R 1 . . H C51 -.0079(5) .4954(4) .6162(3) .0192(16) Uani d . 1 . . C H51A -.0409 .5027 .6499 .023 Uiso calc R 1 . . H H51B -.0545 .5034 .5877 .023 Uiso calc R 1 . . H C52 .0256(6) .4276(4) .6135(3) .0182(18) Uani d . 1 . . C H52A .0446 .4172 .5772 .022 Uiso calc R 1 . . H H52B -.0274 .3992 .6238 .022 Uiso calc R 1 . . H B .7212(7) .4990(6) .5490(4) .028(2) Uani d . 1 . . B O1 .8003(4) .4988(3) .5105(2) .0296(13) Uani d . 1 . . O O2 .6326(5) .4872(3) .5188(3) .0303(15) Uani d . 1 . . O C53 .7608(8) .4851(4) .4636(4) .035(2) Uani d . 1 . . C C54 .6623(8) .4798(4) .4682(4) .035(3) Uani d . 1 . . C C55 .6046(11) .4655(5) .4253(5) .056(4) Uani d . 1 . . C H55 .5371 .4605 .4285 .067 Uiso calc R 1 . . H C56 .6512(14) .4589(6) .3773(5) .066(5) Uani d . 1 . . C H56 .6147 .4504 .3467 .079 Uiso calc R 1 . . H C57 .7495(15) .4645(5) .3736(5) .071(5) Uani d . 1 . . C H57 .7793 .4581 .3406 .086 Uiso calc R 1 . . H C58 .8069(11) .4794(5) .4167(4) .049(3) Uani d . 1 . . C H58 .8742 .4851 .4135 .059 Uiso calc R 1 . . H O3 .7152(5) .5607(3) .5775(2) .0241(14) Uani d . 1 . . O O4 .7367(5) .4523(3) .5905(2) .0261(14) Uani d . 1 . . O C59 .7208(7) .5465(4) .6296(4) .026(2) Uani d . 1 . . C C60 .7313(6) .4823(4) .6365(3) .0212(18) Uani d . 1 . . C C61 .7363(7) .4569(5) .6860(3) .027(2) Uani d . 1 . . C H61 .7454 .4131 .6910 .033 Uiso calc R 1 . . H C62 .7277(7) .4976(6) .7285(4) .040(2) Uani d . 1 . . C H62 .7300 .4810 .7630 .048 Uiso calc R 1 . . H C63 .7159(8) .5610(6) .7217(4) .044(3) Uani d . 1 . . C H63 .7118 .5878 .7513 .053 Uiso calc R 1 . . H C64 .7100(6) .5866(5) .6709(4) .032(2) Uani d . 1 . . C H64 .6989 .6301 .6656 .038 Uiso calc R 1 . . H C65 .4580(14) .1443(6) .6514(6) .087(6) Uani d . 1 . . C H65A .4024 .1338 .6290 .105 Uiso calc R 1 . . H H65B .5042 .1685 .6300 .105 Uiso calc R 1 . . H Cl2 .5122(3) .07542(15) .67157(13) .0641(10) Uani d . 1 . . Cl Cl3 .4188(3) .19138(15) .70288(16) .0634(10) Uani d . 1 . . Cl C66 .3512(8) .1484(5) .4759(4) .041(3) Uani d . 1 . . C H66A .3498 .1076 .4573 .049 Uiso calc R 1 . . H H66B .2934 .1510 .4983 .049 Uiso calc R 1 . . H Cl4 .3495(3) .20955(15) .43031(15) .0661(10) Uani d . 1 . . Cl Cl5 .4554(2) .15248(17) .51545(13) .0587(9) Uani d . 1 . . Cl C67 .7909(7) .6427(5) .4787(4) .036(2) Uani d . 1 . . C H67A .8035 .6148 .5090 .043 Uiso calc R 1 . . H H67B .7328 .6271 .4606 .043 Uiso calc R 1 . . H Cl6 .8885(2) .64028(14) .43595(13) .0523(8) Uani d . 1 . . Cl Cl7 .7706(2) .72021(12) .50124(12) .0492(7) Uani d . 1 . . Cl C68 .2824(12) .3951(9) .3663(7) .099(6) Uani d . 1 . . C H68A .2473 .3909 .3327 .119 Uiso calc R 1 . . H H68B .2849 .4403 .3751 .119 Uiso calc R 1 . . H Cl8 .2176(4) .3564(3) .4147(2) .129(2) Uani d . 1 . . Cl Cl9 .3967(3) .3687(3) .3576(2) .129(2) Uani d . 1 . . Cl 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 .0124(2) .0116(2) .0137(2) -.0003(3) .0006(2) -.0007(3) Cl1 .0208(10) .0172(9) .0207(10) .0009(8) .0020(9) -.0043(7) P1 .0140(10) .0150(10) .0177(10) .0003(8) .0010(9) .0006(9) C1 .013(4) .017(4) .026(5) -.005(3) .007(3) .003(4) C2 .038(6) .021(5) .039(6) .008(4) -.008(5) -.003(4) C3 .041(6) .035(6) .045(7) .010(5) -.020(5) -.026(5) C4 .030(6) .032(5) .068(8) .002(5) -.014(6) -.018(5) C5 .028(5) .016(4) .041(5) .003(4) .003(4) .004(4) C6 .016(4) .026(4) .034(5) .006(4) .005(4) -.004(4) C7 .008(4) .019(4) .026(5) -.002(3) .004(3) -.003(4) C8 .016(3) .020(3) .021(3) -.004(3) .006(3) .003(3) C9 .013(5) .027(5) .059(7) .003(4) .006(5) .009(5) C10 .027(5) .043(6) .045(7) .004(5) .013(5) .027(5) C11 .030(5) .025(5) .024(5) .007(4) .001(4) .000(4) C12 .016(4) .014(4) .032(5) .000(3) .004(4) .003(4) P2 .0136(10) .0127(9) .0134(10) .0029(8) .0004(8) -.0006(8) C13 .012(4) .009(3) .013(4) .006(3) .001(3) -.001(3) C14 .021(5) .020(4) .016(4) .009(4) -.005(4) .007(3) C15 .033(5) .022(5) .018(4) -.002(4) .004(4) .003(4) C16 .032(6) .043(6) .021(5) .008(5) .000(4) .005(4) C17 .020(5) .027(5) .019(4) -.001(4) -.005(4) .004(4) C18 .019(4) .013(4) .031(5) -.002(3) -.005(4) -.006(4) C19 .026(5) .012(4) .018(4) .004(3) .007(4) -.004(3) C20 .020(4) .019(4) .025(5) .002(3) -.001(4) -.003(4) C21 .037(6) .032(5) .025(5) .014(5) .013(4) .006(4) C22 .038(6) .028(5) .029(5) -.003(4) .020(5) -.004(4) C23 .039(6) .033(5) .015(4) .006(5) .008(4) -.001(4) C24 .017(4) .029(5) .020(5) -.002(4) .005(4) .001(4) C25 .023(5) .010(4) .028(5) -.002(3) -.005(4) .011(3) C26 .014(3) .006(3) .019(4) -.005(3) -.005(3) .002(3) P3 .0138(10) .0149(9) .0135(10) -.0007(8) -.0016(8) -.0018(8) C27 .018(4) .011(4) .019(4) -.003(3) -.001(4) -.002(3) C28 .030(5) .011(4) .018(4) .002(3) .001(4) .006(3) C29 .040(6) .017(4) .034(5) -.007(4) .004(5) .001(4) C30 .038(6) .020(4) .023(5) -.001(4) .009(4) -.009(4) C31 .048(6) .031(5) .024(5) -.003(5) .005(5) -.003(4) C32 .030(5) .013(4) .014(4) -.001(4) .007(4) .006(3) C33 .017(3) .016(3) .010(3) -.003(3) .004(3) .003(3) C34 .018(4) .012(4) .027(5) -.005(3) .001(4) .002(3) C35 .021(5) .026(5) .025(5) .002(4) .012(4) .000(4) C36 .035(6) .030(5) .022(5) -.003(4) .004(4) -.003(4) C37 .026(5) .036(5) .024(5) -.007(4) -.003(4) .007(4) C38 .024(5) .021(4) .032(5) .001(4) .001(4) .000(4) P4 .0138(11) .0169(10) .0170(10) .0006(9) .0004(8) -.0012(9) C39 .014(3) .019(3) .012(3) -.001(3) -.007(3) .002(3) C40 .038(5) .019(4) .019(4) .003(4) .006(3) .002(4) C41 .039(6) .028(5) .017(4) -.004(4) .001(4) .000(3) C42 .032(5) .047(6) .018(5) .002(5) .003(4) .007(4) C43 .031(6) .036(6) .035(6) -.009(5) -.009(5) .015(5) C44 .020(5) .037(5) .022(5) -.014(4) -.003(4) .001(4) C45 .014(4) .013(4) .024(5) .001(3) .004(4) -.007(3) C46 .019(5) .049(6) .023(5) .010(4) .008(4) -.011(4) C47 .036(6) .035(6) .028(5) -.001(5) .008(4) -.017(4) C48 .023(5) .029(5) .065(8) .009(4) -.001(5) -.015(5) C49 .038(6) .033(6) .055(8) .012(5) -.009(5) -.010(5) C50 .023(5) .020(5) .046(6) .011(4) -.011(5) -.008(5) C51 .015(4) .021(4) .022(4) .005(4) -.002(3) -.002(4) C52 .019(5) .025(4) .011(4) -.006(4) .000(3) .004(3) B .033(5) .025(5) .028(5) .002(6) .004(4) .006(5) O1 .037(3) .026(3) .025(3) .003(4) .006(3) .001(3) O2 .030(3) .028(4) .033(4) .002(3) -.002(3) .006(3) C53 .052(6) .027(5) .025(5) .003(5) .009(5) .004(4) C54 .056(7) .014(4) .034(6) -.001(4) -.012(5) .000(4) C55 .095(11) .024(6) .049(8) .006(6) -.029(7) -.001(5) C56 .125(14) .037(7) .037(7) .017(8) -.032(8) -.001(5) C57 .155(17) .032(6) .028(6) .017(9) .009(9) .003(5) C58 .085(10) .030(6) .033(6) -.007(6) .013(6) -.003(4) O3 .035(4) .019(3) .018(3) .005(3) -.004(3) .007(2) O4 .033(4) .027(3) .019(3) .004(3) .005(3) -.002(2) C59 .025(5) .020(4) .033(5) .004(4) .004(4) -.001(4) C60 .013(4) .025(4) .025(4) .005(3) .009(4) .006(3) C61 .020(4) .035(5) .027(5) .006(4) -.004(4) .008(4) C62 .028(5) .067(7) .024(4) .009(7) -.001(4) .001(6) C63 .039(7) .068(8) .027(5) -.006(6) -.001(5) -.012(5) C64 .020(5) .034(5) .042(6) -.004(4) .004(4) -.008(5) C65 .170(18) .044(8) .047(9) -.003(9) -.020(11) .001(7) Cl2 .104(3) .0416(17) .0470(18) .0158(18) -.0038(19) -.0078(15) Cl3 .065(2) .0373(16) .088(3) .0085(16) -.0104(19) -.0143(16) C66 .042(7) .037(6) .044(7) -.005(5) .006(5) -.006(5) Cl4 .072(2) .0470(18) .079(2) .0108(17) .015(2) .0174(17) Cl5 .057(2) .073(2) .0466(18) -.0126(17) .0031(15) -.0161(16) C67 .026(6) .032(5) .049(6) -.011(4) .017(5) -.002(5) Cl6 .0417(16) .0416(15) .073(2) .0082(13) .0328(15) .0046(14) Cl7 .0471(16) .0351(14) .0652(19) -.0018(13) .0263(15) -.0031(13) C68 .088(13) .119(14) .089(12) .044(11) .031(10) .053(11) Cl8 .109(4) .109(4) .168(5) .050(3) .043(4) .074(4) Cl9 .066(3) .211(6) .110(4) .024(3) -.001(3) .044(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 Rh H1 . 1.27(11) yes Rh P3 . 2.377(2) yes Rh P4 . 2.391(2) yes Rh P2 . 2.403(2) yes Rh P1 . 2.408(2) yes Rh Cl1 . 2.513(2) yes P1 C25 . 1.822(9) no P1 C7 . 1.865(9) no P1 C1 . 1.878(8) no C1 C6 . 1.543(12) no C1 C2 . 1.548(13) no C2 C3 . 1.539(13) no C3 C4 . 1.510(15) no C4 C5 . 1.525(14) no C5 C6 . 1.531(12) no C7 C12 . 1.506(12) no C7 C8 . 1.571(11) no C8 C9 . 1.501(13) no C9 C10 . 1.516(15) no C10 C11 . 1.529(14) no C11 C12 . 1.528(12) no P2 C26 . 1.842(7) no P2 C19 . 1.853(8) no P2 C13 . 1.879(8) no C13 C14 . 1.539(11) no C13 C18 . 1.540(11) no C14 C15 . 1.537(11) no C15 C16 . 1.513(13) no C16 C17 . 1.525(13) no C17 C18 . 1.543(12) no C19 C24 . 1.537(12) no C19 C20 . 1.551(12) no C20 C21 . 1.538(12) no C21 C22 . 1.519(13) no C22 C23 . 1.557(14) no C23 C24 . 1.524(12) no C25 C26 . 1.517(11) no P3 C52 . 1.837(8) no P3 C33 . 1.851(8) no P3 C27 . 1.862(8) no C27 C32 . 1.545(11) no C27 C28 . 1.547(11) no C28 C29 . 1.543(11) no C29 C30 . 1.522(13) no C30 C31 . 1.513(13) no C31 C32 . 1.516(12) no C33 C38 . 1.534(12) no C33 C34 . 1.543(11) no C34 C35 . 1.546(12) no C35 C36 . 1.522(13) no C36 C37 . 1.531(13) no C37 C38 . 1.514(13) no P4 C51 . 1.844(9) no P4 C39 . 1.858(8) no P4 C45 . 1.859(8) no C39 C40 . 1.524(11) no C39 C44 . 1.540(11) no C40 C41 . 1.539(11) no C41 C42 . 1.532(13) no C42 C43 . 1.500(14) no C43 C44 . 1.527(13) no C45 C50 . 1.542(11) no C45 C46 . 1.558(12) no C46 C47 . 1.521(13) no C47 C48 . 1.505(14) no C48 C49 . 1.515(16) no C49 C50 . 1.548(12) no C51 C52 . 1.519(12) no B O4 . 1.468(12) yes B O2 . 1.477(12) yes B O1 . 1.479(11) yes B O3 . 1.504(13) yes O1 C53 . 1.352(11) no O2 C54 . 1.367(12) no C53 C58 . 1.366(14) no C53 C54 . 1.382(16) no C54 C55 . 1.393(15) no C55 C56 . 1.39(2) no C56 C57 . 1.38(2) no C57 C58 . 1.396(19) no O3 C59 . 1.367(10) no O4 C60 . 1.341(10) no C59 C64 . 1.366(13) no C59 C60 . 1.388(12) no C60 C61 . 1.377(12) no C61 C62 . 1.395(14) no C62 C63 . 1.371(17) no C63 C64 . 1.411(15) no C65 Cl2 . 1.728(15) no C65 Cl3 . 1.742(15) no C66 Cl4 . 1.747(11) no C66 Cl5 . 1.772(12) no C67 Cl6 . 1.746(10) no C67 Cl7 . 1.771(10) no C68 Cl9 . 1.704(16) no C68 Cl8 . 1.739(15) no