#------------------------------------------------------------------------------ #$Date: 2011-01-02 20:00:31 +0000 (Sun, 02 Jan 2011) $ #$Revision: 5310 $ #$URL: svn://www.crystallography.net/cod/cif/2/2012058.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_2012058 loop_ _publ_author_name 'Jin, Qiong-Hua' 'Li, Xia' 'Zou, Ying-Quan' 'Yu, Kai-Bei' _publ_section_title ; catena-Poly[europium-tri-\m-4-methylbenzoato] ; _journal_name_full 'Acta Crystallographica, Section C' _journal_page_first 676 _journal_page_last 677 _journal_volume 57 _journal_year 2001 _chemical_formula_moiety '[Eu3 (C8 H7 O2)9]' _chemical_formula_sum 'C72 H63 Eu3 O18' _chemical_formula_weight 1672.10 _space_group_IT_number 14 _symmetry_cell_setting monoclinic _symmetry_space_group_name_Hall '-P 2yn' _symmetry_space_group_name_H-M 'P 1 21/n 1' _cell_angle_alpha 90.00 _cell_angle_beta 90.840(10) _cell_angle_gamma 90.00 _cell_formula_units_Z 4 _cell_length_a 12.9880(10) _cell_length_b 21.823(2) _cell_length_c 23.542(4) _cell_measurement_temperature 298(2) _cell_volume 6672.0(14) _diffrn_ambient_temperature 298(2) _exptl_crystal_density_diffrn 1.665 _[local]_cod_cif_authors_sg_H-M 'P 21/n' _cod_depositor_comments ; The following automatic conversions were performed: '_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic' according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29. Automatic conversion script Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius ; _cod_database_code 2012058 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x+1/2, y+1/2, -z+1/2' '-x, -y, -z' 'x-1/2, -y-1/2, z-1/2' 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 Eu1 -.714116(19) 1.312782(10) .258538(9) .02961(7) Uani d . 1 . . Eu Eu2 -.783652(17) 1.482469(11) .273650(9) .02842(6) Uani d . 1 . . Eu Eu3 -.710338(18) 1.648647(10) .266596(10) .03110(7) Uani d . 1 . . Eu O1 -.6764(2) 1.20403(14) .29244(12) .0379(8) Uani d . 1 . . O O2 -.5622(2) 1.27554(15) .31032(14) .0443(9) Uani d . 1 . . O O3 -.5661(3) 1.35361(15) .21068(14) .0455(9) Uani d . 1 . . O O4 -.6312(2) 1.42125(14) .26859(13) .0393(8) Uani d . 1 . . O O5 -.7565(3) 1.31085(16) .35960(13) .0504(10) Uani d . 1 . . O O6 -.8270(2) 1.38653(13) .31214(12) .0320(7) Uani d . 1 . . O O7 -.7997(3) 1.3779(2) .19376(15) .0726(13) Uani d . 1 . . O O8 -.8963(3) 1.4601(2) .19565(16) .0712(13) Uani d . 1 . . O O9 -.9557(2) 1.51057(15) .30221(14) .0479(9) Uani d . 1 . . O O10 -.8623(2) 1.59064(14) .28238(13) .0394(8) Uani d . 1 . . O O11 -.7445(3) 1.49540(15) .37353(13) .0439(9) Uani d . 1 . . O O12 -.6597(2) 1.56006(13) .32048(12) .0332(7) Uani d . 1 . . O O13 -.7076(3) 1.54703(15) .20668(13) .0456(9) Uani d . 1 . . O O14 -.6446(3) 1.63074(17) .17091(15) .0589(11) Uani d . 1 . . O O15 -.7129(3) 1.67799(16) .36381(14) .0573(11) Uani d . 1 . . O O16 -.8087(3) 1.74393(16) .31867(13) .0481(9) Uani d . 1 . . O O17 -.5308(2) 1.67504(15) .27231(14) .0479(9) Uani d . 1 . . O O18 -.6310(2) 1.75258(14) .24901(13) .0371(8) Uani d . 1 . . O C1 -.3919(4) 1.0626(3) .4813(2) .0663(18) Uani d . 1 . . C H1A -.3319 1.0829 .4964 .080 Uiso calc R 1 . . H H1B -.3722 1.0245 .4642 .080 Uiso calc R 1 . . H H1C -.4393 1.0549 .5113 .080 Uiso calc R 1 . . H C2 -.4429(4) 1.1030(3) .4369(2) .0441(13) Uani d . 1 . . C C3 -.5240(4) 1.0825(2) .4045(2) .0493(14) Uani d . 1 . . C H3 -.5478 1.0426 .4091 .059 Uiso calc R 1 . . H C4 -.5714(4) 1.1206(2) .3646(2) .0467(14) Uani d . 1 . . C H4 -.6260 1.1056 .3427 .056 Uiso calc R 1 . . H C5 -.5391(4) 1.1799(2) .35706(18) .0343(11) Uani d . 1 . . C C6 -.4570(4) 1.2011(2) .3899(2) .0456(13) Uani d . 1 . . C H6 -.4342 1.2413 .3859 .055 Uiso calc R 1 . . H C7 -.4089(4) 1.1621(3) .4288(2) .0514(15) Uani d . 1 . . C H7 -.3526 1.1763 .4498 .062 Uiso calc R 1 . . H C8 -.5941(4) 1.2222(2) .31802(18) .0327(11) Uani d . 1 . . C C9 -.2045(5) 1.5572(3) .1936(3) .092(2) Uani d . 1 . . C H9A -.1422 1.5342 .1994 .111 Uiso calc R 1 . . H H9B -.2045 1.5919 .2187 .111 Uiso calc R 1 . . H H9C -.2085 1.5712 .1550 .111 Uiso calc R 1 . . H C10 -.2960(4) 1.5169(3) .2059(2) .0597(16) Uani d . 1 . . C C11 -.3761(4) 1.5386(3) .2383(2) .0581(16) Uani d . 1 . . C H11 -.3728 1.5780 .2533 .070 Uiso calc R 1 . . H C12 -.4616(4) 1.5021(2) .2487(2) .0491(14) Uani d . 1 . . C H12 -.5136 1.5166 .2718 .059 Uiso calc R 1 . . H C13 -.4697(4) 1.4445(2) .22490(19) .0361(12) Uani d . 1 . . C C14 -.3895(4) 1.4233(3) .1930(2) .0583(16) Uani d . 1 . . C H14 -.3933 1.3843 .1770 .070 Uiso calc R 1 . . H C15 -.3042(5) 1.4585(3) .1843(3) .074(2) Uani d . 1 . . C H15 -.2504 1.4427 .1632 .089 Uiso calc R 1 . . H C16 -.5598(4) 1.4047(2) .2351(2) .0365(12) Uani d . 1 . . C C17 -1.0720(5) 1.4138(3) .5507(2) .0732(19) Uani d . 1 . . C H17A -1.0598 1.3847 .5806 .088 Uiso calc R 1 . . H H17B -1.1430 1.4120 .5389 .088 Uiso calc R 1 . . H H17C -1.0561 1.4543 .5641 .088 Uiso calc R 1 . . H C18 -1.0044(4) 1.3987(3) .5010(2) .0521(15) Uani d . 1 . . C C19 -1.0233(4) 1.4245(2) .4480(2) .0564(15) Uani d . 1 . . C H19 -1.0786 1.4512 .4432 .068 Uiso calc R 1 . . H C20 -.9619(4) 1.4117(2) .4025(2) .0499(14) Uani d . 1 . . C H20 -.9749 1.4306 .3677 .060 Uiso calc R 1 . . H C21 -.8815(4) 1.3711(2) .40787(19) .0387(12) Uani d . 1 . . C C22 -.8621(4) 1.3437(3) .4603(2) .0570(16) Uani d . 1 . . C H22 -.8087 1.3156 .4646 .068 Uiso calc R 1 . . H C23 -.9238(5) 1.3589(3) .5062(2) .0638(17) Uani d . 1 . . C H23 -.9096 1.3414 .5415 .077 Uiso calc R 1 . . H C24 -.8170(4) 1.3550(2) .35879(19) .0368(12) Uani d . 1 . . C C25 -1.1514(5) 1.3037(3) .0059(2) .076(2) Uani d . 1 . . C H25A -1.1493 1.3294 -.0272 .091 Uiso calc R 1 . . H H25B -1.2205 1.3024 .0198 .091 Uiso calc R 1 . . H H25C -1.1296 1.2631 -.0038 .091 Uiso calc R 1 . . H C26 -1.0795(4) 1.3298(3) .0520(2) .0475(14) Uani d . 1 . . C C27 -1.1025(4) 1.3851(3) .0772(2) .0510(14) Uani d . 1 . . C H27 -1.1626 1.4057 .0669 .061 Uiso calc R 1 . . H C28 -1.0373(4) 1.4101(2) .1176(2) .0425(13) Uani d . 1 . . C H28 -1.0532 1.4476 .1341 .051 Uiso calc R 1 . . H C29 -.9481(4) 1.3796(2) .13361(19) .0369(12) Uani d . 1 . . C C30 -.9264(4) 1.3252(2) .1087(2) .0540(15) Uani d . 1 . . C H30 -.8659 1.3049 .1187 .065 Uiso calc R 1 . . H C31 -.9918(5) 1.2993(3) .0687(2) .0621(17) Uani d . 1 . . C H31 -.9765 1.2613 .0531 .075 Uiso calc R 1 . . H C32 -.8768(4) 1.4090(3) .1767(2) .0509(15) Uani d . 1 . . C C33 -1.2904(5) 1.7206(3) .3634(3) .107(3) Uani d . 1 . . C H33A -1.3530 1.7079 .3447 .129 Uiso calc R 1 . . H H33B -1.2761 1.7625 .3541 .129 Uiso calc R 1 . . H H33C -1.2977 1.7167 .4038 .129 Uiso calc R 1 . . H C34 -1.2023(5) 1.6804(3) .3441(2) .0674(19) Uani d . 1 . . C C35 -1.2070(4) 1.6178(4) .3502(2) .074(2) Uani d . 1 . . C H35 -1.2656 1.5998 .3651 .089 Uiso calc R 1 . . H C36 -1.1255(4) 1.5813(3) .3344(2) .0563(15) Uani d . 1 . . C H36 -1.1302 1.5390 .3384 .068 Uiso calc R 1 . . H C37 -1.0363(4) 1.6070(2) .31259(19) .0392(12) Uani d . 1 . . C C38 -1.0326(4) 1.6696(2) .3062(2) .0476(14) Uani d . 1 . . C H38 -.9741 1.6879 .2914 .057 Uiso calc R 1 . . H C39 -1.1154(5) 1.7057(3) .3217(2) .0644(17) Uani d . 1 . . C H39 -1.1119 1.7479 .3167 .077 Uiso calc R 1 . . H C40 -.9479(4) 1.5677(2) .29833(18) .0367(12) Uani d . 1 . . C C41 -.4506(5) 1.6164(3) .5697(2) .086(2) Uani d . 1 . . C H41A -.4728 1.5936 .6022 .103 Uiso calc R 1 . . H H41B -.4626 1.6593 .5759 .103 Uiso calc R 1 . . H H41C -.3784 1.6096 .5641 .103 Uiso calc R 1 . . H C42 -.5105(5) 1.5956(2) .5174(2) .0557(16) Uani d . 1 . . C C43 -.5919(4) 1.5558(2) .5214(2) .0535(15) Uani d . 1 . . C H43 -.6110 1.5414 .5569 .064 Uiso calc R 1 . . H C44 -.6463(4) 1.5364(2) .4734(2) .0484(14) Uani d . 1 . . C H44 -.7013 1.5094 .4770 .058 Uiso calc R 1 . . H C45 -.6188(4) 1.5569(2) .42062(19) .0374(12) Uani d . 1 . . C C46 -.5368(4) 1.5970(2) .4160(2) .0494(14) Uani d . 1 . . C H46 -.5178 1.6114 .3805 .059 Uiso calc R 1 . . H C47 -.4829(4) 1.6157(2) .4644(2) .0598(16) Uani d . 1 . . C H47 -.4274 1.6422 .4609 .072 Uiso calc R 1 . . H C48 -.6783(4) 1.5362(2) .36986(19) .0340(11) Uani d . 1 . . C C49 -.6229(5) 1.4569(3) -.0533(2) .101(3) Uani d . 1 . . C H49A -.6815 1.4655 -.0773 .121 Uiso calc R 1 . . H H49B -.6168 1.4134 -.0480 .121 Uiso calc R 1 . . H H49C -.5618 1.4723 -.0708 .121 Uiso calc R 1 . . H C50 -.6365(4) 1.4877(4) .0039(2) .0610(16) Uani d . 1 . . C C51 -.6387(4) 1.5504(3) .0082(2) .0642(17) Uani d . 1 . . C H51 -.6326 1.5740 -.0244 .077 Uiso calc R 1 . . H C52 -.6499(4) 1.5794(3) .0609(2) .0554(15) Uani d . 1 . . C H52 -.6505 1.6220 .0631 .066 Uiso calc R 1 . . H C53 -.6600(4) 1.5445(2) .10960(19) .0396(12) Uani d . 1 . . C C54 -.6586(4) 1.4823(3) .1051(2) .0481(13) Uani d . 1 . . C H54 -.6656 1.4585 .1376 .058 Uiso calc R 1 . . H C55 -.6469(4) 1.4539(3) .0528(2) .0603(16) Uani d . 1 . . C H55 -.6461 1.4113 .0509 .072 Uiso calc R 1 . . H C56 -.6700(4) 1.5759(3) .1645(2) .0422(13) Uani d . 1 . . C C57 -.9602(6) 1.7813(3) .5804(3) .107(3) Uani d . 1 . . C H57A -.9300 1.8170 .5975 .129 Uiso calc R 1 . . H H57B -.9508 1.7468 .6053 .129 Uiso calc R 1 . . H H57C -1.0325 1.7881 .5739 .129 Uiso calc R 1 . . H C58 -.9086(5) 1.7683(3) .5240(2) .0660(18) Uani d . 1 . . C C59 -.9486(5) 1.7922(3) .4738(3) .0722(19) Uani d . 1 . . C H59 -1.0056 1.8179 .4749 .087 Uiso calc R 1 . . H C60 -.9051(4) 1.7783(2) .4222(2) .0549(15) Uani d . 1 . . C H60 -.9328 1.7947 .3888 .066 Uiso calc R 1 . . H C61 -.8206(4) 1.7403(2) .42008(19) .0401(12) Uani d . 1 . . C C62 -.7794(4) 1.7170(2) .4702(2) .0553(15) Uani d . 1 . . C H62 -.7220 1.6916 .4694 .066 Uiso calc R 1 . . H C63 -.8241(5) 1.7316(3) .5211(2) .0662(18) Uani d . 1 . . C H63 -.7955 1.7160 .5546 .079 Uiso calc R 1 . . H C64 -.7768(4) 1.7203(2) .3650(2) .0375(12) Uani d . 1 . . C C65 -.1870(4) 1.8615(3) .1711(3) .077(2) Uani d . 1 . . C H65A -.1885 1.8568 .1306 .092 Uiso calc R 1 . . H H65B -.1240 1.8448 .1863 .092 Uiso calc R 1 . . H H65C -.1911 1.9042 .1806 .092 Uiso calc R 1 . . H C66 -.2772(4) 1.8280(3) .1963(2) .0538(15) Uani d . 1 . . C C67 -.3661(4) 1.8580(3) .2092(2) .0550(15) Uani d . 1 . . C H67 -.3694 1.9004 .2052 .066 Uiso calc R 1 . . H C68 -.4519(4) 1.8262(2) .2282(2) .0459(13) Uani d . 1 . . C H68 -.5119 1.8475 .2362 .055 Uiso calc R 1 . . H C69 -.4491(4) 1.7637(2) .23522(19) .0384(12) Uani d . 1 . . C C70 -.3585(4) 1.7343(3) .2241(2) .0552(15) Uani d . 1 . . C H70 -.3539 1.6923 .2303 .066 Uiso calc R 1 . . H C71 -.2742(4) 1.7648(3) .2040(2) .0657(17) Uani d . 1 . . C H71 -.2147 1.7431 .1955 .079 Uiso calc R 1 . . H C72 -.5408(4) 1.7287(2) .25388(19) .0385(12) Uani d . 1 . . C 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 Eu1 .03373(15) .02382(13) .03117(13) -.00119(11) -.00341(10) -.00069(10) Eu2 .03153(14) .02376(12) .02997(12) .00012(12) .00014(9) -.00014(11) Eu3 .03273(15) .02390(13) .03664(14) .00119(12) .00003(10) .00387(10) O1 .036(2) .038(2) .0388(18) .0004(16) -.0131(15) -.0010(15) O2 .039(2) .036(2) .058(2) -.0063(17) -.0107(16) .0102(17) O3 .045(2) .038(2) .053(2) -.0055(18) .0103(17) -.0046(17) O4 .033(2) .0328(19) .052(2) .0026(16) .0050(16) -.0027(16) O5 .062(3) .049(2) .040(2) .018(2) -.0023(17) .0041(17) O6 .037(2) .0301(18) .0287(17) -.0013(15) .0044(14) .0001(14) O7 .041(2) .120(4) .057(3) -.007(2) -.0127(19) .046(2) O8 .080(3) .082(3) .051(3) -.015(3) -.020(2) -.013(2) O9 .037(2) .035(2) .072(2) .0013(17) .0143(17) .0003(18) O10 .031(2) .035(2) .052(2) .0002(16) .0083(16) .0050(16) O11 .047(2) .049(2) .0359(19) -.0184(18) .0000(16) -.0006(15) O12 .0363(19) .0285(18) .0348(18) .0053(15) -.0019(14) .0015(14) O13 .048(2) .055(2) .0335(19) -.0066(19) .0041(16) .0072(17) O14 .075(3) .044(2) .058(2) -.005(2) .025(2) -.0068(19) O15 .079(3) .047(2) .046(2) .020(2) .000(2) -.0036(17) O16 .045(2) .063(2) .037(2) .0019(19) .0060(16) .0159(17) O17 .031(2) .040(2) .072(2) .0018(17) .0005(17) .0160(18) O18 .0274(19) .0351(19) .049(2) .0022(15) -.0014(15) .0032(15) C1 .061(4) .085(5) .053(4) .019(4) -.007(3) .017(3) C2 .041(3) .055(4) .036(3) .017(3) -.005(2) .001(3) C3 .055(4) .039(3) .054(3) .007(3) -.006(3) .012(3) C4 .046(3) .048(3) .046(3) .006(3) -.012(3) -.001(3) C5 .034(3) .037(3) .032(3) .004(2) .004(2) .000(2) C6 .040(3) .045(3) .052(3) -.001(3) -.005(3) .002(3) C7 .035(3) .074(4) .044(3) .007(3) -.013(2) -.004(3) C8 .032(3) .037(3) .030(3) .009(2) .005(2) -.003(2) C9 .075(5) .135(7) .067(4) -.059(5) .013(4) -.006(4) C10 .046(4) .086(5) .047(3) -.029(4) .004(3) .003(3) C11 .049(4) .057(4) .069(4) -.021(3) .001(3) -.010(3) C12 .034(3) .048(4) .066(4) .003(2) .005(3) -.005(3) C13 .031(3) .039(3) .039(3) .002(2) -.001(2) .005(2) C14 .051(4) .065(4) .060(4) -.011(3) .021(3) -.010(3) C15 .054(4) .099(6) .069(4) -.014(4) .019(3) -.016(4) C16 .036(3) .036(3) .037(3) -.001(2) -.009(2) .005(2) C17 .082(5) .091(5) .047(4) -.020(4) .018(3) -.012(3) C18 .057(4) .056(4) .043(3) -.015(3) .010(3) -.007(3) C19 .058(4) .057(4) .055(4) .004(3) .013(3) .000(3) C20 .057(4) .052(4) .041(3) .003(3) .012(3) .008(3) C21 .046(3) .037(3) .033(3) -.005(3) .002(2) -.005(2) C22 .067(4) .065(4) .039(3) .010(3) -.003(3) .008(3) C23 .077(5) .085(5) .029(3) .003(4) .000(3) .007(3) C24 .038(3) .039(3) .033(3) -.009(3) -.003(2) -.001(2) C25 .091(5) .088(5) .050(4) -.042(4) -.013(3) .000(3) C26 .048(4) .059(4) .035(3) -.020(3) -.001(2) .008(3) C27 .035(3) .057(4) .060(4) .001(3) -.010(3) .005(3) C28 .038(3) .041(3) .048(3) .005(3) -.005(2) -.009(2) C29 .034(3) .045(3) .031(3) -.003(3) -.001(2) .006(2) C30 .059(4) .052(4) .051(3) .019(3) -.015(3) .003(3) C31 .089(5) .040(3) .058(4) .008(3) .003(3) -.007(3) C32 .037(3) .089(5) .027(3) -.015(3) -.005(2) .016(3) C33 .097(6) .152(8) .073(5) .069(6) -.001(4) -.027(5) C34 .053(4) .096(6) .053(4) .033(4) -.001(3) -.019(4) C35 .038(4) .123(6) .063(4) .004(4) .016(3) -.009(4) C36 .043(4) .061(4) .065(4) -.006(3) .009(3) -.004(3) C37 .033(3) .044(3) .040(3) .008(3) .000(2) -.001(2) C38 .041(3) .048(3) .053(3) .010(3) .000(3) -.001(3) C39 .062(4) .058(4) .072(4) .023(4) -.009(3) -.008(3) C40 .038(3) .041(3) .030(3) .002(3) -.004(2) .001(2) C41 .094(5) .091(5) .071(4) .016(4) -.039(4) -.032(4) C42 .065(4) .051(4) .050(4) .011(3) -.026(3) -.019(3) C43 .067(4) .059(4) .034(3) .011(3) -.005(3) -.008(3) C44 .053(4) .054(4) .038(3) .002(3) -.004(3) -.009(2) C45 .041(3) .032(3) .039(3) .005(2) -.007(2) .000(2) C46 .050(4) .045(3) .053(3) -.001(3) -.011(3) .004(3) C47 .057(4) .051(4) .071(4) -.010(3) -.023(3) -.009(3) C48 .035(3) .033(3) .034(3) .008(2) -.001(2) -.004(2) C49 .067(5) .185(8) .051(4) .018(5) -.004(3) -.042(5) C50 .040(3) .098(5) .045(4) .006(4) -.004(3) -.012(4) C51 .053(4) .099(5) .041(4) .002(4) .006(3) .012(4) C52 .058(4) .061(4) .048(3) .004(3) .014(3) .011(3) C53 .041(3) .044(3) .033(3) .002(3) .004(2) .004(2) C54 .048(3) .057(4) .039(3) .000(3) -.005(2) .001(3) C55 .061(4) .059(4) .061(4) .008(3) -.006(3) -.016(3) C56 .034(3) .058(4) .035(3) .002(3) .003(2) .005(3) C57 .165(8) .102(6) .057(4) .010(6) .041(5) -.003(4) C58 .098(5) .062(4) .038(3) -.013(4) .018(3) -.004(3) C59 .086(5) .064(4) .067(4) .022(4) .024(4) -.004(3) C60 .074(4) .045(3) .046(3) .007(3) .004(3) .009(3) C61 .051(3) .035(3) .034(3) -.003(3) .006(2) .003(2) C62 .072(4) .052(4) .042(3) .005(3) -.006(3) .000(3) C63 .091(5) .075(5) .033(3) -.004(4) -.003(3) .001(3) C64 .043(3) .031(3) .038(3) -.009(3) -.003(2) .003(2) C65 .050(4) .098(5) .083(5) -.028(4) .012(3) .003(4) C66 .047(4) .062(4) .052(3) -.016(3) -.003(3) .004(3) C67 .050(4) .043(3) .072(4) -.011(3) -.005(3) .008(3) C68 .029(3) .051(3) .057(3) .000(3) -.002(2) .004(3) C69 .029(3) .046(3) .040(3) .002(3) -.004(2) .003(2) C70 .046(4) .048(4) .071(4) .008(3) .007(3) .013(3) C71 .028(3) .086(5) .084(5) .009(3) .018(3) .007(4) C72 .043(3) .036(3) .036(3) .001(3) .000(2) -.001(2) 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 Eu1 O7 . 2.351(4) no Eu1 O16 2_345 2.380(3) no Eu1 O18 2_345 2.407(3) no Eu1 O3 . 2.413(3) no Eu1 O2 . 2.443(3) no Eu1 O5 . 2.450(3) no Eu1 O6 . 2.527(3) no Eu1 O1 . 2.549(3) no Eu1 O4 . 2.610(3) no Eu1 C8 . 2.870(4) no Eu1 C24 . 2.880(5) no Eu1 C16 . 2.895(5) no Eu2 O13 . 2.343(3) yes Eu2 O6 . 2.353(3) yes Eu2 O8 . 2.382(4) yes Eu2 O4 . 2.393(3) yes Eu2 O11 . 2.415(3) yes Eu2 O9 . 2.422(3) yes Eu2 O12 . 2.573(3) yes Eu2 O10 . 2.581(3) yes Eu2 C48 . 2.879(4) no Eu2 C40 . 2.895(5) no Eu2 O7 . 2.963(5) yes Eu2 C32 . 3.027(6) yes Eu3 O1 2_355 2.344(3) no Eu3 O15 . 2.377(3) no Eu3 O10 . 2.378(3) no Eu3 O12 . 2.399(3) no Eu3 O17 . 2.403(3) no Eu3 O14 . 2.452(3) no Eu3 O18 . 2.528(3) no Eu3 O13 . 2.629(3) no Eu3 O16 . 2.739(3) no Eu3 C72 . 2.830(5) no Eu3 C56 . 2.933(5) no Eu3 C64 . 2.936(5) no O1 C8 . 1.282(5) no O1 Eu3 2_345 2.344(3) no O2 C8 . 1.250(5) no O3 C16 . 1.257(5) no O4 C16 . 1.279(5) no O5 C24 . 1.243(5) no O6 C24 . 1.301(5) no O7 C32 . 1.270(6) no O8 C32 . 1.229(7) no O9 C40 . 1.254(5) no O10 C40 . 1.281(5) no O11 C48 . 1.242(5) no O12 C48 . 1.299(5) no O13 C56 . 1.279(5) no O14 C56 . 1.249(6) no O15 C64 . 1.243(5) no O16 C64 . 1.271(5) no O16 Eu1 2_355 2.380(3) no O17 C72 . 1.255(5) no O18 C72 . 1.285(5) no O18 Eu1 2_355 2.407(3) no C1 C2 . 1.512(6) no C2 C3 . 1.368(7) no C2 C7 . 1.377(7) no C3 C4 . 1.390(6) no C4 C5 . 1.374(6) no C5 C6 . 1.387(6) no C5 C8 . 1.478(6) no C6 C7 . 1.393(6) no C9 C10 . 1.510(7) no C10 C15 . 1.376(8) no C10 C11 . 1.382(7) no C11 C12 . 1.392(7) no C12 C13 . 1.378(6) no C13 C14 . 1.375(6) no C13 C16 . 1.479(6) no C14 C15 . 1.366(7) no C17 C18 . 1.509(7) no C18 C23 . 1.364(7) no C18 C19 . 1.387(7) no C19 C20 . 1.373(7) no C20 C21 . 1.374(7) no C21 C22 . 1.390(6) no C21 C24 . 1.479(6) no C22 C23 . 1.396(7) no C25 C26 . 1.530(6) no C26 C31 . 1.372(7) no C26 C27 . 1.380(7) no C27 C28 . 1.376(6) no C28 C29 . 1.384(6) no C29 C30 . 1.355(6) no C29 C32 . 1.508(7) no C30 C31 . 1.380(7) no C33 C34 . 1.516(8) no C34 C39 . 1.368(8) no C34 C35 . 1.376(8) no C35 C36 . 1.380(8) no C36 C37 . 1.392(7) no C37 C38 . 1.376(6) no C37 C40 . 1.476(6) no C38 C39 . 1.386(7) no C41 C42 . 1.516(7) no C42 C43 . 1.373(7) no C42 C47 . 1.376(7) no C43 C44 . 1.391(6) no C44 C45 . 1.372(6) no C45 C46 . 1.382(6) no C45 C48 . 1.485(6) no C46 C47 . 1.390(7) no C49 C50 . 1.517(7) no C50 C51 . 1.372(8) no C50 C55 . 1.377(8) no C51 C52 . 1.402(7) no C52 C53 . 1.385(6) no C53 C54 . 1.362(6) no C53 C56 . 1.471(6) no C54 C55 . 1.388(7) no C57 C58 . 1.522(7) no C58 C63 . 1.361(8) no C58 C59 . 1.386(8) no C59 C60 . 1.382(7) no C60 C61 . 1.377(7) no C61 C62 . 1.384(6) no C61 C64 . 1.488(6) no C62 C63 . 1.378(7) no C65 C66 . 1.509(7) no C66 C67 . 1.366(7) no C66 C71 . 1.392(7) no C67 C68 . 1.392(7) no C68 C69 . 1.374(6) no C69 C70 . 1.370(6) no C69 C72 . 1.486(6) no C70 C71 . 1.371(7) no