#------------------------------------------------------------------------------
#$Date: 2018-10-31 01:27:16 +0200 (Wed, 31 Oct 2018) $
#$Revision: 211710 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/55/01/1550156.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_1550156
loop_
_publ_author_name
'Lu, Xing'
'Shen, Wangqiang'
'Bao, Lipiao'
'Hu, Shuaifeng'
'Yang, Le'
'Jin, Peng'
'Xie, Yun-Peng'
'Akasaka, Takeshi'
_publ_section_title
;
 Crystallographic Characterization of Lu2C2n (2n = 76-90): Cluster
 Selection by Cage Size
;
_journal_name_full               'Chemical Science'
_journal_paper_doi               10.1039/C8SC03886D
_journal_year                    2019
_chemical_formula_moiety         'Lu2 C84, C36 H44 N4 Ni, C6 H6 '
_chemical_formula_sum            'C126 H50 Lu2 N4 Ni'
_chemical_formula_weight         2028.35
_chemical_name_common            'Lu2@C2v-C84 Ni(OEP)'
_chemical_name_systematic        'Lu2@C2v-C84 Ni(OEP)'
_space_group_crystal_system      monoclinic
_space_group_IT_number           12
_space_group_name_Hall           '-C 2y'
_space_group_name_H-M_alt        'C 1 2/m 1'
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_audit_update_record
;
2017-10-26 deposited with the CCDC.
2018-10-29 downloaded from the CCDC.
;
_cell_angle_alpha                90.000(5)
_cell_angle_beta                 94.510(5)
_cell_angle_gamma                90.000(5)
_cell_formula_units_Z            4
_cell_length_a                   25.410(5)
_cell_length_b                   15.110(5)
_cell_length_c                   19.917(5)
_cell_measurement_reflns_used    9835
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      23.133
_cell_measurement_theta_min      2.325
_cell_volume                     7623(4)
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.974
_diffrn_measured_fraction_theta_max 0.974
_diffrn_measurement_device_type  'CCD MX300-HE'
_diffrn_measurement_method       'phi scans'
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.6525
_diffrn_reflns_av_R_equivalents  0.0504
_diffrn_reflns_av_unetI/netI     0.0303
_diffrn_reflns_Laue_measured_fraction_full 0.974
_diffrn_reflns_Laue_measured_fraction_max 0.974
_diffrn_reflns_limit_h_max       29
_diffrn_reflns_limit_h_min       -29
_diffrn_reflns_limit_k_max       18
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       23
_diffrn_reflns_limit_l_min       -23
_diffrn_reflns_number            51276
_diffrn_reflns_point_group_measured_fraction_full 0.974
_diffrn_reflns_point_group_measured_fraction_max 0.974
_diffrn_reflns_theta_full        23.048
_diffrn_reflns_theta_max         23.133
_diffrn_reflns_theta_min         1.687
_diffrn_source                   'SSRF, Beamline BL17B'
_exptl_absorpt_coefficient_mu    2.339
_exptl_absorpt_correction_T_max  0.7449
_exptl_absorpt_correction_T_min  0.5218
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            Black
_exptl_crystal_density_diffrn    1.767
_exptl_crystal_description       Block
_exptl_crystal_F_000             4016
_exptl_crystal_size_max          0.120
_exptl_crystal_size_mid          0.080
_exptl_crystal_size_min          0.070
_refine_diff_density_max         1.015
_refine_diff_density_min         -1.434
_refine_diff_density_rms         0.118
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.068
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     866
_refine_ls_number_reflns         7072
_refine_ls_number_restraints     864
_refine_ls_restrained_S_all      1.131
_refine_ls_R_factor_all          0.0890
_refine_ls_R_factor_gt           0.0818
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1486P)²+43.3856P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2353
_refine_ls_wR_factor_ref         0.2438
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6280
_reflns_number_total             7072
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c8sc03886d2.cif
_cod_data_source_block           Lu2@C2v-C84
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-scan' changed to
'multi-scan' according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 
;
_cod_database_code               1550156
_shelx_shelxl_version_number     2014/7
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.799
_shelx_estimated_absorpt_t_max   0.849
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z'
'-x, -y, -z'
'x, -y, z'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z'
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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Lu1 Lu 0.26604(14) 0.0431(2) 0.1465(2) 0.0640(9) Uani 0.1517 1 d . . P A 1
Lu2 Lu 0.18947(7) 0.04085(13) 0.27450(8) 0.0597(5) Uani 0.1508 1 d . . P A 1
Lu3 Lu 0.15949(12) 0.0884(2) 0.22996(15) 0.0515(6) Uani 0.1353 1 d . . P A 1
Lu4 Lu 0.14742(12) 0.1165(2) 0.1962(3) 0.0708(10) Uani 0.1117 1 d . . P A 1
Lu5 Lu 0.17179(18) 0.1103(2) 0.1448(2) 0.0453(9) Uani 0.0787 1 d . . P A 1
Lu6 Lu 0.1996(3) 0.1114(4) 0.1333(3) 0.0787(15) Uani 0.0775 1 d . U P A 1
Lu7 Lu 0.1906(2) 0.0000 0.0852(2) 0.0539(13) Uani 0.0664 2 d S TU P A 1
Lu8 Lu 0.1311(2) 0.0557(5) 0.1928(3) 0.0770(15) Uani 0.0631 1 d . U P A 1
Lu9 Lu 0.2526(3) 0.0446(7) 0.1259(3) 0.046(2) Uani 0.0564 1 d . U P A 1
Lu10 Lu 0.2376(9) 0.0000 0.1051(10) 0.081(3) Uani 0.0363 2 d S TU P A 1
Lu11 Lu 0.2004(9) 0.1337(9) 0.1869(9) 0.123(4) Uani 0.0325 1 d . U P A 1
Lu12 Lu 0.1712(10) 0.1162(13) 0.2438(12) 0.110(6) Uani 0.0312 1 d . U P A 1
Lu13 Lu 0.2102(8) -0.0588(13) 0.1038(7) 0.090(3) Uani 0.0292 1 d . U P A 1
Lu14 Lu 0.2530(10) 0.0848(17) 0.1678(10) 0.098(4) Uani 0.0228 1 d . U P A 1
Lu15 Lu 0.2751(14) 0.0000 0.2078(16) 0.090(6) Uani 0.0156 2 d S TU P A 1
C1 C 0.10201(13) 0.0151(3) 0.33016(16) 0.121(5) Uani 0.5 1 d G U P A -1
C2 C 0.13883(15) -0.0477(3) 0.36138(13) 0.098(5) Uani 0.5 1 d G U P A -1
C3 C 0.14350(16) -0.1480(2) 0.33619(16) 0.102(5) Uani 0.5 1 d G U P A -1
C4 C 0.10837(15) -0.1770(2) 0.28724(19) 0.123(6) Uani 0.5 1 d G U P A -1
C5 C 0.07549(12) -0.1072(3) 0.2693(2) 0.139(6) Uani 0.5 1 d G U P A -1
C6 C 0.05041(10) -0.1049(3) 0.2093(2) 0.135(6) Uani 0.5 1 d G U P A -1
C7 C 0.03672(7) -0.0229(3) 0.1877(2) 0.118(6) Uani 0.5 1 d G U P A -1
C8 C 0.05276(8) 0.0358(3) 0.2364(2) 0.144(6) Uani 0.5 1 d G U P A -1
C9 C 0.07006(11) -0.0236(3) 0.2861(2) 0.161(6) Uani 0.5 1 d G U P A -1
C10 C 0.11926(13) 0.0968(3) 0.33832(15) 0.111(5) Uani 0.5 1 d G U P A -1
C11 C 0.16620(15) 0.0889(3) 0.37469(11) 0.064(3) Uani 0.5 1 d G U P A -1
C12 C 0.17841(16) 0.0040(3) 0.38806(10) 0.087(3) Uani 0.5 1 d G U P A -1
C13 C 0.23030(17) -0.0299(3) 0.39458(10) 0.089(4) Uani 0.5 1 d G U P A -1
C14 C 0.24097(17) -0.1144(3) 0.37847(12) 0.086(4) Uani 0.5 1 d G U P A -1
C15 C 0.19454(17) -0.1594(2) 0.35151(14) 0.111(5) Uani 0.5 1 d G U P A -1
C16 C 0.21096(17) -0.2255(2) 0.30598(17) 0.112(6) Uani 0.5 1 d G U P A -1
C17 C 0.17280(17) -0.26681(19) 0.23616(19) 0.097(5) Uani 0.5 1 d G U P A -1
C18 C 0.11383(15) -0.2304(2) 0.2357(2) 0.107(5) Uani 0.5 1 d G U P A -1
C19 C 0.09574(14) -0.2197(2) 0.1745(2) 0.116(5) Uani 0.5 1 d G U P A -1
C20 C 0.05740(11) -0.1671(3) 0.1686(2) 0.117(6) Uani 0.5 1 d G U P A -1
C21 C 0.05785(12) -0.1353(3) 0.0990(2) 0.113(5) Uani 0.5 1 d G U P A -1
C22 C 0.04645(11) -0.0421(3) 0.0787(2) 0.115(5) Uani 0.5 1 d G U P A -1
C23 C 0.03523(9) 0.0224(3) 0.1275(2) 0.105(5) Uani 0.5 1 d G U P A -1
C24 C 0.04755(11) 0.0934(3) 0.1174(2) 0.096(5) Uani 0.5 1 d G U P A -1
C25 C 0.06667(11) 0.1589(3) 0.1743(2) 0.103(5) Uani 0.5 1 d G U P A -1
C26 C 0.06423(10) 0.1222(3) 0.2356(2) 0.114(5) Uani 0.5 1 d G U P A -1
C27 C 0.10150(12) 0.1480(2) 0.28621(18) 0.122(6) Uani 0.5 1 d G U P A -1
C28 C 0.13075(14) 0.2100(2) 0.28689(17) 0.083(4) Uani 0.5 1 d G U P A -1
C29 C 0.18158(15) 0.2190(2) 0.31309(15) 0.073(3) Uani 0.5 1 d G U P A -1
C30 C 0.20680(15) 0.1620(2) 0.36342(12) 0.077(4) Uani 0.5 1 d G U P A -1
C31 C 0.25331(15) 0.1321(3) 0.36824(13) 0.066(3) Uani 0.5 1 d G U P A -1
C32 C 0.26997(15) 0.0388(3) 0.39014(12) 0.088(4) Uani 0.5 1 d G U P A -1
C33 C 0.32070(13) 0.0239(3) 0.35642(17) 0.105(5) Uani 0.5 1 d G U P A -1
C34 C 0.32610(13) -0.0769(3) 0.33871(18) 0.107(5) Uani 0.5 1 d G U P A -1
C35 C 0.28676(16) -0.1408(3) 0.34742(16) 0.101(5) Uani 0.5 1 d G U P A -1
C36 C 0.26575(16) -0.2086(2) 0.30109(17) 0.138(6) Uani 0.5 1 d G U P A -1
C37 C 0.29410(15) -0.2185(2) 0.2532(2) 0.138(6) Uani 0.5 1 d G U P A -1
C38 C 0.25861(15) -0.2521(2) 0.19411(19) 0.082(4) Uani 0.5 1 d G U P A -1
C39 C 0.20327(16) -0.27091(19) 0.17505(19) 0.069(4) Uani 0.5 1 d G U P A -1
C40 C 0.17812(15) -0.2453(2) 0.10630(18) 0.073(4) Uani 0.5 1 d G U P A -1
C41 C 0.12313(15) -0.2242(2) 0.10413(19) 0.085(4) Uani 0.5 1 d G U P A -1
C42 C 0.09519(14) -0.1735(3) 0.06600(19) 0.099(5) Uani 0.5 1 d G U P A -1
C43 C 0.11196(16) -0.1292(3) 0.01856(16) 0.105(5) Uani 0.5 1 d G U P A -1
C44 C 0.10705(17) -0.0351(3) 0.00125(14) 0.113(6) Uani 0.5 1 d G U P A -1
C45 C 0.07224(15) 0.0119(3) 0.02896(17) 0.116(5) Uani 0.5 1 d G U P A -1
C46 C 0.07238(15) 0.0887(3) 0.05128(18) 0.103(5) Uani 0.5 1 d G U P A -1
C47 C 0.11680(18) 0.1479(3) 0.03973(15) 0.109(5) Uani 0.5 1 d G U P A -1
C48 C 0.13028(18) 0.2290(2) 0.09037(17) 0.114(6) Uani 0.5 1 d G U P A -1
C49 C 0.10605(15) 0.2310(2) 0.15451(19) 0.116(5) Uani 0.5 1 d G U P A -1
C50 C 0.13351(15) 0.2536(2) 0.21320(19) 0.098(5) Uani 0.5 1 d G U P A -1
C51 C 0.18914(16) 0.27408(19) 0.20654(18) 0.093(5) Uani 0.5 1 d G U P A -1
C52 C 0.21562(15) 0.2505(2) 0.27580(16) 0.063(3) Uani 0.5 1 d G U P A -1
C53 C 0.26397(14) 0.2340(2) 0.27054(17) 0.046(2) Uani 0.5 1 d G U P A -1
C54 C 0.29310(13) 0.1713(3) 0.31910(17) 0.090(4) Uani 0.5 1 d G U P A -1
C55 C 0.33339(11) 0.1019(3) 0.31083(19) 0.112(5) Uani 0.5 1 d G U P A -1
C56 C 0.34779(9) 0.1070(3) 0.2498(2) 0.110(5) Uani 0.5 1 d G U P A -1
C57 C 0.36489(8) 0.0151(3) 0.2434(2) 0.097(4) Uani 0.5 1 d G U P A -1
C58 C 0.35349(10) -0.0742(3) 0.2765(2) 0.087(4) Uani 0.5 1 d G U P A -1
C59 C 0.33721(12) -0.1569(3) 0.2391(2) 0.092(5) Uani 0.5 1 d G U P A -1
C60 C 0.33264(11) -0.1531(3) 0.1623(2) 0.112(5) Uani 0.5 1 d G U P A -1
C61 C 0.29035(14) -0.2168(3) 0.1375(2) 0.111(5) Uani 0.5 1 d G U P A -1
C62 C 0.26693(15) -0.1800(3) 0.07267(17) 0.122(5) Uani 0.5 1 d G U P A -1
C63 C 0.20729(16) -0.2075(2) 0.05946(16) 0.108(5) Uani 0.5 1 d G U P A -1
C64 C 0.18054(17) -0.1531(3) 0.01627(13) 0.094(4) Uani 0.5 1 d G U P A -1
C65 C 0.18895(18) -0.0670(3) -0.01598(10) 0.122(5) Uani 0.5 1 d G U P A -1
C66 C 0.15258(19) 0.0169(3) -0.01645(10) 0.117(5) Uani 0.5 1 d G U P A -1
C67 C 0.15820(19) 0.1178(3) 0.00354(11) 0.098(5) Uani 0.5 1 d G U P A -1
C68 C 0.21796(19) 0.1137(3) 0.00804(11) 0.123(5) Uani 0.5 1 d G U P A -1
C69 C 0.23117(19) 0.1847(3) 0.05104(14) 0.147(6) Uani 0.5 1 d G U P A -1
C70 C 0.19207(19) 0.2385(2) 0.08118(16) 0.118(6) Uani 0.5 1 d G U P A -1
C71 C 0.21621(17) 0.2654(2) 0.14736(17) 0.108(6) Uani 0.5 1 d G U P A -1
C72 C 0.26971(16) 0.2351(2) 0.15267(18) 0.108(5) Uani 0.5 1 d G U P A -1
C73 C 0.29680(13) 0.2150(2) 0.21186(19) 0.104(5) Uani 0.5 1 d G U P A -1
C74 C 0.33592(11) 0.1546(3) 0.1989(2) 0.102(5) Uani 0.5 1 d G U P A -1
C75 C 0.34711(11) 0.0965(3) 0.1466(2) 0.132(6) Uani 0.5 1 d G U P A -1
C76 C 0.36284(9) 0.0067(3) 0.1664(2) 0.108(4) Uani 0.5 1 d G U P A -1
C77 C 0.34868(10) -0.0719(3) 0.1267(2) 0.121(5) Uani 0.5 1 d G U P A -1
C78 C 0.31740(14) -0.0597(3) 0.06648(19) 0.154(6) Uani 0.5 1 d G U P A -1
C79 C 0.27099(16) -0.1080(3) 0.03036(15) 0.140(6) Uani 0.5 1 d G U P A -1
C80 C 0.23733(18) -0.0371(3) -0.00412(11) 0.141(6) Uani 0.5 1 d G U P A -1
C81 C 0.26188(18) 0.0509(3) 0.00969(13) 0.148(6) Uani 0.5 1 d G U P A -1
C82 C 0.31401(16) 0.0324(3) 0.04569(18) 0.154(6) Uani 0.5 1 d G U P A -1
C83 C 0.31549(15) 0.1135(3) 0.08538(19) 0.157(6) Uani 0.5 1 d G U P A -1
C84 C 0.28094(17) 0.1896(3) 0.09234(18) 0.128(6) Uani 0.5 1 d G U P A -1
Ni1A Ni 0.01908(2) 0.0000 0.41868(3) 0.0184(2) Uani 1 2 d S T P B 2
C1A C -0.08989(19) 0.1465(3) 0.1572(2) 0.0392(10) Uani 1 1 d . . . B 2
H1AA H -0.0749 0.0996 0.1323 0.059 Uiso 1 1 calc R U . B 2
H1AB H -0.0621 0.1801 0.1805 0.059 Uiso 1 1 calc R U . B 2
H1AC H -0.1105 0.1844 0.1268 0.059 Uiso 1 1 calc R U . B 2
N2A N 0.02031(12) 0.1299(2) 0.41714(15) 0.0213(7) Uani 1 1 d . . . B 2
C2A C -0.12520(17) 0.1070(3) 0.2084(2) 0.0342(10) Uani 1 1 d . . . B 2
H2AA H -0.1400 0.1546 0.2336 0.041 Uiso 1 1 calc R U . B 2
H2AB H -0.1543 0.0756 0.1845 0.041 Uiso 1 1 calc R U . B 2
N3A N 0.07632(17) 0.0000 0.4904(2) 0.0204(9) Uani 1 2 d S T P B 2
C4A C -0.05916(15) 0.0722(3) 0.31161(18) 0.0228(8) Uani 1 1 d . . . B 2
C5A C -0.04809(15) 0.1587(3) 0.32676(19) 0.0260(8) Uani 1 1 d . . . B 2
H5A H -0.0674 0.2019 0.3024 0.031 Uiso 1 1 calc R U . B 2
C6A C -0.01037(15) 0.1861(3) 0.37550(19) 0.0248(8) Uani 1 1 d . . . B 2
C7A C 0.00331(16) 0.2774(3) 0.3885(2) 0.0300(9) Uani 1 1 d . . . B 2
C8A C -0.02097(19) 0.3539(3) 0.3499(3) 0.0410(11) Uani 1 1 d . . . B 2
H8AA H -0.0147 0.4076 0.3760 0.049 Uiso 1 1 calc R U . B 2
H8AB H -0.0588 0.3450 0.3434 0.049 Uiso 1 1 calc R U . B 2
C9A C 0.0012(2) 0.3655(4) 0.2809(3) 0.0553(15) Uani 1 1 d . . . B 2
H9AA H -0.0068 0.3139 0.2539 0.083 Uiso 1 1 calc R U . B 2
H9AB H 0.0387 0.3733 0.2870 0.083 Uiso 1 1 calc R U . B 2
H9AC H -0.0146 0.4166 0.2588 0.083 Uiso 1 1 calc R U . B 2
C10A C 0.04264(16) 0.2770(3) 0.4394(2) 0.0290(9) Uani 1 1 d . . . B 2
C11A C 0.07271(17) 0.3539(3) 0.4714(3) 0.0378(10) Uani 1 1 d . . . B 2
H11A H 0.0774 0.3444 0.5197 0.045 Uiso 1 1 calc R U . B 2
H11B H 0.0521 0.4074 0.4635 0.045 Uiso 1 1 calc R U . B 2
C12A C 0.1264(2) 0.3670(3) 0.4447(3) 0.0485(13) Uani 1 1 d . . . B 2
H12A H 0.1220 0.3808 0.3975 0.073 Uiso 1 1 calc R U . B 2
H12B H 0.1467 0.3137 0.4511 0.073 Uiso 1 1 calc R U . B 2
H12C H 0.1444 0.4147 0.4685 0.073 Uiso 1 1 calc R U . B 2
C13A C 0.05268(15) 0.1859(3) 0.45652(19) 0.0242(8) Uani 1 1 d . . . B 2
C14A C 0.09060(15) 0.1585(3) 0.50503(19) 0.0243(8) Uani 1 1 d . . . B 2
H14A H 0.1097 0.2017 0.5296 0.029 Uiso 1 1 calc R U . B 2
C15A C 0.10222(15) 0.0719(3) 0.51960(18) 0.0226(8) Uani 1 1 d . . . B 2
C16A C 0.14460(15) 0.0447(3) 0.56768(18) 0.0238(8) Uani 1 1 d . . . B 2
C17A C 0.18263(16) 0.1070(3) 0.6048(2) 0.0296(9) Uani 1 1 d . . . B 2
H17A H 0.1982 0.0780 0.6450 0.036 Uiso 1 1 calc R U . B 2
H17B H 0.1636 0.1586 0.6188 0.036 Uiso 1 1 calc R U . B 2
C18A C 0.22638(18) 0.1364(4) 0.5617(2) 0.0424(11) Uani 1 1 d . . . B 2
H18A H 0.2455 0.0855 0.5482 0.064 Uiso 1 1 calc R U . B 2
H18B H 0.2500 0.1755 0.5873 0.064 Uiso 1 1 calc R U . B 2
H18C H 0.2112 0.1667 0.5225 0.064 Uiso 1 1 calc R U . B 2
C3A C -0.09602(15) 0.0445(3) 0.25680(19) 0.0270(8) Uani 1 1 d . . . B 2
N1A N -0.03593(18) 0.0000 0.3446(2) 0.0232(9) Uani 1 2 d S T P B 2
C1B C 0.1259(4) 0.5000 0.1959(6) 0.082(3) Uani 1 2 d S T P C 3
H1B H 0.0901 0.5000 0.1820 0.099 Uiso 1 2 calc R U P C 3
C2B C 0.1412(3) 0.5000 0.2629(4) 0.0517(18) Uani 1 2 d S T P C 3
H2B H 0.1161 0.5000 0.2944 0.062 Uiso 1 2 calc R U P C 3
C3B C 0.1934(3) 0.5000 0.2835(3) 0.0440(16) Uani 1 2 d S T P C 3
H3B H 0.2041 0.5000 0.3292 0.053 Uiso 1 2 calc R U P C 3
C4B C 0.2309(3) 0.5000 0.2362(3) 0.0437(16) Uani 1 2 d S T P C 3
H4B H 0.2665 0.5000 0.2508 0.052 Uiso 1 2 calc R U P C 3
C5B C 0.2163(4) 0.5000 0.1690(3) 0.0496(18) Uani 1 2 d S T P C 3
H5B H 0.2418 0.5000 0.1378 0.060 Uiso 1 2 calc R U P C 3
C6B C 0.1628(4) 0.5000 0.1474(5) 0.076(3) Uani 1 2 d S T P C 3
H6B H 0.1518 0.5000 0.1017 0.091 Uiso 1 2 calc R U P C 3
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0027 0.0014 '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 0.0053 0.0028 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ni Ni 0.3436 0.9622 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Lu Lu -0.2922 5.1425 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
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
Lu9 Lu1 Lu14 96(2) . .
Lu9 Lu1 Lu10 34.4(15) . .
Lu14 Lu1 Lu10 119.8(19) . .
Lu9 Lu1 Lu1 92.6(15) . 6
Lu14 Lu1 Lu1 138.4(12) . 6
Lu10 Lu1 Lu1 58.3(7) . 6
Lu9 Lu1 Lu15 141(2) . .
Lu14 Lu1 Lu15 87.2(19) . .
Lu10 Lu1 Lu15 112.8(11) . .
Lu1 Lu1 Lu15 62.0(7) 6 .
Lu9 Lu1 Lu9 71.5(16) . 6
Lu14 Lu1 Lu9 138.4(15) . 6
Lu10 Lu1 Lu9 37.1(7) . 6
Lu1 Lu1 Lu9 21.2(2) 6 6
Lu15 Lu1 Lu9 80.6(7) . 6
Lu9 Lu1 Lu13 21.5(14) . 6
Lu14 Lu1 Lu13 77.9(19) . 6
Lu10 Lu1 Lu13 44.2(9) . 6
Lu1 Lu1 Lu13 98.5(7) 6 6
Lu15 Lu1 Lu13 127.7(16) . 6
Lu9 Lu1 Lu13 78.7(8) 6 6
Lu9 Lu1 Lu6 50.4(13) . .
Lu14 Lu1 Lu6 46.5(18) . .
Lu10 Lu1 Lu6 74.8(8) . .
Lu1 Lu1 Lu6 121.5(2) 6 .
Lu15 Lu1 Lu6 116.3(14) . .
Lu9 Lu1 Lu6 105.4(5) 6 .
Lu13 Lu1 Lu6 31.5(7) 6 .
Lu9 Lu1 Lu14 95.9(16) . 6
Lu14 Lu1 Lu14 122.3(17) . 6
Lu10 Lu1 Lu14 62.5(10) . 6
Lu1 Lu1 Lu14 16.1(5) 6 6
Lu15 Lu1 Lu14 51.8(10) . 6
Lu9 Lu1 Lu14 29.0(7) 6 6
Lu13 Lu1 Lu14 95.8(11) 6 6
Lu6 Lu1 Lu14 112.1(8) . 6
Lu9 Lu1 C83 84.6(14) . .
Lu14 Lu1 C83 100.9(12) . .
Lu10 Lu1 C83 103.0(6) . .
Lu1 Lu1 C83 120.38(16) 6 .
Lu15 Lu1 C83 132.9(15) . .
Lu9 Lu1 C83 116.5(5) 6 .
Lu13 Lu1 C83 99.2(5) 6 .
Lu6 Lu1 C83 101.6(3) . .
Lu14 Lu1 C83 136.4(5) 6 .
Lu9 Lu1 C75 123.1(14) . .
Lu14 Lu1 C75 97.5(15) . .
Lu10 Lu1 C75 133.4(7) . .
Lu1 Lu1 C75 111.41(16) 6 .
Lu15 Lu1 C75 94.6(15) . .
Lu9 Lu1 C75 122.9(5) 6 .
Lu13 Lu1 C75 136.6(6) 6 .
Lu6 Lu1 C75 126.4(3) . .
Lu14 Lu1 C75 121.3(8) 6 .
C83 Lu1 C75 38.59(7) . .
Lu9 Lu1 Lu13 50.2(15) . .
Lu14 Lu1 Lu13 116.6(16) . .
Lu10 Lu1 Lu13 19.4(7) . .
Lu1 Lu1 Lu13 46.0(5) 6 .
Lu15 Lu1 Lu13 94.0(11) . .
Lu9 Lu1 Lu13 27.1(6) 6 .
Lu13 Lu1 Lu13 52.5(12) 6 .
Lu6 Lu1 Lu13 78.3(5) . .
Lu14 Lu1 Lu13 45.8(9) 6 .
C83 Lu1 Lu13 121.5(5) . .
C75 Lu1 Lu13 145.2(5) . .
Lu2 Lu2 Lu3 122.63(14) 6 .
Lu2 Lu2 Lu12 147.1(10) 6 .
Lu3 Lu2 Lu12 24.6(9) . .
Lu2 Lu2 Lu8 96.0(2) 6 .
Lu3 Lu2 Lu8 26.6(2) . .
Lu12 Lu2 Lu8 51.2(9) . .
Lu2 Lu2 Lu4 122.12(12) 6 .
Lu3 Lu2 Lu4 5.70(16) . .
Lu12 Lu2 Lu4 25.0(9) . .
Lu8 Lu2 Lu4 27.3(2) . .
Lu2 Lu2 C11 108.86(12) 6 .
Lu3 Lu2 C11 103.90(17) . .
Lu12 Lu2 C11 91.4(10) . .
Lu8 Lu2 C11 115.45(18) . .
Lu4 Lu2 C11 108.79(18) . .
Lu2 Lu2 Lu3 29.90(10) 6 6
Lu3 Lu2 Lu3 92.7(2) . 6
Lu12 Lu2 Lu3 117.2(10) . 6
Lu8 Lu2 Lu3 66.2(2) . 6
Lu4 Lu2 Lu3 92.40(15) . 6
C11 Lu2 Lu3 121.71(14) . 6
Lu2 Lu2 Lu11 128.1(4) 6 .
Lu3 Lu2 Lu11 41.8(6) . .
Lu12 Lu2 Lu11 36.3(11) . .
Lu8 Lu2 Lu11 57.8(6) . .
Lu4 Lu2 Lu11 36.7(6) . .
C11 Lu2 Lu11 122.6(4) . .
Lu3 Lu2 Lu11 106.9(4) 6 .
Lu2 Lu2 C12 76.40(11) 6 .
Lu3 Lu2 C12 131.14(17) . .
Lu12 Lu2 C12 124.5(10) . .
Lu8 Lu2 C12 128.9(2) . .
Lu4 Lu2 C12 136.78(17) . .
C11 Lu2 C12 33.7 . .
Lu3 Lu2 C12 96.35(14) 6 .
Lu11 Lu2 C12 155.4(4) . .
Lu2 Lu2 C10 110.43(11) 6 .
Lu3 Lu2 C10 75.82(16) . .
Lu12 Lu2 C10 72.8(10) . .
Lu8 Lu2 C10 82.35(17) . .
Lu4 Lu2 C10 81.40(16) . .
C11 Lu2 C10 33.4 . .
Lu3 Lu2 C10 105.61(14) 6 .
Lu11 Lu2 C10 109.1(5) . .
C12 Lu2 C10 55.47(5) . .
Lu2 Lu2 Lu12 17.3(6) 6 6
Lu3 Lu2 Lu12 105.4(6) . 6
Lu12 Lu2 Lu12 129.8(15) . 6
Lu8 Lu2 Lu12 78.9(6) . 6
Lu4 Lu2 Lu12 104.9(6) . 6
C11 Lu2 Lu12 118.1(6) . 6
Lu3 Lu2 Lu12 12.7(6) 6 6
Lu11 Lu2 Lu12 115.6(7) . 6
C12 Lu2 Lu12 88.7(6) . 6
C10 Lu2 Lu12 109.4(6) . 6
Lu2 Lu2 C30 135.61(10) 6 .
Lu3 Lu2 C30 97.65(17) . .
Lu12 Lu2 C30 75.3(10) . .
Lu8 Lu2 C30 121.7(2) . .
Lu4 Lu2 C30 99.82(17) . .
C11 Lu2 C30 36.6 . .
Lu3 Lu2 C30 157.87(13) 6 .
Lu11 Lu2 C30 93.7(4) . .
C12 Lu2 C30 62.23(6) . .
C10 Lu2 C30 58.76(6) . .
Lu12 Lu2 C30 150.6(6) 6 .
Lu12 Lu3 Lu4 99(3) . .
Lu12 Lu3 Lu8 159(3) . .
Lu4 Lu3 Lu8 60.6(4) . .
Lu12 Lu3 Lu2 80(3) . .
Lu4 Lu3 Lu2 165.1(4) . .
Lu8 Lu3 Lu2 120.7(4) . .
Lu12 Lu3 Lu11 66(2) . .
Lu4 Lu3 Lu11 63.3(8) . .
Lu8 Lu3 Lu11 104.8(8) . .
Lu2 Lu3 Lu11 103.4(8) . .
Lu12 Lu3 Lu5 101(2) . .
Lu4 Lu3 Lu5 38.5(3) . .
Lu8 Lu3 Lu5 66.4(4) . .
Lu2 Lu3 Lu5 126.9(2) . .
Lu11 Lu3 Lu5 38.6(7) . .
Lu12 Lu3 C27 78(3) . .
Lu4 Lu3 C27 89.0(4) . .
Lu8 Lu3 C27 95.8(3) . .
Lu2 Lu3 C27 105.18(19) . .
Lu11 Lu3 C27 128.8(6) . .
Lu5 Lu3 C27 127.3(3) . .
Lu12 Lu3 Lu2 107(3) . 6
Lu4 Lu3 Lu2 148.3(4) . 6
Lu8 Lu3 Lu2 93.3(4) . 6
Lu2 Lu3 Lu2 27.48(12) . 6
Lu11 Lu3 Lu2 112.2(7) . 6
Lu5 Lu3 Lu2 117.20(17) . 6
C27 Lu3 Lu2 112.80(17) . 6
Lu12 Lu3 Lu6 93(2) . .
Lu4 Lu3 Lu6 53.2(4) . .
Lu8 Lu3 Lu6 79.3(4) . .
Lu2 Lu3 Lu6 112.0(2) . .
Lu11 Lu3 Lu6 26.3(6) . .
Lu5 Lu3 Lu6 16.5(2) . .
C27 Lu3 Lu6 139.4(3) . .
Lu2 Lu3 Lu6 107.8(2) 6 .
Lu12 Lu3 C28 50(3) . .
Lu4 Lu3 C28 83.2(4) . .
Lu8 Lu3 C28 118.0(3) . .
Lu2 Lu3 C28 106.77(19) . .
Lu11 Lu3 C28 99.9(6) . .
Lu5 Lu3 C28 114.0(2) . .
C27 Lu3 C28 30.9 . .
Lu2 Lu3 C28 127.37(17) 6 .
Lu6 Lu3 C28 118.4(2) . .
Lu12 Lu3 Lu8 161(3) . 6
Lu4 Lu3 Lu8 97.5(4) . 6
Lu8 Lu3 Lu8 39.0(4) . 6
Lu2 Lu3 Lu8 81.8(3) . 6
Lu11 Lu3 Lu8 115.3(6) . 6
Lu5 Lu3 Lu8 86.9(2) . 6
C27 Lu3 Lu8 110.2(2) . 6
Lu2 Lu3 Lu8 54.4(2) 6 6
Lu6 Lu3 Lu8 91.2(2) . 6
C28 Lu3 Lu8 141.0(2) . 6
Lu12 Lu3 C10 77(2) . .
Lu4 Lu3 C10 122.0(4) . .
Lu8 Lu3 C10 108.4(4) . .
Lu2 Lu3 C10 72.52(16) . .
Lu11 Lu3 C10 143.3(6) . .
Lu5 Lu3 C10 160.3(2) . .
C27 Lu3 C10 33.0 . .
Lu2 Lu3 C10 81.40(14) 6 .
Lu6 Lu3 C10 168.0(2) . .
C28 Lu3 C10 50.13(6) . .
Lu8 Lu3 C10 100.5(2) 6 .
Lu3 Lu4 Lu8 73.4(5) . .
Lu3 Lu4 Lu12 31.4(10) . .
Lu8 Lu4 Lu12 104.7(12) . .
Lu3 Lu4 Lu5 116.9(4) . .
Lu8 Lu4 Lu5 96.0(6) . .
Lu12 Lu4 Lu5 116.1(14) . .
Lu3 Lu4 Lu11 84.5(8) . .
Lu8 Lu4 Lu11 123.8(7) . .
Lu12 Lu4 Lu11 68.9(14) . .
Lu5 Lu4 Lu11 49.9(8) . .
Lu3 Lu4 Lu6 106.3(4) . .
Lu8 Lu4 Lu6 102.9(5) . .
Lu12 Lu4 Lu6 101.9(13) . .
Lu5 Lu4 Lu6 14.4(3) . .
Lu11 Lu4 Lu6 35.8(7) . .
Lu3 Lu4 C50 114.9(5) . .
Lu8 Lu4 C50 145.5(4) . .
Lu12 Lu4 C50 87.3(12) . .
Lu5 Lu4 C50 107.6(3) . .
Lu11 Lu4 C50 90.8(6) . .
Lu6 Lu4 C50 106.1(3) . .
Lu3 Lu4 Lu2 9.2(2) . .
Lu8 Lu4 Lu2 75.1(5) . .
Lu12 Lu4 Lu2 31.9(11) . .
Lu5 Lu4 Lu2 107.9(2) . .
Lu11 Lu4 Lu2 76.5(7) . .
Lu6 Lu4 Lu2 97.1(2) . .
C50 Lu4 Lu2 118.7(3) . .
Lu3 Lu4 C49 149.0(5) . .
Lu8 Lu4 C49 121.3(5) . .
Lu12 Lu4 C49 124.2(12) . .
Lu5 Lu4 C49 90.1(3) . .
Lu11 Lu4 C49 104.2(7) . .
Lu6 Lu4 C49 97.1(3) . .
C50 Lu4 C49 36.88(7) . .
Lu2 Lu4 C49 154.9(3) . .
Lu3 Lu4 C25 126.7(4) . .
Lu8 Lu4 C25 83.0(4) . .
Lu12 Lu4 C25 129.3(14) . .
Lu5 Lu4 C25 112.5(4) . .
Lu11 Lu4 C25 145.8(7) . .
Lu6 Lu4 C25 125.5(3) . .
C50 Lu4 C25 65.01(11) . .
Lu2 Lu4 C25 135.6(3) . .
C49 Lu4 C25 42.10(8) . .
Lu3 Lu4 C27 69.4(4) . .
Lu8 Lu4 C27 90.6(4) . .
Lu12 Lu4 C27 66.2(14) . .
Lu5 Lu4 C27 171.9(3) . .
Lu11 Lu4 C27 128.9(8) . .
Lu6 Lu4 C27 164.2(3) . .
C50 Lu4 C27 64.41(14) . .
Lu2 Lu4 C27 78.2(2) . .
C49 Lu4 C27 82.53(14) . .
C25 Lu4 C27 63.73(11) . .
Lu3 Lu4 C26 92.0(4) . .
Lu8 Lu4 C26 71.1(3) . .
Lu12 Lu4 C26 99.6(13) . .
Lu5 Lu4 C26 144.2(4) . .
Lu11 Lu4 C26 162.4(7) . .
Lu6 Lu4 C26 158.5(3) . .
C50 Lu4 C26 75.09(13) . .
Lu2 Lu4 C26 100.9(2) . .
C49 Lu4 C26 70.71(11) . .
C25 Lu4 C26 34.80(6) . .
C27 Lu4 C26 35.19(7) . .
Lu6 Lu5 Lu11 70.0(13) . .
Lu6 Lu5 Lu4 141.7(8) . .
Lu11 Lu5 Lu4 72.3(11) . .
Lu6 Lu5 Lu13 37.2(9) . 6
Lu11 Lu5 Lu13 99.0(13) . 6
Lu4 Lu5 Lu13 149.0(6) . 6
Lu6 Lu5 Lu8 144.2(6) . .
Lu11 Lu5 Lu8 97.0(11) . .
Lu4 Lu5 Lu8 36.7(3) . .
Lu13 Lu5 Lu8 120.0(7) 6 .
Lu6 Lu5 Lu3 122.0(7) . .
Lu11 Lu5 Lu3 59.9(11) . .
Lu4 Lu5 Lu3 24.66(17) . .
Lu13 Lu5 Lu3 125.5(6) 6 .
Lu8 Lu5 Lu3 37.3(3) . .
Lu6 Lu5 Lu12 112.4(10) . .
Lu11 Lu5 Lu12 45.2(13) . .
Lu4 Lu5 Lu12 29.5(8) . .
Lu13 Lu5 Lu12 127.6(10) 6 .
Lu8 Lu5 Lu12 53.2(6) . .
Lu3 Lu5 Lu12 16.5(5) . .
Lu6 Lu5 Lu14 32.3(7) . .
Lu11 Lu5 Lu14 48.1(12) . .
Lu4 Lu5 Lu14 112.1(6) . .
Lu13 Lu5 Lu14 51.1(9) 6 .
Lu8 Lu5 Lu14 114.9(6) . .
Lu3 Lu5 Lu14 90.1(6) . .
Lu12 Lu5 Lu14 82.8(10) . .
Lu6 Lu5 Lu7 65.9(7) . .
Lu11 Lu5 Lu7 120.3(10) . .
Lu4 Lu5 Lu7 132.0(3) . .
Lu13 Lu5 Lu7 28.7(7) 6 .
Lu8 Lu5 Lu7 96.2(3) . .
Lu3 Lu5 Lu7 116.8(2) . .
Lu12 Lu5 Lu7 127.8(7) . .
Lu14 Lu5 Lu7 73.7(7) . .
Lu6 Lu5 C48 104.1(6) . .
Lu11 Lu5 C48 110.6(8) . .
Lu4 Lu5 C48 95.2(3) . .
Lu13 Lu5 C48 115.5(6) 6 .
Lu8 Lu5 C48 111.8(3) . .
Lu3 Lu5 C48 119.0(2) . .
Lu12 Lu5 C48 113.3(7) . .
Lu14 Lu5 C48 130.3(6) . .
Lu7 Lu5 C48 117.5(2) . .
Lu6 Lu5 Lu9 27.3(6) . .
Lu11 Lu5 Lu9 74.3(11) . .
Lu4 Lu5 Lu9 131.8(3) . .
Lu13 Lu5 Lu9 25.2(6) 6 .
Lu8 Lu5 Lu9 118.1(3) . .
Lu3 Lu5 Lu9 107.3(3) . .
Lu12 Lu5 Lu9 104.8(8) . .
Lu14 Lu5 Lu9 26.2(7) . .
Lu7 Lu5 Lu9 48.5(3) . .
C48 Lu5 Lu9 129.0(3) . .
Lu6 Lu5 C70 65.1(6) . .
Lu11 Lu5 C70 89.3(9) . .
Lu4 Lu5 C70 121.3(3) . .
Lu13 Lu5 C70 87.5(6) 6 .
Lu8 Lu5 C70 150.2(3) . .
Lu3 Lu5 C70 135.8(2) . .
Lu12 Lu5 C70 120.8(6) . .
Lu14 Lu5 C70 90.9(6) . .
Lu7 Lu5 C70 105.8(2) . .
C48 Lu5 C70 39.79(7) . .
Lu9 Lu5 C70 91.7(3) . .
Lu5 Lu6 Lu13 116.3(14) . 6
Lu5 Lu6 Lu11 70.3(13) . .
Lu13 Lu6 Lu11 141.9(13) 6 .
Lu5 Lu6 Lu14 132.2(10) . .
Lu13 Lu6 Lu14 78.1(14) 6 .
Lu11 Lu6 Lu14 72.6(14) . .
Lu5 Lu6 Lu9 140.9(8) . .
Lu13 Lu6 Lu9 41.7(10) 6 .
Lu11 Lu6 Lu9 107.9(12) . .
Lu14 Lu6 Lu9 36.9(10) . .
Lu5 Lu6 Lu4 23.9(5) . .
Lu13 Lu6 Lu4 129.1(10) 6 .
Lu11 Lu6 Lu4 46.9(12) . .
Lu14 Lu6 Lu4 110.8(8) . .
Lu9 Lu6 Lu4 132.9(4) . .
Lu5 Lu6 Lu7 93.1(7) . .
Lu13 Lu6 Lu7 23.2(10) 6 .
Lu11 Lu6 Lu7 136.4(8) . .
Lu14 Lu6 Lu7 93.5(10) . .
Lu9 Lu6 Lu7 60.4(4) . .
Lu4 Lu6 Lu7 107.4(3) . .
Lu5 Lu6 Lu1 138.8(6) . .
Lu13 Lu6 Lu1 54.5(10) 6 .
Lu11 Lu6 Lu1 94.6(12) . .
Lu14 Lu6 Lu1 23.6(9) . .
Lu9 Lu6 Lu1 13.5(2) . .
Lu4 Lu6 Lu1 124.5(3) . .
Lu7 Lu6 Lu1 71.4(4) . .
Lu5 Lu6 Lu10 122.5(8) . .
Lu13 Lu6 Lu10 20.4(11) 6 .
Lu11 Lu6 Lu10 122.6(12) . .
Lu14 Lu6 Lu10 58.9(11) . .
Lu9 Lu6 Lu10 24.6(7) . .
Lu4 Lu6 Lu10 125.8(4) . .
Lu7 Lu6 Lu10 35.9(7) . .
Lu1 Lu6 Lu10 35.8(7) . .
Lu5 Lu6 C69 130.0(7) . .
Lu13 Lu6 C69 80.6(8) 6 .
Lu11 Lu6 C69 125.7(10) . .
Lu14 Lu6 C69 96.1(8) . .
Lu9 Lu6 C69 84.1(5) . .
Lu4 Lu6 C69 142.4(4) . .
Lu7 Lu6 C69 96.1(3) . .
Lu1 Lu6 C69 90.3(4) . .
Lu10 Lu6 C69 90.2(5) . .
Lu5 Lu6 C70 96.5(7) . .
Lu13 Lu6 C70 115.0(8) 6 .
Lu11 Lu6 C70 100.5(9) . .
Lu14 Lu6 C70 119.2(8) . .
Lu9 Lu6 C70 121.5(5) . .
Lu4 Lu6 C70 103.8(4) . .
Lu7 Lu6 C70 121.7(3) . .
Lu1 Lu6 C70 124.4(4) . .
Lu10 Lu6 C70 128.4(5) . .
C69 Lu6 C70 38.79(9) . .
Lu5 Lu6 Lu3 41.5(5) . .
Lu13 Lu6 Lu3 121.1(8) 6 .
Lu11 Lu6 Lu3 38.1(10) . .
Lu14 Lu6 Lu3 91.1(8) . .
Lu9 Lu6 Lu3 113.2(4) . .
Lu4 Lu6 Lu3 20.54(13) . .
Lu7 Lu6 Lu3 104.0(3) . .
Lu1 Lu6 Lu3 104.0(2) . .
Lu10 Lu6 Lu3 111.1(4) . .
C69 Lu6 Lu3 158.2(4) . .
C70 Lu6 Lu3 120.5(4) . .
Lu13 Lu7 Lu13 112(2) . 6
Lu13 Lu7 Lu10 58.3(11) . .
Lu13 Lu7 Lu10 58.3(11) 6 .
Lu13 Lu7 Lu9 78.1(11) . .
Lu13 Lu7 Lu9 35.5(11) 6 .
Lu10 Lu7 Lu9 23.3(4) . .
Lu13 Lu7 Lu9 35.5(11) . 6
Lu13 Lu7 Lu9 78.1(11) 6 6
Lu10 Lu7 Lu9 23.3(4) . 6
Lu9 Lu7 Lu9 42.9(7) . 6
Lu13 Lu7 Lu6 22.4(10) . 6
Lu13 Lu7 Lu6 121.0(9) 6 6
Lu10 Lu7 Lu6 76.5(4) . 6
Lu9 Lu7 Lu6 92.0(4) . 6
Lu9 Lu7 Lu6 53.2(4) 6 6
Lu13 Lu7 Lu6 121.0(9) . .
Lu13 Lu7 Lu6 22.4(10) 6 .
Lu10 Lu7 Lu6 76.5(4) . .
Lu9 Lu7 Lu6 53.2(4) . .
Lu9 Lu7 Lu6 92.0(4) 6 .
Lu6 Lu7 Lu6 120.2(4) 6 .
Lu13 Lu7 Lu5 43.4(11) . 6
Lu13 Lu7 Lu5 125.2(7) 6 6
Lu10 Lu7 Lu5 94.3(5) . 6
Lu9 Lu7 Lu5 105.2(4) . 6
Lu9 Lu7 Lu5 71.8(4) 6 6
Lu6 Lu7 Lu5 21.0(2) 6 6
Lu6 Lu7 Lu5 115.3(3) . 6
Lu13 Lu7 Lu5 125.2(7) . .
Lu13 Lu7 Lu5 43.4(11) 6 .
Lu10 Lu7 Lu5 94.3(5) . .
Lu9 Lu7 Lu5 71.8(4) . .
Lu9 Lu7 Lu5 105.2(4) 6 .
Lu6 Lu7 Lu5 115.3(3) 6 .
Lu6 Lu7 Lu5 21.0(2) . .
Lu5 Lu7 Lu5 103.5(3) 6 .
Lu13 Lu7 C66 125.2(7) . .
Lu13 Lu7 C66 112.5(7) 6 .
Lu10 Lu7 C66 130.3(8) . .
Lu9 Lu7 C66 131.7(4) . .
Lu9 Lu7 C66 138.6(4) 6 .
Lu6 Lu7 C66 125.8(2) 6 .
Lu6 Lu7 C66 112.4(2) . .
Lu5 Lu7 C66 120.5(3) 6 .
Lu5 Lu7 C66 108.9(2) . .
Lu13 Lu7 C65 84.9(7) . .
Lu13 Lu7 C65 131.2(8) 6 .
Lu10 Lu7 C65 103.8(7) . .
Lu9 Lu7 C65 120.9(4) . .
Lu9 Lu7 C65 100.6(3) 6 .
Lu6 Lu7 C65 92.57(19) 6 .
Lu6 Lu7 C65 145.5(2) . .
Lu5 Lu7 C65 99.13(17) 6 .
Lu5 Lu7 C65 149.8(3) . .
C66 Lu7 C65 41.36(9) . .
Lu13 Lu7 C80 79.0(8) . .
Lu13 Lu7 C80 102.6(10) 6 .
Lu10 Lu7 C80 72.5(7) . .
Lu9 Lu7 C80 87.3(4) . .
Lu9 Lu7 C80 76.9(3) 6 .
Lu6 Lu7 C80 97.0(3) 6 .
Lu6 Lu7 C80 123.2(3) . .
Lu5 Lu7 C80 113.35(19) 6 .
Lu5 Lu7 C80 141.4(2) . .
C66 Lu7 C80 61.80(13) . .
C65 Lu7 C80 33.65(7) . .
Lu4 Lu8 Lu3 46.0(4) . .
Lu4 Lu8 Lu12 39.2(9) . .
Lu3 Lu8 Lu12 7.0(10) . .
Lu4 Lu8 Lu5 47.3(4) . .
Lu3 Lu8 Lu5 76.3(4) . .
Lu12 Lu8 Lu5 72.6(9) . .
Lu4 Lu8 Lu8 155.7(3) . 6
Lu3 Lu8 Lu8 116.5(4) . 6
Lu12 Lu8 Lu8 123.5(9) . 6
Lu5 Lu8 Lu8 119.5(2) . 6
Lu4 Lu8 Lu2 77.6(5) . .
Lu3 Lu8 Lu2 32.6(3) . .
Lu12 Lu8 Lu2 39.6(8) . .
Lu5 Lu8 Lu2 93.7(3) . .
Lu8 Lu8 Lu2 84.0(2) 6 .
Lu4 Lu8 Lu11 33.1(5) . .
Lu3 Lu8 Lu11 45.0(6) . .
Lu12 Lu8 Lu11 42.0(9) . .
Lu5 Lu8 Lu11 31.5(5) . .
Lu8 Lu8 Lu11 123.6(5) 6 .
Lu2 Lu8 Lu11 64.6(5) . .
Lu4 Lu8 C26 83.3(4) . .
Lu3 Lu8 C26 91.1(4) . .
Lu12 Lu8 C26 88.1(10) . .
Lu5 Lu8 C26 121.6(4) . .
Lu8 Lu8 C26 117.1(2) 6 .
Lu2 Lu8 C26 105.4(3) . .
Lu11 Lu8 C26 115.8(6) . .
Lu4 Lu8 C8 117.8(4) . .
Lu3 Lu8 C8 110.5(4) . .
Lu12 Lu8 C8 110.9(9) . .
Lu5 Lu8 C8 152.5(4) . .
Lu8 Lu8 C8 82.4(2) 6 .
Lu2 Lu8 C8 106.0(3) . .
Lu11 Lu8 C8 148.6(6) . .
C26 Lu8 C8 34.89(8) . .
Lu4 Lu8 C25 70.9(4) . .
Lu3 Lu8 C25 103.0(4) . .
Lu12 Lu8 C25 97.0(10) . .
Lu5 Lu8 C25 92.2(3) . .
Lu8 Lu8 C25 133.4(2) 6 .
Lu2 Lu8 C25 130.3(3) . .
Lu11 Lu8 C25 101.5(6) . .
C26 Lu8 C25 34.98(8) . .
C8 Lu8 C25 60.39(13) . .
Lu4 Lu8 Lu6 52.3(4) . .
Lu3 Lu8 Lu6 73.0(4) . .
Lu12 Lu8 Lu6 70.5(9) . .
Lu5 Lu8 Lu6 11.0(2) . .
Lu8 Lu8 Lu6 111.1(2) 6 .
Lu2 Lu8 Lu6 85.6(3) . .
Lu11 Lu8 Lu6 28.5(5) . .
C26 Lu8 Lu6 131.3(4) . .
C8 Lu8 Lu6 163.4(4) . .
C25 Lu8 Lu6 103.1(3) . .
Lu4 Lu8 Lu3 134.1(6) . 6
Lu3 Lu8 Lu3 92.0(5) . 6
Lu12 Lu8 Lu3 99.0(9) . 6
Lu5 Lu8 Lu3 116.1(2) . 6
Lu8 Lu8 Lu3 24.5(2) 6 6
Lu2 Lu8 Lu3 59.48(19) . 6
Lu11 Lu8 Lu3 106.9(5) . 6
C26 Lu8 Lu3 121.2(3) . 6
C8 Lu8 Lu3 90.8(3) . 6
C25 Lu8 Lu3 150.6(4) . 6
Lu6 Lu8 Lu3 105.4(2) . 6
Lu1 Lu9 Lu10 126(2) . .
Lu1 Lu9 Lu14 54.3(19) . .
Lu10 Lu9 Lu14 145.4(17) . .
Lu1 Lu9 Lu13 149.1(19) . 6
Lu10 Lu9 Lu13 66.3(15) . 6
Lu14 Lu9 Lu13 99(2) . 6
Lu1 Lu9 Lu9 87.4(15) . 6
Lu10 Lu9 Lu9 38.7(14) . 6
Lu14 Lu9 Lu9 126.0(14) . 6
Lu13 Lu9 Lu9 100.8(11) 6 6
Lu1 Lu9 Lu1 66.2(14) . 6
Lu10 Lu9 Lu1 59.8(15) . 6
Lu14 Lu9 Lu1 109.2(15) . 6
Lu13 Lu9 Lu1 118.8(12) 6 6
Lu9 Lu9 Lu1 21.2(2) 6 6
Lu1 Lu9 Lu6 116.2(15) . .
Lu10 Lu9 Lu6 100.5(15) . .
Lu14 Lu9 Lu6 62.5(17) . .
Lu13 Lu9 Lu6 36.7(11) 6 .
Lu9 Lu9 Lu6 126.5(4) 6 .
Lu1 Lu9 Lu6 134.7(7) 6 .
Lu1 Lu9 Lu15 28.6(15) . .
Lu10 Lu9 Lu15 103.7(15) . .
Lu14 Lu9 Lu15 60.6(16) . .
Lu13 Lu9 Lu15 129.2(14) 6 .
Lu9 Lu9 Lu15 68.2(5) 6 .
Lu1 Lu9 Lu15 48.9(5) 6 .
Lu6 Lu9 Lu15 109.8(10) . .
Lu1 Lu9 Lu7 145.9(17) . .
Lu10 Lu9 Lu7 34.3(14) . .
Lu14 Lu9 Lu7 121.7(16) . .
Lu13 Lu9 Lu7 32.6(11) 6 .
Lu9 Lu9 Lu7 68.5(3) 6 .
Lu1 Lu9 Lu7 87.9(5) 6 .
Lu6 Lu9 Lu7 66.4(4) . .
Lu15 Lu9 Lu7 117.3(10) . .
Lu1 Lu9 Lu13 118.0(17) . .
Lu10 Lu9 Lu13 16.5(10) . .
Lu14 Lu9 Lu13 129.1(13) . .
Lu13 Lu9 Lu13 64.8(15) 6 .
Lu9 Lu9 Lu13 35.9(6) 6 .
Lu1 Lu9 Lu13 55.1(6) 6 .
Lu6 Lu9 Lu13 94.0(7) . .
Lu15 Lu9 Lu13 92.0(9) . .
Lu7 Lu9 Lu13 32.9(6) . .
Lu1 Lu9 C83 81.5(13) . .
Lu10 Lu9 C83 121.2(10) . .
Lu14 Lu9 C83 93.4(12) . .
Lu13 Lu9 C83 118.3(9) 6 .
Lu9 Lu9 C83 119.4(3) 6 .
Lu1 Lu9 C83 113.4(6) 6 .
Lu6 Lu9 C83 111.6(6) . .
Lu15 Lu9 C83 109.3(11) . .
Lu7 Lu9 C83 131.0(4) . .
Lu13 Lu9 C83 137.3(6) . .
Lu1 Lu9 Lu14 70.2(16) . 6
Lu10 Lu9 Lu14 57.2(16) . 6
Lu14 Lu9 Lu14 102.9(18) . 6
Lu13 Lu9 Lu14 107.3(13) 6 6
Lu9 Lu9 Lu14 23.1(6) 6 6
Lu1 Lu9 Lu14 15.3(6) 6 6
Lu6 Lu9 Lu14 119.5(8) . 6
Lu15 Lu9 Lu14 46.7(8) . 6
Lu7 Lu9 Lu14 79.3(9) . 6
Lu13 Lu9 Lu14 47.9(10) . 6
C83 Lu9 Lu14 128.4(8) . 6
Lu9 Lu10 Lu9 103(3) . 6
Lu9 Lu10 Lu13 69.2(11) . 6
Lu9 Lu10 Lu13 150.9(17) 6 6
Lu9 Lu10 Lu13 150.9(17) . .
Lu9 Lu10 Lu13 69.2(11) 6 .
Lu13 Lu10 Lu13 104(3) 6 .
Lu9 Lu10 Lu7 122.4(14) . .
Lu9 Lu10 Lu7 122.4(14) 6 .
Lu13 Lu10 Lu7 53.8(15) 6 .
Lu13 Lu10 Lu7 53.8(15) . .
Lu9 Lu10 Lu1 19.6(9) . .
Lu9 Lu10 Lu1 83(2) 6 .
Lu13 Lu10 Lu1 85.9(11) 6 .
Lu13 Lu10 Lu1 139.2(17) . .
Lu7 Lu10 Lu1 135.8(9) . .
Lu9 Lu10 Lu1 83(2) . 6
Lu9 Lu10 Lu1 19.6(9) 6 6
Lu13 Lu10 Lu1 139.2(17) 6 6
Lu13 Lu10 Lu1 85.9(11) . 6
Lu7 Lu10 Lu1 135.8(9) . 6
Lu1 Lu10 Lu1 63.4(13) . 6
Lu9 Lu10 Lu14 99(2) . 6
Lu9 Lu10 Lu14 18.9(10) 6 6
Lu13 Lu10 Lu14 132.3(13) 6 6
Lu13 Lu10 Lu14 63.8(14) . 6
Lu7 Lu10 Lu14 112.0(12) . 6
Lu1 Lu10 Lu14 80.2(16) . 6
Lu1 Lu10 Lu14 23.8(10) 6 6
Lu9 Lu10 Lu14 18.9(10) . .
Lu9 Lu10 Lu14 99(2) 6 .
Lu13 Lu10 Lu14 63.8(14) 6 .
Lu13 Lu10 Lu14 132.3(13) . .
Lu7 Lu10 Lu14 112.0(12) . .
Lu1 Lu10 Lu14 23.8(10) . .
Lu1 Lu10 Lu14 80.2(16) 6 .
Lu14 Lu10 Lu14 90.1(19) 6 .
Lu9 Lu10 Lu6 135.4(15) . 6
Lu9 Lu10 Lu6 54.9(9) 6 6
Lu13 Lu10 Lu6 110.6(16) 6 6
Lu13 Lu10 Lu6 18.6(10) . 6
Lu7 Lu10 Lu6 67.7(6) . 6
Lu1 Lu10 Lu6 121.0(11) . 6
Lu1 Lu10 Lu6 69.3(4) 6 6
Lu14 Lu10 Lu6 46.2(10) 6 6
Lu14 Lu10 Lu6 118.4(9) . 6
Lu9 Lu10 Lu6 54.9(9) . .
Lu9 Lu10 Lu6 135.4(15) 6 .
Lu13 Lu10 Lu6 18.6(10) 6 .
Lu13 Lu10 Lu6 110.6(16) . .
Lu7 Lu10 Lu6 67.7(6) . .
Lu1 Lu10 Lu6 69.3(4) . .
Lu1 Lu10 Lu6 121.0(11) 6 .
Lu14 Lu10 Lu6 118.4(9) 6 .
Lu14 Lu10 Lu6 46.2(10) . .
Lu6 Lu10 Lu6 111.2(8) 6 .
Lu9 Lu10 C81 89.9(9) . .
Lu9 Lu10 C81 123.2(13) 6 .
Lu13 Lu10 C81 85.3(10) 6 .
Lu13 Lu10 C81 118.3(16) . .
Lu7 Lu10 C81 93.0(12) . .
Lu1 Lu10 C81 101.8(7) . .
Lu1 Lu10 C81 125.1(12) 6 .
Lu14 Lu10 C81 142.1(11) 6 .
Lu14 Lu10 C81 106.9(7) . .
Lu6 Lu10 C81 134.6(9) 6 .
Lu6 Lu10 C81 96.9(5) . .
Lu6 Lu11 Lu5 39.7(7) . .
Lu6 Lu11 Lu4 97.3(15) . .
Lu5 Lu11 Lu4 57.8(11) . .
Lu6 Lu11 Lu12 137.1(19) . .
Lu5 Lu11 Lu12 100.9(19) . .
Lu4 Lu11 Lu12 45.1(13) . .
Lu6 Lu11 Lu3 115.6(14) . .
Lu5 Lu11 Lu3 81.5(13) . .
Lu4 Lu11 Lu3 32.2(5) . .
Lu12 Lu11 Lu3 21.6(8) . .
Lu6 Lu11 Lu14 65.5(13) . .
Lu5 Lu11 Lu14 100.5(14) . .
Lu4 Lu11 Lu14 141.0(12) . .
Lu12 Lu11 Lu14 126.8(17) . .
Lu3 Lu11 Lu14 122.3(12) . .
Lu6 Lu11 Lu13 18.3(7) . 6
Lu5 Lu11 Lu13 48.0(9) . 6
Lu4 Lu11 Lu13 100.7(11) . 6
Lu12 Lu11 Lu13 130.3(13) . 6
Lu3 Lu11 Lu13 109.5(9) . 6
Lu14 Lu11 Lu13 52.6(11) . 6
Lu6 Lu11 Lu8 86.2(11) . .
Lu5 Lu11 Lu8 51.5(9) . .
Lu4 Lu11 Lu8 23.2(3) . .
Lu12 Lu11 Lu8 51.0(11) . .
Lu3 Lu11 Lu8 30.2(4) . .
Lu14 Lu11 Lu8 117.8(10) . .
Lu13 Lu11 Lu8 83.8(8) 6 .
Lu6 Lu11 C51 118.2(11) . .
Lu5 Lu11 C51 110.8(12) . .
Lu4 Lu11 C51 90.9(9) . .
Lu12 Lu11 C51 87.4(12) . .
Lu3 Lu11 C51 103.1(10) . .
Lu14 Lu11 C51 128.0(13) . .
Lu13 Lu11 C51 135.4(10) 6 .
Lu8 Lu11 C51 114.1(10) . .
Lu6 Lu11 C71 85.4(10) . .
Lu5 Lu11 C71 98.3(10) . .
Lu4 Lu11 C71 115.1(11) . .
Lu12 Lu11 C71 125.2(13) . .
Lu3 Lu11 C71 138.4(11) . .
Lu14 Lu11 C71 98.9(12) . .
Lu13 Lu11 C71 100.1(9) 6 .
Lu8 Lu11 C71 134.4(10) . .
C51 Lu11 C71 37.8(2) . .
Lu6 Lu11 Lu2 123.6(10) . .
Lu5 Lu11 Lu2 105.6(11) . .
Lu4 Lu11 Lu2 66.8(7) . .
Lu12 Lu11 Lu2 34.2(11) . .
Lu3 Lu11 Lu2 34.8(4) . .
Lu14 Lu11 Lu2 93.0(10) . .
Lu13 Lu11 Lu2 108.1(7) 6 .
Lu8 Lu11 Lu2 57.6(5) . .
C51 Lu11 Lu2 115.9(8) . .
C71 Lu11 Lu2 150.9(8) . .
Lu6 Lu11 Lu9 44.5(9) . .
Lu5 Lu11 Lu9 77.8(10) . .
Lu4 Lu11 Lu9 124.2(9) . .
Lu12 Lu11 Lu9 131.9(13) . .
Lu3 Lu11 Lu9 118.1(8) . .
Lu14 Lu11 Lu9 22.7(9) . .
Lu13 Lu11 Lu9 30.0(6) 6 .
Lu8 Lu11 Lu9 102.6(6) . .
C51 Lu11 Lu9 138.8(10) . .
C71 Lu11 Lu9 102.2(9) . .
Lu2 Lu11 Lu9 98.9(6) . .
Lu3 Lu12 Lu4 49(2) . .
Lu3 Lu12 Lu2 76(2) . .
Lu4 Lu12 Lu2 123.0(17) . .
Lu3 Lu12 Lu11 92(3) . .
Lu4 Lu12 Lu11 66.0(15) . .
Lu2 Lu12 Lu11 109.5(19) . .
Lu3 Lu12 Lu8 14(2) . .
Lu4 Lu12 Lu8 36.0(7) . .
Lu2 Lu12 Lu8 89.2(10) . .
Lu11 Lu12 Lu8 87.0(15) . .
Lu3 Lu12 Lu5 62(2) . .
Lu4 Lu12 Lu5 34.3(8) . .
Lu2 Lu12 Lu5 112.6(14) . .
Lu11 Lu12 Lu5 33.9(10) . .
Lu8 Lu12 Lu5 54.2(8) . .
Lu3 Lu12 C28 118(3) . .
Lu4 Lu12 C28 95.9(17) . .
Lu2 Lu12 C28 125.1(15) . .
Lu11 Lu12 C28 122.0(14) . .
Lu8 Lu12 C28 110.1(15) . .
Lu5 Lu12 C28 120.5(13) . .
Lu3 Lu12 C27 86(3) . .
Lu4 Lu12 C27 85.4(16) . .
Lu2 Lu12 C27 106.5(12) . .
Lu11 Lu12 C27 142.4(19) . .
Lu8 Lu12 C27 82.8(11) . .
Lu5 Lu12 C27 119.3(14) . .
C28 Lu12 C27 34.1(4) . .
Lu3 Lu12 C29 154(3) . .
Lu4 Lu12 C29 127.6(18) . .
Lu2 Lu12 C29 107.9(14) . .
Lu11 Lu12 C29 110.0(12) . .
Lu8 Lu12 C29 149.1(17) . .
Lu5 Lu12 C29 133.2(11) . .
C28 Lu12 C29 39.0(4) . .
C27 Lu12 C29 68.0(7) . .
Lu3 Lu12 C50 110(3) . .
Lu4 Lu12 C50 65.2(12) . .
Lu2 Lu12 C50 167.8(16) . .
Lu11 Lu12 C50 81.7(12) . .
Lu8 Lu12 C50 96.3(13) . .
Lu5 Lu12 C50 79.3(9) . .
C28 Lu12 C50 42.8(5) . .
C27 Lu12 C50 63.7(7) . .
C29 Lu12 C50 62.6(6) . .
Lu3 Lu12 Lu6 73(2) . .
Lu4 Lu12 Lu6 51.5(10) . .
Lu2 Lu12 Lu6 105.9(13) . .
Lu11 Lu12 Lu6 18.7(8) . .
Lu8 Lu12 Lu6 68.3(9) . .
Lu5 Lu12 Lu6 17.3(3) . .
C28 Lu12 Lu6 129.0(12) . .
C27 Lu12 Lu6 135.7(13) . .
C29 Lu12 Lu6 127.3(9) . .
C50 Lu12 Lu6 86.2(8) . .
Lu3 Lu12 C52 166(3) . .
Lu4 Lu12 C52 116.7(14) . .
Lu2 Lu12 C52 117.2(15) . .
Lu11 Lu12 C52 77.9(10) . .
Lu8 Lu12 C52 152.7(15) . .
Lu5 Lu12 C52 105.3(9) . .
C28 Lu12 C52 61.8(5) . .
C27 Lu12 C52 95.4(9) . .
C29 Lu12 C52 32.3(3) . .
C50 Lu12 C52 59.4(5) . .
Lu6 Lu12 C52 95.9(7) . .
Lu6 Lu13 Lu7 134.4(19) 6 .
Lu6 Lu13 Lu10 141(2) 6 .
Lu7 Lu13 Lu10 68(2) . .
Lu6 Lu13 Lu9 101.6(16) 6 6
Lu7 Lu13 Lu9 111.9(19) . 6
Lu10 Lu13 Lu9 44.5(13) . 6
Lu6 Lu13 Lu5 26.4(7) 6 6
Lu7 Lu13 Lu5 108.0(14) . 6
Lu10 Lu13 Lu5 143.6(12) . 6
Lu9 Lu13 Lu5 120.4(13) 6 6
Lu6 Lu13 Lu1 94.0(13) 6 6
Lu7 Lu13 Lu1 115.2(16) . 6
Lu10 Lu13 Lu1 49.9(13) . 6
Lu9 Lu13 Lu1 9.4(5) 6 6
Lu5 Lu13 Lu1 111.3(10) 6 6
Lu6 Lu13 Lu14 64.2(14) 6 6
Lu7 Lu13 Lu14 136.2(16) . 6
Lu10 Lu13 Lu14 78.5(17) . 6
Lu9 Lu13 Lu14 38.0(12) 6 6
Lu5 Lu13 Lu14 82.9(13) 6 6
Lu1 Lu13 Lu14 29.8(10) 6 6
Lu6 Lu13 Lu13 140.1(8) 6 6
Lu7 Lu13 Lu13 33.9(10) . 6
Lu10 Lu13 Lu13 38.0(14) . 6
Lu9 Lu13 Lu13 79.2(11) 6 6
Lu5 Lu13 Lu13 120.5(6) 6 6
Lu1 Lu13 Lu13 81.5(7) 6 6
Lu14 Lu13 Lu13 103.7(12) 6 6
Lu6 Lu13 Lu9 131.0(11) 6 .
Lu7 Lu13 Lu9 69.1(11) . .
Lu10 Lu13 Lu9 12.6(8) . .
Lu9 Lu13 Lu9 43.3(10) 6 .
Lu5 Lu13 Lu9 131.0(7) 6 .
Lu1 Lu13 Lu9 46.2(6) 6 .
Lu14 Lu13 Lu9 72.2(13) 6 .
Lu13 Lu13 Lu9 35.9(6) 6 .
Lu6 Lu13 Lu11 19.8(7) 6 6
Lu7 Lu13 Lu11 131.3(13) . 6
Lu10 Lu13 Lu11 122.2(16) . 6
Lu9 Lu13 Lu11 87.9(12) 6 6
Lu5 Lu13 Lu11 32.9(8) 6 6
Lu1 Lu13 Lu11 79.2(9) 6 6
Lu14 Lu13 Lu11 50.1(12) 6 6
Lu13 Lu13 Lu11 123.7(6) 6 6
Lu9 Lu13 Lu11 111.5(8) . 6
Lu6 Lu13 Lu1 120.1(11) 6 .
Lu7 Lu13 Lu1 79.8(11) . .
Lu10 Lu13 Lu1 21.4(11) . .
Lu9 Lu13 Lu1 34.2(8) 6 .
Lu5 Lu13 Lu1 124.2(7) 6 .
Lu1 Lu13 Lu1 35.5(5) 6 .
Lu14 Lu13 Lu1 60.5(12) 6 .
Lu13 Lu13 Lu1 46.0(5) 6 .
Lu9 Lu13 Lu1 11.8(3) . .
Lu11 Lu13 Lu1 100.9(8) 6 .
Lu6 Lu13 C64 82.7(10) 6 .
Lu7 Lu13 C64 97.7(9) . .
Lu10 Lu13 C64 131.4(14) . .
Lu9 Lu13 C64 129.6(11) 6 .
Lu5 Lu13 C64 84.7(9) 6 .
Lu1 Lu13 C64 134.7(9) 6 .
Lu14 Lu13 C64 125.8(13) 6 .
Lu13 Lu13 C64 127.7(5) 6 .
Lu9 Lu13 C64 143.9(9) . .
Lu11 Lu13 C64 102.5(10) 6 .
Lu1 Lu13 C64 150.5(9) . .
Lu1 Lu14 Lu9 29.7(9) . .
Lu1 Lu14 Lu6 110(2) . .
Lu9 Lu14 Lu6 80.7(16) . .
Lu1 Lu14 Lu15 61(2) . .
Lu9 Lu14 Lu15 85(2) . .
Lu6 Lu14 Lu15 134.9(18) . .
Lu1 Lu14 Lu11 147(2) . .
Lu9 Lu14 Lu11 121(2) . .
Lu6 Lu14 Lu11 41.9(10) . .
Lu15 Lu14 Lu11 121.6(18) . .
Lu1 Lu14 Lu13 72.3(17) . 6
Lu9 Lu14 Lu13 43.4(12) . 6
Lu6 Lu14 Lu13 37.7(9) . 6
Lu15 Lu14 Lu13 112.4(18) . 6
Lu11 Lu14 Lu13 77.4(16) . 6
Lu1 Lu14 Lu10 36.4(13) . .
Lu9 Lu14 Lu10 15.7(8) . .
Lu6 Lu14 Lu10 74.9(12) . .
Lu15 Lu14 Lu10 79.9(17) . .
Lu11 Lu14 Lu10 110.6(17) . .
Lu13 Lu14 Lu10 37.7(10) 6 .
Lu1 Lu14 Lu1 25.4(9) . 6
Lu9 Lu14 Lu1 41.9(11) . 6
Lu6 Lu14 Lu1 108.3(12) . 6
Lu15 Lu14 Lu1 43.4(13) . 6
Lu11 Lu14 Lu1 130.5(13) . 6
Lu13 Lu14 Lu1 73.7(12) 6 6
Lu10 Lu14 Lu1 37.3(8) . 6
Lu1 Lu14 Lu5 116(2) . .
Lu9 Lu14 Lu5 89.1(16) . .
Lu6 Lu14 Lu5 15.5(4) . .
Lu15 Lu14 Lu5 123.9(16) . .
Lu11 Lu14 Lu5 31.5(8) . .
Lu13 Lu14 Lu5 46.0(10) 6 .
Lu10 Lu14 Lu5 80.0(12) . .
Lu1 Lu14 Lu5 107.7(10) 6 .
Lu1 Lu14 Lu9 26.3(10) . 6
Lu9 Lu14 Lu9 30.9(10) . 6
Lu6 Lu14 Lu9 95.1(11) . 6
Lu15 Lu14 Lu9 56.3(13) . 6
Lu11 Lu14 Lu9 122.7(13) . 6
Lu13 Lu14 Lu9 59.9(11) 6 6
Lu10 Lu14 Lu9 23.7(7) . 6
Lu1 Lu14 Lu9 13.9(2) 6 6
Lu5 Lu14 Lu9 96.2(9) . 6
Lu1 Lu14 C84 91.8(13) . .
Lu9 Lu14 C84 82.1(12) . .
Lu6 Lu14 C84 80.5(10) . .
Lu15 Lu14 C84 139(2) . .
Lu11 Lu14 C84 98.1(14) . .
Lu13 Lu14 C84 83.1(10) 6 .
Lu10 Lu14 C84 95.5(9) . .
Lu1 Lu14 C84 116.9(10) 6 .
Lu5 Lu14 C84 94.5(10) . .
Lu9 Lu14 C84 111.3(10) 6 .
Lu1 Lu14 C72 125.4(15) . .
Lu9 Lu14 C72 117.3(14) . .
Lu6 Lu14 C72 81.3(12) . .
Lu15 Lu14 C72 142.1(17) . .
Lu11 Lu14 C72 75.2(12) . .
Lu13 Lu14 C72 104.2(14) 6 .
Lu10 Lu14 C72 129.1(11) . .
Lu1 Lu14 C72 150.7(11) 6 .
Lu5 Lu14 C72 88.8(11) . .
Lu9 Lu14 C72 147.1(10) 6 .
C84 Lu14 C72 35.7(3) . .
Lu1 Lu15 Lu1 55.9(13) 6 .
Lu1 Lu15 Lu14 32.0(9) 6 6
Lu1 Lu15 Lu14 84.8(19) . 6
Lu1 Lu15 Lu14 84.8(19) 6 .
Lu1 Lu15 Lu14 32.0(9) . .
Lu14 Lu15 Lu14 108(3) 6 .
Lu1 Lu15 Lu9 50.5(11) 6 .
Lu1 Lu15 Lu9 10.2(5) . .
Lu14 Lu15 Lu9 77.0(17) 6 .
Lu14 Lu15 Lu9 34.5(11) . .
Lu1 Lu15 Lu9 10.2(5) 6 6
Lu1 Lu15 Lu9 50.5(11) . 6
Lu14 Lu15 Lu9 34.5(11) 6 6
Lu14 Lu15 Lu9 77.0(17) . 6
Lu9 Lu15 Lu9 43.6(10) . 6
Lu1 Lu15 Lu10 31.4(8) 6 .
Lu1 Lu15 Lu10 31.4(8) . .
Lu14 Lu15 Lu10 54.5(13) 6 .
Lu14 Lu15 Lu10 54.5(13) . .
Lu9 Lu15 Lu10 22.6(5) . .
Lu9 Lu15 Lu10 22.6(5) 6 .
Lu1 Lu15 C57 113.7(19) 6 .
Lu1 Lu15 C57 108.1(17) . .
Lu14 Lu15 C57 121.8(16) 6 .
Lu14 Lu15 C57 111.8(15) . .
Lu9 Lu15 C57 117.7(15) . .
Lu9 Lu15 C57 122.5(16) 6 .
Lu10 Lu15 C57 128.6(16) . .
Lu1 Lu15 C76 79.3(15) 6 .
Lu1 Lu15 C76 77.0(14) . .
Lu14 Lu15 C76 99.3(16) 6 .
Lu14 Lu15 C76 95.4(15) . .
Lu9 Lu15 C76 85.0(12) . .
Lu9 Lu15 C76 86.8(12) 6 .
Lu10 Lu15 C76 91.5(12) . .
C57 Lu15 C76 37.3(6) . .
Lu1 Lu15 C56 130.8(19) 6 .
Lu1 Lu15 C56 93.3(10) . .
Lu14 Lu15 C56 154(2) 6 .
Lu14 Lu15 C56 82.6(10) . .
Lu9 Lu15 C56 103.2(8) . .
Lu9 Lu15 C56 134.4(16) 6 .
Lu10 Lu15 C56 123.9(11) . .
C57 Lu15 C56 34.5(5) . .
C76 Lu15 C56 54.9(7) . .
Lu1 Lu15 C58 109.3(13) 6 .
Lu1 Lu15 C58 138(2) . .
Lu14 Lu15 C58 98.3(11) 6 .
Lu14 Lu15 C58 147.6(18) . .
Lu9 Lu15 C58 144.4(17) . .
Lu9 Lu15 C58 119.4(10) 6 .
Lu10 Lu15 C58 139.2(12) . .
C57 Lu15 C58 36.0(5) . .
C76 Lu15 C58 60.6(8) . .
C56 Lu15 C58 65.9(9) . .
Lu1 Lu15 Lu13 55.2(12) 6 6
Lu1 Lu15 Lu13 28.3(10) . 6
Lu14 Lu15 Lu13 73.1(16) 6 6
Lu14 Lu15 Lu13 34.6(12) . 6
Lu9 Lu15 Lu13 19.3(7) . 6
Lu9 Lu15 Lu13 45.7(9) 6 6
Lu10 Lu15 Lu13 24.0(6) . 6
C57 Lu15 Lu13 136.2(12) . 6
C76 Lu15 Lu13 104.3(11) . 6
C56 Lu15 Lu13 115.3(7) . 6
C58 Lu15 Lu13 161.9(14) . 6
C9 C1 C10 134.1 . .
C9 C1 C2 110.4 . .
C10 C1 C2 111.5 . .
C9 C1 Lu2 107.02(6) . .
C10 C1 Lu2 67.87(8) . .
C2 C1 Lu2 74.53(8) . .
C9 C1 Lu3 91.75(8) . .
C10 C1 Lu3 61.86(8) . .
C2 C1 Lu3 102.20(9) . .
Lu2 C1 Lu3 28.36(9) . .
C9 C1 Lu8 69.74(16) . .
C10 C1 Lu8 79.31(16) . .
C2 C1 Lu8 109.59(10) . .
Lu2 C1 Lu8 44.48(13) . .
Lu3 C1 Lu8 22.01(16) . .
C9 C1 Lu12 102.1(5) . .
C10 C1 Lu12 52.0(4) . .
C2 C1 Lu12 101.2(5) . .
Lu2 C1 Lu12 27.1(5) . .
Lu3 C1 Lu12 10.8(4) . .
Lu8 C1 Lu12 32.4(4) . .
C12 C2 C1 103.2 . .
C12 C2 C3 126.8 . .
C1 C2 C3 123.3 . .
C12 C2 Lu2 64.69(6) . .
C1 C2 Lu2 73.31(7) . .
C3 C2 Lu2 103.00(7) . .
C15 C3 C4 135.3 . .
C15 C3 C2 98.4 . .
C4 C3 C2 118.3 . .
C18 C4 C3 131.2 . .
C18 C4 C5 111.4 . .
C3 C4 C5 107.1 . .
C6 C5 C9 98.8 . .
C6 C5 C4 120.0 . .
C9 C5 C4 138.0 . .
C20 C6 C5 118.9 . .
C20 C6 C7 121.7 . .
C5 C6 C7 114.2 . .
C20 C6 C9 155.7 . .
C5 C6 C9 40.7 . .
C7 C6 C9 73.8 . .
C6 C7 C8 108.5 . .
C6 C7 C23 136.3 . .
C8 C7 C23 106.5 . .
C6 C7 Lu8 100.83(14) . .
C8 C7 Lu8 57.50(14) . .
C23 C7 Lu8 77.03(15) . .
C26 C8 C7 133.2 . .
C26 C8 C9 125.8 . .
C7 C8 C9 98.5 . .
C26 C8 Lu8 70.46(19) . .
C7 C8 Lu8 92.1(2) . .
C9 C8 Lu8 96.98(17) . .
C26 C8 Lu3 61.07(9) . .
C7 C8 Lu3 112.71(7) . .
C9 C8 Lu3 87.88(9) . .
Lu8 C8 Lu3 21.46(19) . .
C26 C8 Lu4 52.65(9) . .
C7 C8 Lu4 106.89(12) . .
C9 C8 Lu4 104.44(10) . .
Lu8 C8 Lu4 18.13(18) . .
Lu3 C8 Lu4 16.77(9) . .
C1 C9 C5 122.4 . .
C1 C9 C8 109.9 . .
C5 C9 C8 118.3 . .
C1 C9 C6 155.3 . .
C5 C9 C6 40.5 . .
C8 C9 C6 78.7 . .
C1 C9 Lu8 84.54(17) . .
C5 C9 Lu8 99.67(14) . .
C8 C9 Lu8 53.47(12) . .
C6 C9 Lu8 82.63(17) . .
C1 C10 C27 110.9 . .
C1 C10 C11 104.7 . .
C27 C10 C11 133.9 . .
C1 C10 C28 142.1 . .
C27 C10 C28 34.6 . .
C11 C10 C28 100.9 . .
C1 C10 Lu12 102.5(5) . .
C27 C10 Lu12 59.8(7) . .
C11 C10 Lu12 85.1(7) . .
C28 C10 Lu12 52.5(5) . .
C1 C10 Lu2 81.93(8) . .
C27 C10 Lu2 90.69(8) . .
C11 C10 Lu2 66.10(7) . .
C28 C10 Lu2 83.56(9) . .
Lu12 C10 Lu2 32.6(6) . .
C1 C10 Lu3 90.04(10) . .
C27 C10 Lu3 59.34(10) . .
C11 C10 Lu3 93.18(10) . .
C28 C10 Lu3 60.93(10) . .
Lu12 C10 Lu3 13.4(5) . .
Lu2 C10 Lu3 31.66(10) . .
C1 C10 Lu4 94.50(9) . .
C27 C10 Lu4 45.74(7) . .
C11 C10 Lu4 104.44(8) . .
C28 C10 Lu4 51.87(9) . .
Lu12 C10 Lu4 19.6(6) . .
Lu2 C10 Lu4 45.30(9) . .
Lu3 C10 Lu4 13.66(9) . .
C12 C11 C10 111.8 . .
C12 C11 C30 124.6 . .
C10 C11 C30 115.6 . .
C12 C11 Lu2 78.13(9) . .
C10 C11 Lu2 80.52(8) . .
C30 C11 Lu2 82.88(9) . .
C12 C11 Lu12 108.4(5) . .
C10 C11 Lu12 64.4(6) . .
C30 C11 Lu12 70.2(4) . .
Lu2 C11 Lu12 30.7(5) . .
C12 C11 Lu3 101.02(9) . .
C10 C11 Lu3 58.83(8) . .
C30 C11 Lu3 80.98(8) . .
Lu2 C11 Lu3 26.76(9) . .
Lu12 C11 Lu3 11.0(4) . .
C11 C12 C2 108.8 . .
C11 C12 C13 124.4 . .
C2 C12 C13 119.2 . .
C11 C12 Lu2 68.20(8) . .
C2 C12 Lu2 84.30(8) . .
C13 C12 Lu2 89.61(8) . .
C14 C13 C12 121.7 . .
C14 C13 C32 120.5 . .
C12 C13 C32 112.5 . .
C14 C13 Lu2 103.32(7) . .
C12 C13 Lu2 59.49(6) . .
C32 C13 Lu2 83.42(7) . .
C13 C14 C35 123.8 . .
C13 C14 C15 111.4 . .
C35 C14 C15 112.6 . .
C3 C15 C14 142.4 . .
C3 C15 C16 105.9 . .
C14 C15 C16 107.2 . .
C36 C16 C15 104.6 . .
C36 C16 C17 119.6 . .
C15 C16 C17 125.6 . .
C39 C17 C18 123.8 . .
C39 C17 C16 111.9 . .
C18 C17 C16 110.1 . .
C19 C18 C4 127.7 . .
C19 C18 C17 108.4 . .
C4 C18 C17 111.2 . .
C20 C19 C18 112.8 . .
C20 C19 C41 109.2 . .
C18 C19 C41 132.5 . .
C19 C20 C6 123.9 . .
C19 C20 C21 103.4 . .
C6 C20 C21 112.0 . .
C42 C21 C20 112.6 . .
C42 C21 C22 114.1 . .
C20 C21 C22 123.4 . .
C23 C22 C45 101.7 . .
C23 C22 C21 120.7 . .
C45 C22 C21 128.2 . .
C24 C23 C7 129.2 . .
C24 C23 C22 116.9 . .
C7 C23 C22 105.0 . .
C24 C23 Lu8 70.27(16) . .
C7 C23 Lu8 73.35(16) . .
C22 C23 Lu8 103.49(13) . .
C23 C24 C46 104.5 . .
C23 C24 C25 123.0 . .
C46 C24 C25 122.7 . .
C23 C24 Lu8 85.03(19) . .
C46 C24 Lu8 96.70(14) . .
C25 C24 Lu8 61.15(16) . .
C23 C24 Lu4 104.95(10) . .
C46 C24 Lu4 94.01(11) . .
C25 C24 Lu4 46.98(9) . .
Lu8 C24 Lu4 20.09(17) . .
C26 C25 C49 126.6 . .
C26 C25 C24 111.4 . .
C49 C25 C24 115.7 . .
C26 C25 Lu4 78.77(15) . .
C49 C25 Lu4 68.79(13) . .
C24 C25 Lu4 101.31(15) . .
C26 C25 Lu8 69.77(17) . .
C49 C25 Lu8 93.0(2) . .
C24 C25 Lu8 82.0(2) . .
Lu4 C25 Lu8 26.1(2) . .
C26 C25 Lu3 64.72(8) . .
C49 C25 Lu3 79.84(9) . .
C24 C25 Lu3 104.94(8) . .
Lu4 C25 Lu3 14.09(13) . .
Lu8 C25 Lu3 23.2(2) . .
C26 C25 Lu5 100.93(9) . .
C49 C25 Lu5 59.93(10) . .
C24 C25 Lu5 86.04(10) . .
Lu4 C25 Lu5 23.49(17) . .
Lu8 C25 Lu5 35.69(19) . .
Lu3 C25 Lu5 36.84(10) . .
C26 C25 Lu12 65.9(4) . .
C49 C25 Lu12 72.5(4) . .
C24 C25 Lu12 114.8(4) . .
Lu4 C25 Lu12 16.4(5) . .
Lu8 C25 Lu12 33.6(4) . .
Lu3 C25 Lu12 10.6(4) . .
Lu5 C25 Lu12 39.5(5) . .
C8 C26 C25 116.0 . .
C8 C26 C27 113.8 . .
C25 C26 C27 117.8 . .
C8 C26 Lu8 74.6(2) . .
C25 C26 Lu8 75.25(19) . .
C27 C26 Lu8 84.6(2) . .
C8 C26 Lu4 100.00(12) . .
C25 C26 Lu4 66.42(14) . .
C27 C26 Lu4 70.51(15) . .
Lu8 C26 Lu4 25.6(2) . .
C8 C26 Lu3 90.82(10) . .
C25 C26 Lu3 85.96(10) . .
C27 C26 Lu3 58.50(8) . .
Lu8 C26 Lu3 26.5(2) . .
Lu4 C26 Lu3 19.55(11) . .
C8 C26 Lu12 100.7(4) . .
C25 C26 Lu12 87.2(5) . .
C27 C26 Lu12 48.7(5) . .
Lu8 C26 Lu12 37.6(5) . .
Lu4 C26 Lu12 23.2(5) . .
Lu3 C26 Lu12 11.6(4) . .
C28 C27 C10 105.7 . .
C28 C27 C26 128.2 . .
C10 C27 C26 124.7 . .
C28 C27 Lu12 68.7(5) . .
C10 C27 Lu12 86.3(7) . .
C26 C27 Lu12 101.2(7) . .
C28 C27 Lu3 83.18(11) . .
C10 C27 Lu3 87.63(12) . .
C26 C27 Lu3 87.67(11) . .
Lu12 C27 Lu3 15.6(5) . .
C28 C27 Lu4 79.35(12) . .
C10 C27 Lu4 109.12(12) . .
C26 C27 Lu4 74.31(12) . .
Lu12 C27 Lu4 28.5(7) . .
Lu3 C27 Lu4 21.55(10) . .
C28 C27 Lu8 102.90(19) . .
C10 C27 Lu8 98.74(16) . .
C26 C27 Lu8 61.77(16) . .
Lu12 C27 Lu8 41.3(6) . .
Lu3 C27 Lu8 26.30(18) . .
Lu4 C27 Lu8 23.88(17) . .
C28 C27 Lu2 87.35(7) . .
C10 C27 Lu2 60.47(6) . .
C26 C27 Lu2 106.42(6) . .
Lu12 C27 Lu2 27.8(6) . .
Lu3 C27 Lu2 27.52(11) . .
Lu4 C27 Lu2 49.04(12) . .
Lu8 C27 Lu2 47.13(15) . .
C27 C28 C29 130.8 . .
C27 C28 C50 112.4 . .
C29 C28 C50 101.5 . .
C27 C28 Lu12 77.2(6) . .
C29 C28 Lu12 74.3(7) . .
C50 C28 Lu12 80.7(7) . .
C27 C28 C10 39.7 . .
C29 C28 C10 93.5 . .
C50 C28 C10 145.3 . .
Lu12 C28 C10 73.5(6) . .
C27 C28 Lu3 65.88(10) . .
C29 C28 Lu3 86.60(10) . .
C50 C28 Lu3 80.81(11) . .
Lu12 C28 Lu3 12.7(7) . .
C10 C28 Lu3 68.94(10) . .
C27 C28 Lu4 70.78(12) . .
C29 C28 Lu4 97.55(10) . .
C50 C28 Lu4 61.66(13) . .
Lu12 C28 Lu4 27.2(8) . .
C10 C28 Lu4 85.60(13) . .
Lu3 C28 Lu4 20.52(10) . .
C27 C28 Lu2 69.03(6) . .
C29 C28 Lu2 69.59(6) . .
C50 C28 Lu2 102.5 . .
Lu12 C28 Lu2 21.9(7) . .
C10 C28 Lu2 53.93(6) . .
Lu3 C28 Lu2 25.38(10) . .
Lu4 C28 Lu2 45.66(12) . .
C52 C29 C28 118.7 . .
C52 C29 C30 110.2 . .
C28 C29 C30 124.5 . .
C52 C29 Lu12 87.1(6) . .
C28 C29 Lu12 66.7(8) . .
C30 C29 Lu12 92.4(7) . .
C52 C29 Lu3 92.02(8) . .
C28 C29 Lu3 62.00(9) . .
C30 C29 Lu3 92.95(10) . .
Lu12 C29 Lu3 5.5(7) . .
C52 C29 Lu2 97.62(6) . .
C28 C29 Lu2 83.41(6) . .
C30 C29 Lu2 65.06(6) . .
Lu12 C29 Lu2 27.3(7) . .
Lu3 C29 Lu2 28.17(10) . .
C52 C29 Lu4 84.58(10) . .
C28 C29 Lu4 54.43(7) . .
C30 C29 Lu4 109.41(9) . .
Lu12 C29 Lu4 17.4(8) . .
Lu3 C29 Lu4 16.57(8) . .
Lu2 C29 Lu4 44.40(10) . .
C52 C29 Lu11 59.7(4) . .
C28 C29 Lu11 80.7(4) . .
C30 C29 Lu11 104.1(3) . .
Lu12 C29 Lu11 27.6(7) . .
Lu3 C29 Lu11 32.3(4) . .
Lu2 C29 Lu11 46.9(3) . .
Lu4 C29 Lu11 28.0(4) . .
C31 C30 C29 129.2 . .
C31 C30 C11 111.5 . .
C29 C30 C11 105.4 . .
C31 C30 Lu2 84.59(7) . .
C29 C30 Lu2 84.42(8) . .
C11 C30 Lu2 60.50(7) . .
C31 C30 Lu12 103.4(6) . .
C29 C30 Lu12 53.8(5) . .
C11 C30 Lu12 75.6(4) . .
Lu2 C30 Lu12 30.6(5) . .
C30 C31 C32 126.2 . .
C30 C31 C54 117.4 . .
C32 C31 C54 110.3 . .
C30 C31 Lu2 68.19(7) . .
C32 C31 Lu2 82.35(8) . .
C54 C31 Lu2 98.04(6) . .
C13 C32 C33 122.5 . .
C13 C32 C31 119.9 . .
C33 C32 C31 103.7 . .
C13 C32 Lu2 67.34(7) . .
C33 C32 Lu2 102.5 . .
C31 C32 Lu2 66.93(7) . .
C32 C33 C55 111.9 . .
C32 C33 C34 109.6 . .
C55 C33 C34 125.7 . .
C35 C34 C58 120.7 . .
C35 C34 C33 124.1 . .
C58 C34 C33 102.6 . .
C34 C35 C14 118.4 . .
C34 C35 C36 129.3 . .
C14 C35 C36 101.7 . .
C37 C36 C16 130.9 . .
C37 C36 C35 111.4 . .
C16 C36 C35 113.3 . .
C36 C37 C59 123.2 . .
C36 C37 C38 106.9 . .
C59 C37 C38 117.9 . .
C39 C38 C37 140.6 . .
C39 C38 C61 115.5 . .
C37 C38 C61 98.0 . .
C38 C39 C17 109.3 . .
C38 C39 C40 121.1 . .
C17 C39 C40 121.1 . .
C63 C40 C41 118.0 . .
C63 C40 C39 120.8 . .
C41 C40 C39 115.2 . .
C63 C40 Lu13 54.5(3) . .
C41 C40 Lu13 93.3(4) . .
C39 C40 Lu13 99.4(3) . .
C42 C41 C40 131.1 . .
C42 C41 C19 103.7 . .
C40 C41 C19 118.0 . .
C41 C42 C43 124.6 . .
C41 C42 C21 110.9 . .
C43 C42 C21 116.0 . .
C42 C43 C44 131.6 . .
C42 C43 C64 107.5 . .
C44 C43 C64 104.8 . .
C45 C44 C66 112.9 . .
C45 C44 C43 118.7 . .
C66 C44 C43 121.5 . .
C45 C44 Lu7 99.33(11) . .
C66 C44 Lu7 55.65(11) . .
C43 C44 Lu7 89.81(8) . .
C46 C45 C44 133.1 . .
C46 C45 C22 105.4 . .
C44 C45 C22 109.8 . .
C45 C46 C47 119.5 . .
C45 C46 C24 111.5 . .
C47 C46 C24 119.2 . .
C67 C47 C46 120.1 . .
C67 C47 C48 116.1 . .
C46 C47 C48 119.6 . .
C67 C47 Lu5 87.94(12) . .
C46 C47 Lu5 96.71(13) . .
C48 C47 Lu5 64.41(11) . .
C67 C47 Lu6 73.59(18) . .
C46 C47 Lu6 109.11(13) . .
C48 C47 Lu6 67.32(17) . .
Lu5 C47 Lu6 15.67(11) . .
C49 C48 C70 125.6 . .
C49 C48 C47 118.7 . .
C70 C48 C47 99.2 . .
C49 C48 Lu5 79.25(13) . .
C70 C48 Lu5 72.99(14) . .
C47 C48 Lu5 76.67(12) . .
C49 C48 Lu6 92.77(16) . .
C70 C48 Lu6 56.87(15) . .
C47 C48 Lu6 77.90(17) . .
Lu5 C48 Lu6 16.51(11) . .
C49 C48 Lu4 52.22(10) . .
C70 C48 Lu4 92.65(8) . .
C47 C48 Lu4 91.32(12) . .
Lu5 C48 Lu4 27.05(14) . .
Lu6 C48 Lu4 41.76(17) . .
C49 C48 Lu11 73.1(4) . .
C70 C48 Lu11 64.1(4) . .
C47 C48 Lu11 97.3(3) . .
Lu5 C48 Lu11 21.2(3) . .
Lu6 C48 Lu11 22.7(4) . .
Lu4 C48 Lu11 28.6(4) . .
C50 C49 C48 122.3 . .
C50 C49 C25 104.9 . .
C48 C49 C25 122.2 . .
C50 C49 Lu4 70.62(15) . .
C48 C49 Lu4 95.40(15) . .
C25 C49 Lu4 69.11(12) . .
C50 C49 Lu5 87.04(11) . .
C48 C49 Lu5 65.54(11) . .
C25 C49 Lu5 87.46(13) . .
Lu4 C49 Lu5 29.88(17) . .
C50 C49 Lu8 85.05(16) . .
C48 C49 Lu8 96.62(12) . .
C25 C49 Lu8 53.65(14) . .
Lu4 C49 Lu8 17.81(17) . .
Lu5 C49 Lu8 36.23(15) . .
C50 C49 Lu11 64.4(3) . .
C48 C49 Lu11 77.4(4) . .
C25 C49 Lu11 97.4(4) . .
Lu4 C49 Lu11 28.5(4) . .
Lu5 C49 Lu11 23.1(3) . .
Lu8 C49 Lu11 44.2(4) . .
C50 C49 Lu3 63.44(8) . .
C48 C49 Lu3 103.01(6) . .
C25 C49 Lu3 68.42(8) . .
Lu4 C49 Lu3 8.50(15) . .
Lu5 C49 Lu3 37.56(11) . .
Lu8 C49 Lu3 22.30(16) . .
Lu11 C49 Lu3 31.4(4) . .
C50 C49 Lu12 52.7(4) . .
C48 C49 Lu12 105.3(5) . .
C25 C49 Lu12 76.9(4) . .
Lu4 C49 Lu12 18.0(4) . .
Lu5 C49 Lu12 42.0(5) . .
Lu8 C49 Lu12 33.6(4) . .
Lu11 C49 Lu12 28.7(6) . .
Lu3 C49 Lu12 11.3(4) . .
C49 C50 C51 114.2 . .
C49 C50 C28 128.6 . .
C51 C50 C28 106.3 . .
C49 C50 Lu4 72.50(15) . .
C51 C50 Lu4 91.03(11) . .
C28 C50 Lu4 76.54(16) . .
C49 C50 Lu12 99.9(6) . .
C51 C50 Lu12 80.4(6) . .
C28 C50 Lu12 56.6(6) . .
Lu4 C50 Lu12 27.5(6) . .
C49 C50 Lu11 87.1(4) . .
C51 C50 Lu11 58.1(4) . .
C28 C50 Lu11 88.5(4) . .
Lu4 C50 Lu11 33.0(4) . .
Lu12 C50 Lu11 33.4(7) . .
C49 C50 Lu3 88.68(9) . .
C51 C50 Lu3 88.71(8) . .
C28 C50 Lu3 61.30(8) . .
Lu4 C50 Lu3 16.90(14) . .
Lu12 C50 Lu3 12.0(6) . .
Lu11 C50 Lu3 35.1(4) . .
C49 C50 Lu5 63.71(10) . .
C51 C50 Lu5 75.05(12) . .
C28 C50 Lu5 99.76(10) . .
Lu4 C50 Lu5 25.23(16) . .
Lu12 C50 Lu5 44.4(6) . .
Lu11 C50 Lu5 23.8(4) . .
Lu3 C50 Lu5 38.52(10) . .
C71 C51 C50 126.3 . .
C71 C51 C52 121.4 . .
C50 C51 C52 103.2 . .
C71 C51 Lu11 71.4(5) . .
C50 C51 Lu11 87.2(6) . .
C52 C51 Lu11 83.2(5) . .
C71 C51 Lu12 105.3(5) . .
C50 C51 Lu12 65.2(6) . .
C52 C51 Lu12 66.2(6) . .
Lu11 C51 Lu12 34.0(7) . .
C71 C51 Lu4 94.04(12) . .
C50 C51 Lu4 54.86(8) . .
C52 C51 Lu4 90.35(12) . .
Lu11 C51 Lu4 32.4(6) . .
Lu12 C51 Lu4 24.2(6) . .
C71 C51 Lu5 67.69(11) . .
C50 C51 Lu5 74.41(11) . .
C52 C51 Lu5 103.59(9) . .
Lu11 C51 Lu5 22.1(5) . .
Lu12 C51 Lu5 43.2(5) . .
Lu4 C51 Lu5 26.36(14) . .
C71 C51 Lu6 55.19(12) . .
C50 C51 Lu6 89.65(16) . .
C52 C51 Lu6 101.94(12) . .
Lu11 C51 Lu6 20.0(5) . .
Lu12 C51 Lu6 51.3(5) . .
Lu4 C51 Lu6 40.05(17) . .
Lu5 C51 Lu6 15.32(12) . .
C71 C51 Lu3 100.95(6) . .
C50 C51 Lu3 61.58(7) . .
C52 C51 Lu3 74.69(8) . .
Lu11 C51 Lu3 30.9(6) . .
Lu12 C51 Lu3 8.5(6) . .
Lu4 C51 Lu3 15.71(10) . .
Lu5 C51 Lu3 36.00(10) . .
Lu6 C51 Lu3 45.91(12) . .
C53 C52 C29 132.9 . .
C53 C52 C51 109.4 . .
C29 C52 C51 110.0 . .
C53 C52 Lu12 104.5(7) . .
C29 C52 Lu12 60.6(6) . .
C51 C52 Lu12 78.0(6) . .
C53 C52 Lu11 84.2(5) . .
C29 C52 Lu11 94.2(5) . .
C51 C52 Lu11 59.6(4) . .
Lu12 C52 Lu11 33.8(7) . .
C53 C52 Lu3 105.02(7) . .
C29 C52 Lu3 62.31(6) . .
C51 C52 Lu3 75.25(9) . .
Lu12 C52 Lu3 2.7(6) . .
Lu11 C52 Lu3 31.9(5) . .
C52 C53 C54 120.2 . .
C52 C53 C73 134.2 . .
C54 C53 C73 96.0 . .
C52 C53 Lu11 67.9(5) . .
C54 C53 Lu11 106.5(3) . .
C73 C53 Lu11 75.9(5) . .
C52 C53 Lu12 51.1(5) . .
C54 C53 Lu12 94.7(5) . .
C73 C53 Lu12 103.0(5) . .
Lu11 C53 Lu12 28.7(6) . .
C55 C54 C53 133.0 . .
C55 C54 C31 106.6 . .
C53 C54 C31 109.2 . .
C56 C55 C54 108.0 . .
C56 C55 C33 133.3 . .
C54 C55 C33 107.3 . .
C56 C55 Lu15 62.1(6) . .
C54 C55 Lu15 97.8(6) . .
C33 C55 Lu15 83.7(5) . .
C74 C56 C55 136.0 . .
C74 C56 C57 121.7 . .
C55 C56 C57 97.6 . .
C74 C56 Lu15 88.7(6) . .
C55 C56 Lu15 91.1(7) . .
C57 C56 Lu15 65.3(5) . .
C74 C56 Lu14 57.5(4) . .
C55 C56 Lu14 104.1(4) . .
C57 C56 Lu14 94.8(6) . .
Lu15 C56 Lu14 33.9(7) . .
C74 C56 Lu1 61.20(9) . .
C55 C56 Lu1 113.34(8) . .
C57 C56 Lu1 80.07(10) . .
Lu15 C56 Lu1 27.8(7) . .
Lu14 C56 Lu1 16.5(6) . .
C56 C57 C76 100.2 . .
C56 C57 C58 136.6 . .
C76 C57 C58 111.3 . .
C56 C57 Lu15 80.21(18) . .
C76 C57 Lu15 74.6(8) . .
C58 C57 Lu15 80.4(4) . .
C34 C58 C59 105.4 . .
C34 C58 C57 120.3 . .
C59 C58 C57 124.9 . .
C34 C58 Lu15 93.6(7) . .
C59 C58 Lu15 85.8(4) . .
C57 C58 Lu15 63.6(5) . .
C37 C59 C58 127.6 . .
C37 C59 C60 102.4 . .
C58 C59 C60 117.6 . .
C37 C59 Lu15 99.0(6) . .
C58 C59 Lu15 63.1(6) . .
C60 C59 Lu15 75.8(6) . .
C77 C60 C61 126.1 . .
C77 C60 C59 120.4 . .
C61 C60 C59 107.6 . .
C77 C60 Lu15 70.0(5) . .
C61 C60 Lu15 104.3(6) . .
C59 C60 Lu15 73.7(6) . .
C62 C61 C60 105.9 . .
C62 C61 C38 124.8 . .
C60 C61 C38 112.8 . .
C79 C62 C61 141.1 . .
C79 C62 C63 102.8 . .
C61 C62 C63 111.2 . .
C79 C62 Lu13 68.8(5) . .
C61 C62 Lu13 105.3(4) . .
C63 C62 Lu13 70.1(5) . .
C79 C62 Lu10 55.4(3) . .
C61 C62 Lu10 104.4(4) . .
C63 C62 Lu10 91.3(5) . .
Lu13 C62 Lu10 22.3(6) . .
C64 C63 C40 115.0 . .
C64 C63 C62 112.3 . .
C40 C63 C62 124.4 . .
C64 C63 Lu13 70.2(4) . .
C40 C63 Lu13 98.2(4) . .
C62 C63 Lu13 72.1(5) . .
C63 C64 C65 137.7 . .
C63 C64 C43 123.8 . .
C65 C64 C43 90.5 . .
C63 C64 Lu13 77.1(5) . .
C65 C64 Lu13 74.8(5) . .
C43 C64 Lu13 96.7(5) . .
C63 C64 Lu7 100.23(12) . .
C65 C64 Lu7 56.81(10) . .
C43 C64 Lu7 82.35(15) . .
Lu13 C64 Lu7 23.2(5) . .
C80 C65 C64 113.0 . .
C80 C65 C66 105.4 . .
C64 C65 C66 127.6 . .
C80 C65 Lu7 74.55(17) . .
C64 C65 Lu7 90.00(10) . .
C66 C65 Lu7 67.12(14) . .
C80 C65 Lu13 70.8(5) . .
C64 C65 Lu13 69.0(5) . .
C66 C65 Lu13 92.9(4) . .
Lu7 C65 Lu13 26.3(4) . .
C80 C65 Lu10 51.7(3) . .
C64 C65 Lu10 90.74(15) . .
C66 C65 Lu10 86.2(3) . .
Lu7 C65 Lu10 25.1(4) . .
Lu13 C65 Lu10 23.4(5) . .
C44 C66 C65 92.3 . .
C44 C66 C67 121.0 . .
C65 C66 C67 137.5 . .
C44 C66 Lu7 90.80(15) . .
C65 C66 Lu7 71.52(12) . .
C67 C66 Lu7 81.66(9) . .
C44 C66 Lu13 87.0(4) . .
C65 C66 Lu13 54.9(3) . .
C67 C66 Lu13 98.1(4) . .
Lu7 C66 Lu13 17.3(3) . .
C47 C67 C68 140.7 . .
C47 C67 C66 112.8 . .
C68 C67 C66 92.6 . .
C47 C67 Lu7 96.80(14) . .
C68 C67 Lu7 69.89(15) . .
C66 C67 Lu7 59.76(10) . .
C47 C67 Lu6 76.8(2) . .
C68 C67 Lu6 68.29(18) . .
C66 C67 Lu6 103.08(15) . .
Lu7 C67 Lu6 43.44(16) . .
C47 C67 Lu5 62.27(10) . .
C68 C67 Lu5 83.99(11) . .
C66 C67 Lu5 102.44(10) . .
Lu7 C67 Lu5 46.65(11) . .
Lu6 C67 Lu5 15.72(14) . .
C69 C68 C81 109.8 . .
C69 C68 C67 101.3 . .
C81 C68 C67 141.9 . .
C69 C68 Lu7 102.80(11) . .
C81 C68 Lu7 77.55(14) . .
C67 C68 Lu7 74.46(16) . .
C69 C68 Lu6 57.96(15) . .
C81 C68 Lu6 99.52(18) . .
C67 C68 Lu6 78.53(18) . .
Lu7 C68 Lu6 45.46(16) . .
C69 C68 Lu10 91.7(3) . .
C81 C68 Lu10 56.9(3) . .
C67 C68 Lu10 101.7(5) . .
Lu7 C68 Lu10 28.0(5) . .
Lu6 C68 Lu10 46.4(3) . .
C69 C68 Lu9 73.3(2) . .
C81 C68 Lu9 61.7(2) . .
C67 C68 Lu9 109.2(2) . .
Lu7 C68 Lu9 42.1(2) . .
Lu6 C68 Lu9 37.8(3) . .
Lu10 C68 Lu9 18.9(4) . .
C68 C69 C70 123.0 . .
C68 C69 C84 122.8 . .
C70 C69 C84 109.3 . .
C68 C69 Lu6 89.1(2) . .
C70 C69 Lu6 70.7(2) . .
C84 C69 Lu6 87.5(2) . .
C68 C69 Lu9 75.96(17) . .
C70 C69 Lu9 109.6(2) . .
C84 C69 Lu9 65.64(18) . .
Lu6 C69 Lu9 40.1(3) . .
C68 C69 Lu5 89.09(10) . .
C70 C69 Lu5 60.95(9) . .
C84 C69 Lu5 97.85(10) . .
Lu6 C69 Lu5 12.3(2) . .
Lu9 C69 Lu5 51.7(2) . .
C68 C69 Lu14 96.7(5) . .
C70 C69 Lu14 93.2(6) . .
C84 C69 Lu14 56.6(4) . .
Lu6 C69 Lu14 32.9(5) . .
Lu9 C69 Lu14 21.7(5) . .
Lu5 C69 Lu14 45.0(5) . .
C68 C69 Lu1 83.29(11) . .
C70 C69 Lu1 108.69(8) . .
C84 C69 Lu1 57.97(10) . .
Lu6 C69 Lu1 42.1(2) . .
Lu9 C69 Lu1 8.09(19) . .
Lu5 C69 Lu1 54.24(10) . .
Lu14 C69 Lu1 16.6(5) . .
C68 C69 Lu11 106.9(3) . .
C70 C69 Lu11 62.0(4) . .
C84 C69 Lu11 77.2(4) . .
Lu6 C69 Lu11 17.8(3) . .
Lu9 C69 Lu11 48.1(4) . .
Lu5 C69 Lu11 22.1(4) . .
Lu14 C69 Lu11 32.0(7) . .
Lu1 C69 Lu11 46.7(4) . .
C69 C70 C71 106.0 . .
C69 C70 C48 135.0 . .
C71 C70 C48 105.5 . .
C69 C70 Lu6 70.5(2) . .
C71 C70 Lu6 78.56(19) . .
C48 C70 Lu6 85.3(2) . .
C69 C70 Lu5 87.07(12) . .
C71 C70 Lu5 80.80(12) . .
C48 C70 Lu5 67.22(12) . .
Lu6 C70 Lu5 18.43(19) . .
C69 C70 Lu11 88.8(4) . .
C71 C70 Lu11 56.3(4) . .
C48 C70 Lu11 82.6(5) . .
Lu6 C70 Lu11 24.7(4) . .
Lu5 C70 Lu11 25.2(4) . .
C51 C71 C72 119.3 . .
C51 C71 C70 125.3 . .
C72 C71 C70 107.8 . .
C51 C71 Lu11 70.7(5) . .
C72 C71 Lu11 83.3(6) . .
C70 C71 Lu11 89.8(5) . .
C51 C71 Lu6 95.52(19) . .
C72 C71 Lu6 81.6(2) . .
C70 C71 Lu6 64.23(14) . .
Lu11 C71 Lu6 28.0(5) . .
C51 C71 Lu5 82.03(11) . .
C72 C71 Lu5 97.03(11) . .
C70 C71 Lu5 65.34(10) . .
Lu11 C71 Lu5 25.3(5) . .
Lu6 C71 Lu5 16.85(17) . .
C51 C71 Lu14 98.2(4) . .
C72 C71 Lu14 52.8(4) . .
C70 C71 Lu14 88.5(4) . .
Lu11 C71 Lu14 33.0(7) . .
Lu6 C71 Lu14 31.6(5) . .
Lu5 C71 Lu14 44.8(5) . .
C73 C72 C71 123.5 . .
C73 C72 C84 120.1 . .
C71 C72 C84 110.0 . .
C73 C72 Lu14 75.7(6) . .
C71 C72 Lu14 98.0(7) . .
C84 C72 Lu14 72.0(5) . .
C73 C72 Lu11 86.9(4) . .
C71 C72 Lu11 61.6(4) . .
C84 C72 Lu11 97.3(4) . .
Lu14 C72 Lu11 38.7(8) . .
C73 C72 Lu6 105.33(12) . .
C71 C72 Lu6 65.24(19) . .
C84 C72 Lu6 73.03(19) . .
Lu14 C72 Lu6 35.6(7) . .
Lu11 C72 Lu6 25.4(4) . .
C73 C72 Lu1 79.89(11) . .
C71 C72 Lu1 106.77(8) . .
C84 C72 Lu1 59.54(9) . .
Lu14 C72 Lu1 13.7(6) . .
Lu11 C72 Lu1 51.0(4) . .
Lu6 C72 Lu1 41.68(19) . .
C73 C72 Lu9 89.75(13) . .
C71 C72 Lu9 99.91(18) . .
C84 C72 Lu9 54.34(16) . .
Lu14 C72 Lu9 18.1(5) . .
Lu11 C72 Lu9 49.2(4) . .
Lu6 C72 Lu9 34.9(3) . .
Lu1 C72 Lu9 10.01(13) . .
C72 C73 C74 108.0 . .
C72 C73 C53 110.9 . .
C74 C73 C53 135.5 . .
C72 C73 Lu14 71.1(6) . .
C74 C73 Lu14 73.2(7) . .
C53 C73 Lu14 99.8(5) . .
C72 C73 Lu11 63.8(4) . .
C74 C73 Lu11 108.3(4) . .
C53 C73 Lu11 71.8(4) . .
Lu14 C73 Lu11 35.4(8) . .
C72 C73 Lu1 73.60(10) . .
C74 C73 Lu1 60.87(8) . .
C53 C73 Lu1 111.10(7) . .
Lu14 C73 Lu1 12.9(7) . .
Lu11 C73 Lu1 48.2(4) . .
C56 C74 C73 110.8 . .
C56 C74 C75 100.9 . .
C73 C74 C75 137.4 . .
C56 C74 Lu14 96.1(6) . .
C73 C74 Lu14 73.1(7) . .
C75 C74 Lu14 76.0(6) . .
C56 C74 Lu1 93.74(11) . .
C73 C74 Lu1 91.40(10) . .
C75 C74 Lu1 58.09(9) . .
Lu14 C74 Lu1 18.8(7) . .
C56 C74 Lu15 64.7(7) . .
C73 C74 Lu15 97.4(6) . .
C75 C74 Lu15 70.9(6) . .
Lu14 C74 Lu15 34.3(9) . .
Lu1 C74 Lu15 29.3(7) . .
C56 C74 Lu9 100.94(18) . .
C73 C74 Lu9 88.0(2) . .
C75 C74 Lu9 57.88(19) . .
Lu14 C74 Lu9 18.3(6) . .
Lu1 C74 Lu9 7.3(2) . .
Lu15 C74 Lu9 36.4(7) . .
C74 C75 C83 112.7 . .
C74 C75 C76 116.5 . .
C83 C75 C76 121.4 . .
C74 C75 Lu1 89.22(13) . .
C83 C75 Lu1 66.68(13) . .
C76 C75 Lu1 84.06(13) . .
C74 C75 Lu14 70.3(6) . .
C83 C75 Lu14 70.8(5) . .
C76 C75 Lu14 97.8(6) . .
Lu1 C75 Lu14 19.8(6) . .
C74 C75 Lu9 94.0(2) . .
C83 C75 Lu9 56.92(18) . .
C76 C75 Lu9 89.6(3) . .
Lu1 C75 Lu9 9.8(2) . .
Lu14 C75 Lu9 23.8(6) . .
C74 C75 Lu15 79.6(5) . .
C83 C75 Lu15 97.3(7) . .
C76 C75 Lu15 63.8(5) . .
Lu1 C75 Lu15 30.8(8) . .
Lu14 C75 Lu15 35.4(8) . .
Lu9 C75 Lu15 40.4(7) . .
C77 C76 C75 124.1 . .
C77 C76 C57 126.7 . .
C75 C76 C57 100.4 . .
C77 C76 Lu15 87.5(5) . .
C75 C76 Lu15 83.8(3) . .
C57 C76 Lu15 68.1(8) . .
C77 C76 Lu1 84.01(12) . .
C75 C76 Lu1 60.78(11) . .
C57 C76 Lu1 95.48(11) . .
Lu15 C76 Lu1 32.4(7) . .
C77 C76 Lu9 79.54(19) . .
C75 C76 Lu9 60.3(2) . .
C57 C76 Lu9 102.54(14) . .
Lu15 C76 Lu9 38.4(7) . .
Lu1 C76 Lu9 7.07(19) . .
C78 C77 C76 117.3 . .
C78 C77 C60 111.0 . .
C76 C77 C60 118.6 . .
C78 C77 Lu1 69.75(11) . .
C76 C77 Lu1 64.55(11) . .
C60 C77 Lu1 102.07(9) . .
C78 C77 Lu15 94.8(7) . .
C76 C77 Lu15 61.0(5) . .
C60 C77 Lu15 79.9(3) . .
Lu1 C77 Lu15 28.9(6) . .
C77 C78 C82 112.9 . .
C77 C78 C79 135.3 . .
C82 C78 C79 107.4 . .
C77 C78 Lu10 102.2(6) . .
C82 C78 Lu10 72.49(16) . .
C79 C78 Lu10 71.8(5) . .
C77 C78 Lu9 91.54(14) . .
C82 C78 Lu9 61.9(2) . .
C79 C78 Lu9 90.61(17) . .
Lu10 C78 Lu9 19.1(4) . .
C77 C78 Lu1 80.47(12) . .
C82 C78 Lu1 65.69(10) . .
C79 C78 Lu1 99.56(11) . .
Lu10 C78 Lu1 27.9(5) . .
Lu9 C78 Lu1 11.18(13) . .
C77 C78 Lu13 105.4(3) . .
C82 C78 Lu13 91.9(4) . .
C79 C78 Lu13 53.8(3) . .
Lu10 C78 Lu13 22.4(4) . .
Lu9 C78 Lu13 40.7(4) . .
Lu1 C78 Lu13 47.1(3) . .
C62 C79 C80 140.4 . .
C62 C79 C78 100.5 . .
C80 C79 C78 105.5 . .
C62 C79 Lu13 77.5(5) . .
C80 C79 Lu13 71.2(5) . .
C78 C79 Lu13 94.5(4) . .
C62 C79 Lu10 96.3(3) . .
C80 C79 Lu10 65.4(5) . .
C78 C79 Lu10 71.3(6) . .
Lu13 C79 Lu10 27.5(5) . .
C62 C79 Lu7 97.19(9) . .
C80 C79 Lu7 51.49(10) . .
C78 C79 Lu7 95.47(11) . .
Lu13 C79 Lu7 20.2(5) . .
Lu10 C79 Lu7 24.7(6) . .
C65 C80 C81 135.6 . .
C65 C80 C79 109.2 . .
C81 C80 C79 109.7 . .
C65 C80 Lu10 101.0(6) . .
C81 C80 Lu10 68.2(2) . .
C79 C80 Lu10 77.1(4) . .
C65 C80 Lu7 71.80(15) . .
C81 C80 Lu7 82.67(11) . .
C79 C80 Lu7 97.55(13) . .
Lu10 C80 Lu7 31.5(6) . .
C65 C80 Lu13 77.1(5) . .
C81 C80 Lu13 96.1(5) . .
C79 C80 Lu13 71.2(5) . .
Lu10 C80 Lu13 28.5(5) . .
Lu7 C80 Lu13 26.8(5) . .
C65 C80 Lu9 111.63(19) . .
C81 C80 Lu9 54.7(2) . .
C79 C80 Lu9 82.1(2) . .
Lu10 C80 Lu9 13.6(3) . .
Lu7 C80 Lu9 39.9(2) . .
Lu13 C80 Lu9 42.0(5) . .
C68 C81 C82 141.7 . .
C68 C81 C80 105.5 . .
C82 C81 C80 105.4 . .
C68 C81 Lu10 88.9(5) . .
C82 C81 Lu10 79.3(7) . .
C80 C81 Lu10 72.7(4) . .
C68 C81 Lu9 85.0(3) . .
C82 C81 Lu9 70.8(2) . .
C80 C81 Lu9 94.2(2) . .
Lu10 C81 Lu9 21.6(5) . .
C68 C81 Lu7 68.55(11) . .
C82 C81 Lu7 107.79(13) . .
C80 C81 Lu7 62.20(9) . .
Lu10 C81 Lu7 28.6(7) . .
Lu9 C81 Lu7 43.8(2) . .
C68 C81 Lu1 91.16(9) . .
C82 C81 Lu1 62.91(9) . .
C80 C81 Lu1 97.40(11) . .
Lu10 C81 Lu1 26.4(5) . .
Lu9 C81 Lu1 8.0(2) . .
Lu7 C81 Lu1 51.16(14) . .
C68 C81 Lu13 90.1(4) . .
C82 C81 Lu13 90.7(4) . .
C80 C81 Lu13 53.2(3) . .
Lu10 C81 Lu13 20.1(5) . .
Lu9 C81 Lu13 41.6(4) . .
Lu7 C81 Lu13 21.5(4) . .
Lu1 C81 Lu13 46.4(3) . .
C78 C82 C83 130.8 . .
C78 C82 C81 110.5 . .
C83 C82 C81 95.0 . .
C78 C82 Lu9 84.7(3) . .
C83 C82 Lu9 63.3(2) . .
C81 C82 Lu9 72.24(18) . .
C78 C82 Lu10 72.3(2) . .
C83 C82 Lu10 83.8(3) . .
C81 C82 Lu10 63.3(6) . .
Lu9 C82 Lu10 21.0(4) . .
C78 C82 Lu1 81.41(12) . .
C83 C82 Lu1 59.36(12) . .
C81 C82 Lu1 84.26(12) . .
Lu9 C82 Lu1 12.10(16) . .
Lu10 C82 Lu1 29.6(5) . .
C75 C83 C82 107.4 . .
C75 C83 C84 111.2 . .
C82 C83 C84 136.4 . .
C75 C83 Lu1 74.73(14) . .
C82 C83 Lu1 84.08(14) . .
C84 C83 Lu1 87.30(13) . .
C75 C83 Lu9 88.65(18) . .
C82 C83 Lu9 78.8(3) . .
C84 C83 Lu9 82.7(3) . .
Lu1 C83 Lu9 13.95(17) . .
C75 C83 Lu14 75.1(6) . .
C82 C83 Lu14 103.1(6) . .
C84 C83 Lu14 69.2(7) . .
Lu1 C83 Lu14 20.1(6) . .
Lu9 C83 Lu14 25.3(6) . .
C75 C83 Lu10 97.6(5) . .
C82 C83 Lu10 63.4(2) . .
C84 C83 Lu10 91.9(3) . .
Lu1 C83 Lu10 26.8(4) . .
Lu9 C83 Lu10 16.1(3) . .
Lu14 C83 Lu10 41.3(6) . .
C72 C84 C69 106.1 . .
C72 C84 C83 128.2 . .
C69 C84 C83 114.1 . .
C72 C84 Lu14 72.2(6) . .
C69 C84 Lu14 92.0(6) . .
C83 C84 Lu14 75.0(7) . .
C72 C84 Lu9 96.87(19) . .
C69 C84 Lu9 81.10(18) . .
C83 C84 Lu9 60.4(2) . .
Lu14 C84 Lu9 25.0(6) . .
C72 C84 Lu1 90.94(11) . .
C69 C84 Lu1 92.53(12) . .
C83 C84 Lu1 57.10(9) . .
Lu14 C84 Lu1 19.6(7) . .
Lu9 C84 Lu1 11.79(14) . .
C72 C84 Lu6 74.73(18) . .
C69 C84 Lu6 58.05(14) . .
C83 C84 Lu6 99.91(19) . .
Lu14 C84 Lu6 35.9(7) . .
Lu9 C84 Lu6 39.7(3) . .
Lu1 C84 Lu6 45.87(17) . .
N1A Ni1A N3A 177.76(18) . .
N1A Ni1A N2A 89.97(8) . 6
N3A Ni1A N2A 89.98(8) . 6
N1A Ni1A N2A 89.97(8) . .
N3A Ni1A N2A 89.98(8) . .
N2A Ni1A N2A 177.34(19) 6 .
C13A N2A C6A 104.3(3) . .
C13A N2A Ni1A 127.8(2) . .
C6A N2A Ni1A 127.9(2) . .
C3A C2A C1A 112.7(4) . .
C15A N3A C15A 104.3(4) . 6
C15A N3A Ni1A 127.8(2) . .
C15A N3A Ni1A 127.8(2) 6 .
C5A C4A N1A 125.3(3) . .
C5A C4A C3A 123.7(3) . .
N1A C4A C3A 111.0(3) . .
C4A C5A C6A 124.4(4) . .
C5A C6A N2A 124.6(4) . .
C5A C6A C7A 124.1(4) . .
N2A C6A C7A 111.3(3) . .
C10A C7A C6A 106.4(3) . .
C10A C7A C8A 129.3(4) . .
C6A C7A C8A 124.3(4) . .
C7A C8A C9A 112.6(4) . .
C7A C10A C13A 106.6(3) . .
C7A C10A C11A 129.0(4) . .
C13A C10A C11A 124.4(4) . .
C10A C11A C12A 113.2(4) . .
C14A C13A N2A 124.6(3) . .
C14A C13A C10A 123.9(4) . .
N2A C13A C10A 111.5(3) . .
C15A C14A C13A 124.5(4) . .
C14A C15A N3A 125.3(3) . .
C14A C15A C16A 123.4(3) . .
N3A C15A C16A 111.3(3) . .
C16A C16A C15A 106.5(2) 6 .
C16A C16A C17A 128.8(2) 6 .
C15A C16A C17A 124.5(4) . .
C16A C17A C18A 112.0(3) . .
C3A C3A C4A 106.8(2) 6 .
C3A C3A C2A 128.9(2) 6 .
C4A C3A C2A 124.1(4) . .
C4A N1A C4A 104.3(4) 6 .
C4A N1A Ni1A 127.8(2) 6 .
C4A N1A Ni1A 127.8(2) . .
C2B C1B C6B 121.5(9) . .
C3B C2B C1B 119.6(8) . .
C2B C3B C4B 120.0(7) . .
C5B C4B C3B 121.3(7) . .
C4B C5B C6B 119.1(8) . .
C5B C6B C1B 118.6(8) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Lu1 Lu9 0.513(6) .
Lu1 Lu14 0.84(3) .
Lu1 Lu10 1.24(2) .
Lu1 Lu1 1.301(7) 6
Lu1 Lu15 1.39(3) .
Lu1 Lu9 1.420(8) 6
Lu1 Lu13 1.614(17) 6
Lu1 Lu6 1.978(9) .
Lu1 Lu14 2.01(3) 6
Lu1 C83 2.106(4) .
Lu1 C75 2.212(4) .
Lu1 Lu13 2.218(18) .
Lu2 Lu2 1.234(4) 6
Lu2 Lu3 1.333(4) .
Lu2 Lu12 1.36(2) .
Lu2 Lu8 2.126(7) .
Lu2 Lu4 2.148(5) .
Lu2 C11 2.246(2) .
Lu2 Lu3 2.253(4) 6
Lu2 Lu11 2.273(17) .
Lu2 C12 2.367(3) .
Lu2 C10 2.423(3) .
Lu2 Lu12 2.48(2) 6
Lu2 C30 2.561(3) .
Lu3 Lu12 0.573(19) .
Lu3 Lu4 0.832(4) .
Lu3 Lu8 1.109(8) .
Lu3 Lu11 1.56(2) .
Lu3 Lu5 1.779(5) .
Lu3 C27 2.120(3) .
Lu3 Lu2 2.253(4) 6
Lu3 Lu6 2.276(7) .
Lu3 C28 2.307(4) .
Lu3 Lu8 2.393(7) 6
Lu3 C10 2.463(3) .
Lu4 Lu8 1.008(8) .
Lu4 Lu12 1.08(3) .
Lu4 Lu5 1.241(6) .
Lu4 Lu11 1.40(2) .
Lu4 Lu6 1.898(9) .
Lu4 C50 2.133(5) .
Lu4 C49 2.157(4) .
Lu4 C25 2.161(4) .
Lu4 C27 2.265(5) .
Lu4 C26 2.313(4) .
Lu5 Lu6 0.761(6) .
Lu5 Lu11 1.121(19) .
Lu5 Lu13 1.53(2) 6
Lu5 Lu8 1.678(8) .
Lu5 Lu12 1.97(2) .
Lu5 Lu14 2.11(3) .
Lu5 Lu7 2.123(5) .
Lu5 C48 2.307(4) .
Lu5 Lu9 2.338(11) .
Lu5 C70 2.393(5) .
Lu6 Lu13 1.035(19) 6
Lu6 Lu11 1.119(18) .
Lu6 Lu14 1.52(3) .
Lu6 Lu9 1.697(13) .
Lu6 Lu7 1.941(8) .
Lu6 Lu10 2.040(12) .
Lu6 C69 2.181(6) .
Lu6 C70 2.184(6) .
Lu7 Lu13 1.071(19) .
Lu7 Lu13 1.071(19) 6
Lu7 Lu10 1.23(3) .
Lu7 Lu9 1.843(9) .
Lu7 Lu9 1.843(9) 6
Lu7 Lu6 1.941(8) 6
Lu7 Lu5 2.123(5) 6
Lu7 C66 2.188(5) .
Lu7 C65 2.252(5) .
Lu7 C80 2.285(5) .
Lu8 Lu12 1.66(2) .
Lu8 Lu8 1.682(14) 6
Lu8 Lu11 2.13(2) .
Lu8 C26 2.203(5) .
Lu8 C8 2.254(6) .
Lu8 C25 2.270(5) .
Lu8 Lu3 2.393(7) 6
Lu9 Lu10 0.864(17) .
Lu9 Lu14 1.03(2) .
Lu9 Lu13 1.15(2) 6
Lu9 Lu9 1.35(2) 6
Lu9 Lu1 1.420(8) 6
Lu9 Lu15 1.82(3) .
Lu9 Lu13 1.93(2) .
Lu9 C83 2.120(10) .
Lu9 Lu14 2.13(3) 6
Lu10 Lu9 0.864(17) 6
Lu10 Lu13 1.13(2) 6
Lu10 Lu13 1.13(2) .
Lu10 Lu1 1.24(2) 6
Lu10 Lu14 1.81(3) 6
Lu10 Lu14 1.81(3) .
Lu10 Lu6 2.040(12) 6
Lu10 C81 2.184(13) .
Lu11 Lu12 1.43(3) .
Lu11 Lu14 1.60(3) .
Lu11 Lu13 2.04(3) 6
Lu11 C51 2.180(14) .
Lu11 C71 2.189(15) .
Lu12 C28 1.99(2) .
Lu12 C27 2.08(3) .
Lu12 C29 2.08(2) .
Lu12 C50 2.35(2) .
Lu12 C52 2.385(19) .
Lu13 Lu6 1.035(19) 6
Lu13 Lu9 1.15(2) 6
Lu13 Lu5 1.53(2) 6
Lu13 Lu1 1.614(17) 6
Lu13 Lu14 1.66(3) 6
Lu13 Lu13 1.78(4) 6
Lu13 Lu11 2.04(3) 6
Lu13 C64 2.329(14) .
Lu14 Lu15 1.59(3) .
Lu14 Lu13 1.66(3) 6
Lu14 Lu1 2.01(3) 6
Lu14 Lu9 2.13(3) 6
Lu14 C84 2.333(19) .
Lu14 C72 2.34(2) .
Lu15 Lu1 1.39(3) 6
Lu15 Lu14 1.59(3) 6
Lu15 Lu9 1.82(3) 6
Lu15 C57 2.35(4) .
Lu15 C76 2.44(4) .
Lu15 C56 2.55(3) .
Lu15 C58 2.58(3) .
Lu15 Lu13 2.70(4) 6
C1 C9 1.2880 .
C1 C10 1.3160 .
C1 C2 1.4391 .
C2 C12 1.3492 .
C2 C3 1.6046 .
C3 C15 1.3199 .
C3 C4 1.3424 .
C4 C18 1.3206 .
C4 C5 1.3752 .
C5 C6 1.3102 .
C5 C9 1.3169 .
C6 C20 1.2618 .
C6 C7 1.3491 .
C6 C9 1.9950 .
C7 C8 1.3535 .
C7 C23 1.3776 .
C8 C26 1.3372 .
C8 C9 1.3834 .
C10 C27 1.3436 .
C10 C11 1.3513 .
C10 C28 2.0257 .
C11 C12 1.3414 .
C11 C30 1.5393 .
C12 C13 1.4111 .
C13 C14 1.3493 .
C13 C32 1.4547 .
C14 C35 1.4171 .
C14 C15 1.4293 .
C15 C16 1.4329 .
C16 C36 1.4263 .
C16 C17 1.7469 .
C17 C39 1.4943 .
C17 C18 1.5958 .
C18 C19 1.2783 .
C19 C20 1.2556 .
C19 C41 1.6152 .
C20 C21 1.4687 .
C21 C42 1.3275 .
C21 C22 1.4868 .
C22 C23 1.4216 .
C22 C45 1.4770 .
C23 C24 1.1395 .
C24 C46 1.5055 .
C24 C25 1.5534 .
C25 C26 1.3460 .
C25 C49 1.5509 .
C26 C27 1.3845 .
C27 C28 1.1946 .
C28 C29 1.3612 .
C28 C50 1.6154 .
C29 C52 1.2761 .
C29 C30 1.4342 .
C30 C31 1.2618 .
C31 C32 1.5248 .
C31 C54 1.5770 .
C32 C33 1.5163 .
C33 C55 1.5377 .
C33 C34 1.5711 .
C34 C35 1.4105 .
C34 C58 1.4680 .
C35 C36 1.4518 .
C36 C37 1.2488 .
C37 C59 1.4814 .
C37 C38 1.5131 .
C38 C39 1.4553 .
C38 C61 1.5325 .
C39 C40 1.5151 .
C40 C63 1.3622 .
C40 C41 1.4305 .
C41 C42 1.2585 .
C42 C43 1.2591 .
C43 C44 1.4667 .
C43 C64 1.7837 .
C44 C45 1.2912 .
C44 C66 1.4644 .
C45 C46 1.2431 .
C46 C47 1.4719 .
C47 C67 1.3971 .
C47 C48 1.6070 .
C48 C49 1.4614 .
C48 C70 1.6014 .
C49 C50 1.3572 .
C50 C51 1.4632 .
C51 C71 1.4167 .
C51 C52 1.5285 .
C52 C53 1.2663 .
C53 C54 1.5061 .
C53 C73 1.5157 .
C54 C55 1.4834 .
C55 C56 1.2993 .
C56 C74 1.2600 .
C56 C57 1.4636 .
C57 C76 1.5346 .
C57 C58 1.5387 .
C58 C59 1.4966 .
C59 C60 1.5266 .
C60 C77 1.4894 .
C60 C61 1.4972 .
C61 C62 1.4866 .
C62 C79 1.3858 .
C62 C63 1.5731 .
C63 C64 1.3365 .
C64 C65 1.4734 .
C65 C80 1.3133 .
C65 C66 1.5690 .
C66 C67 1.5788 .
C67 C68 1.5154 .
C68 C69 1.3974 .
C68 C81 1.4629 .
C69 C70 1.4497 .
C69 C84 1.4553 .
C70 C71 1.4668 .
C71 C72 1.4302 .
C72 C73 1.3522 .
C72 C84 1.4325 .
C73 C74 1.3884 .
C74 C75 1.4078 .
C75 C83 1.4304 .
C75 C76 1.4598 .
C76 C77 1.4564 .
C77 C78 1.3984 .
C78 C82 1.4511 .
C78 C79 1.5192 .
C79 C80 1.5019 .
C80 C81 1.4862 .
C81 C82 1.4828 .
C82 C83 1.4581 .
C83 C84 1.4600 .
Ni1A N1A 1.951(4) .
Ni1A N3A 1.957(4) .
Ni1A N2A 1.963(3) 6
Ni1A N2A 1.963(3) .
C1A C2A 1.531(6) .
N2A C13A 1.381(5) .
N2A C6A 1.384(5) .
C2A C3A 1.502(5) .
N3A C15A 1.375(4) .
N3A C15A 1.375(4) 6
C4A C5A 1.365(6) .
C4A N1A 1.382(5) .
C4A C3A 1.443(5) .
C5A C6A 1.373(5) .
C6A C7A 1.441(6) .
C7A C10A 1.366(6) .
C7A C8A 1.495(6) .
C8A C9A 1.535(8) .
C10A C13A 1.436(5) .
C10A C11A 1.504(6) .
C11A C12A 1.515(7) .
C13A C14A 1.374(5) .
C14A C15A 1.367(6) .
C15A C16A 1.443(5) .
C16A C16A 1.351(8) 6
C16A C17A 1.501(5) .
C17A C18A 1.523(6) .
C3A C3A 1.345(8) 6
N1A C4A 1.381(5) 6
C1B C2B 1.361(13) .
C1B C6B 1.397(16) .
C2B C3B 1.356(11) .
C3B C4B 1.391(10) .
C4B C5B 1.360(10) .
C5B C6B 1.394(13) .
