#------------------------------------------------------------------------------
#$Date: 2019-11-25 17:52:20 +0100 (lun 25 de nov de 2019) $
#$Revision: 241565 $
#$URL: svn://www.crystallography.net/cod/cif/4/13/13/4131342.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_4131342
loop_
_publ_author_name
'Shen, Wangqiang'
'Bao, Lipiao'
'Wu, Yongbo'
'Pan, Changwang'
'Zhao, Shasha'
'Fang, Hongyun'
'Xie, Yunpeng'
'Jin, Peng'
'Peng, Ping'
'Li, Fang-Fang'
'Lu, Xing'
_publ_section_title
;
 Lu₂@C₂ₙ (2n = 82, 84, 86): Crystallographic
 Evidence of Direct Lu-Lu Bonding between Two Divalent Lutetium Ions
 Inside Fullerene Cages.
;
_journal_issue                   29
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              9979
_journal_page_last               9984
_journal_paper_doi               10.1021/jacs.7b04421
_journal_volume                  139
_journal_year                    2017
_chemical_formula_moiety         'Lu2 C84, C36 H44 N4 Ni, 2(C H Cl3)'
_chemical_formula_sum            'C122 H45 Cl6 Lu2 N4 Ni S0'
_chemical_formula_weight         2187.97
_chemical_name_common            'Lu2@D2d-C84 Ni(OEP)'
_chemical_name_systematic        'Lu2@D2d-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'
_atom_sites_solution_hydrogens   geom
_audit_creation_method           SHELXL-2014/7
_cell_angle_alpha                90
_cell_angle_beta                 95.150(2)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   25.1184(18)
_cell_length_b                   15.5983(11)
_cell_length_c                   19.6259(13)
_cell_measurement_reflns_used    9974
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      25.407
_cell_measurement_theta_min      2.882
_cell_volume                     7658.5(9)
_computing_cell_refinement       'SAINT (Bruker, 2014)'
_computing_data_collection       'Apex2 (Bruker, 2014)'
_computing_data_reduction        'SAINT (Bruker, 2014)'
_computing_structure_refinement  'SHELXL-2014/7 (Sheldrick, 2014)'
_computing_structure_solution    'SHELXTL XT-2014/4 (Sheldrick, 2014)'
_diffrn_ambient_temperature      173(2)
_diffrn_detector_area_resol_mean 8.3
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.996
_diffrn_measurement_device_type  'Bruker D8 Quest'
_diffrn_measurement_method       ω
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0244
_diffrn_reflns_av_unetI/netI     0.0151
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.996
_diffrn_reflns_limit_h_max       30
_diffrn_reflns_limit_h_min       -30
_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            45170
_diffrn_reflns_point_group_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.996
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         25.440
_diffrn_reflns_theta_min         2.812
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    3.079
_exptl_absorpt_correction_T_max  0.7452
_exptl_absorpt_correction_T_min  0.5781
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            Black
_exptl_crystal_density_diffrn    1.898
_exptl_crystal_description       Block
_exptl_crystal_F_000             4308
_exptl_crystal_size_max          0.150
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.070
_refine_diff_density_max         2.082
_refine_diff_density_min         -1.468
_refine_diff_density_rms         0.148
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.034
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     860
_refine_ls_number_reflns         7346
_refine_ls_number_restraints     759
_refine_ls_restrained_S_all      1.104
_refine_ls_R_factor_all          0.1211
_refine_ls_R_factor_gt           0.1118
_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)+(0.1950P)²+91.2098P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.3046
_refine_ls_wR_factor_ref         0.3166
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6526
_reflns_number_total             7346
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            ja7b04421_si_004.cif
_cod_data_source_block           Lu2@D2d-C84
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_exptl_absorpt_correction_type' value 'Multi-scan' was
changed to 'multi-scan' in accordance with the
/home/saulius/struct/COD-crude-data/automatic-downloads/DataCite-retrospective/ACS/depositions/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 6909 2019-04-08 15:41:33Z antanas 
;
_cod_original_sg_symbol_H-M      'C 2/m'
_cod_database_code               4131342
_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   0.698
_shelx_estimated_absorpt_t_max   0.806
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 0.20817(10) 0.5000 -0.20862(17) 0.0470(6) Uani 0.2207 2 d S T P A 2
Lu2 Lu 0.20906(11) 0.5000 -0.41562(11) 0.0542(8) Uani 0.2043 2 d S T P A 2
Lu3 Lu 0.1643(2) 0.4118(5) -0.2826(5) 0.151(4) Uani 0.1105 1 d . . P A 2
Lu4 Lu 0.13233(19) 0.5000 -0.3310(6) 0.217(5) Uani 0.1718 2 d S T P A 2
Lu5 Lu 0.2781(3) 0.5366(4) -0.3501(6) 0.134(4) Uani 0.102 1 d . . P A 2
Lu6 Lu 0.2650(4) 0.5000 -0.3797(4) 0.050(2) Uani 0.0666 2 d S T P A 2
Lu7 Lu 0.1850(6) 0.4371(10) -0.2361(8) 0.222(6) Uani 0.1148 1 d . . P A 2
Lu8 Lu 0.2343(5) 0.5378(9) -0.3990(7) 0.222(6) Uani 0.094 1 d . . P A 2
Lu9 Lu 0.2695(8) 0.5864(13) -0.3298(7) 0.153(9) Uani 0.0562 1 d . . P A 2
Lu10 Lu 0.2033(5) 0.3794(8) -0.2715(8) 0.075(3) Uani 0.0341 1 d . . P A 2
Lu11 Lu 0.2178(10) 0.5000 -0.2147(6) 0.255(13) Uani 0.1376 2 d S T P A 2
Lu12 Lu 0.2769(10) 0.4614(12) -0.249(2) 0.220(18) Uani 0.0426 1 d . . P A 2
Lu13 Lu 0.2250(11) 0.3800(7) -0.3335(12) 0.150(9) Uani 0.0452 1 d . . P A 2
C1 C 0.0858(2) 0.3299(3) -0.2821(3) 0.146(6) Uani 0.5 1 d G U P B -1
C2 C 0.1310(2) 0.2864(3) -0.2535(3) 0.147(6) Uani 0.5 1 d G U P B -1
C3 C 0.1549(3) 0.2531(3) -0.3080(3) 0.133(6) Uani 0.5 1 d G U P B -1
C4 C 0.1263(2) 0.2815(3) -0.3674(3) 0.146(6) Uani 0.5 1 d G U P B -1
C5 C 0.08544(19) 0.3359(4) -0.3526(3) 0.137(6) Uani 0.5 1 d G U P B -1
C6 C 0.06262(16) 0.4032(4) -0.3914(3) 0.121(5) Uani 0.5 1 d G U P B -1
C7 C 0.04643(11) 0.4789(4) -0.3568(3) 0.117(5) Uani 0.5 1 d G U P B -1
C8 C 0.05482(12) 0.4748(4) -0.2848(3) 0.107(5) Uani 0.5 1 d G U P B -1
C9 C 0.07527(16) 0.4025(4) -0.2481(3) 0.130(5) Uani 0.5 1 d G U P B -1
C10 C 0.1056(2) 0.4236(4) -0.1867(3) 0.123(5) Uani 0.5 1 d G U P B -1
C11 C 0.1428(2) 0.3741(3) -0.1509(2) 0.134(5) Uani 0.5 1 d G U P B -1
C12 C 0.1582(3) 0.3057(3) -0.1924(3) 0.139(6) Uani 0.5 1 d G U P B -1
C13 C 0.2104(3) 0.2838(3) -0.1855(3) 0.134(6) Uani 0.5 1 d G U P B -1
C14 C 0.2363(3) 0.2534(3) -0.2411(3) 0.129(5) Uani 0.5 1 d G U P B -1
C15 C 0.2093(3) 0.2398(3) -0.3039(3) 0.139(6) Uani 0.5 1 d G U P B -1
C16 C 0.2375(3) 0.2518(3) -0.3606(3) 0.133(5) Uani 0.5 1 d G U P B -1
C17 C 0.2062(3) 0.2724(3) -0.4182(3) 0.138(6) Uani 0.5 1 d G U P B -1
C18 C 0.1535(3) 0.2829(4) -0.4223(3) 0.145(6) Uani 0.5 1 d G U P B -1
C19 C 0.1396(2) 0.3495(4) -0.4597(2) 0.128(6) Uani 0.5 1 d G U P B -1
C20 C 0.0937(2) 0.4099(4) -0.4485(3) 0.132(6) Uani 0.5 1 d G U P B -1
C21 C 0.1023(2) 0.4894(5) -0.4822(2) 0.133(5) Uani 0.5 1 d G U P B -1
C22 C 0.08055(19) 0.5639(5) -0.4509(3) 0.130(6) Uani 0.5 1 d G U P B -1
C23 C 0.05362(14) 0.5577(4) -0.3935(3) 0.118(5) Uani 0.5 1 d G U P B -1
C24 C 0.06931(16) 0.6410(4) -0.3346(3) 0.097(4) Uani 0.5 1 d G U P B -1
C25 C 0.07218(16) 0.6209(4) -0.2628(3) 0.100(5) Uani 0.5 1 d G U P B -1
C26 C 0.06719(15) 0.5414(4) -0.2353(3) 0.114(5) Uani 0.5 1 d G U P B -1
C27 C 0.09967(19) 0.5123(4) -0.1768(3) 0.104(4) Uani 0.5 1 d G U P B -1
C28 C 0.1393(2) 0.5628(4) -0.1381(2) 0.101(3) Uani 0.5 1 d G U P B -1
C29 C 0.1834(3) 0.5168(4) -0.10110(15) 0.101(3) Uani 0.5 1 d G U P B -1
C30 C 0.1808(3) 0.4272(4) -0.11675(17) 0.112(5) Uani 0.5 1 d G U P B -1
C31 C 0.2357(3) 0.4020(4) -0.11291(17) 0.126(6) Uani 0.5 1 d G U P B -1
C32 C 0.2488(3) 0.3321(4) -0.1450(2) 0.140(6) Uani 0.5 1 d G U P B -1
C33 C 0.2977(2) 0.3348(4) -0.1742(3) 0.129(6) Uani 0.5 1 d G U P B -1
C34 C 0.2883(2) 0.2866(3) -0.2348(3) 0.140(6) Uani 0.5 1 d G U P B -1
C35 C 0.3163(2) 0.2977(4) -0.2903(3) 0.129(5) Uani 0.5 1 d G U P B -1
C36 C 0.2901(2) 0.2748(4) -0.3529(3) 0.120(5) Uani 0.5 1 d G U P B -1
C37 C 0.3047(2) 0.3295(4) -0.4037(3) 0.126(5) Uani 0.5 1 d G U P B -1
C38 C 0.2698(3) 0.3538(4) -0.4613(2) 0.124(5) Uani 0.5 1 d G U P B -1
C39 C 0.2227(3) 0.3246(4) -0.4633(2) 0.131(6) Uani 0.5 1 d G U P B -1
C40 C 0.1822(3) 0.3701(4) -0.49083(19) 0.115(5) Uani 0.5 1 d G U P B -1
C41 C 0.1933(3) 0.4570(5) -0.52028(14) 0.117(5) Uani 0.5 1 d G U P B -1
C42 C 0.1498(3) 0.5177(5) -0.51318(15) 0.127(5) Uani 0.5 1 d G U P B -1
C43 C 0.1560(3) 0.6076(5) -0.49810(18) 0.129(6) Uani 0.5 1 d G U P B -1
C44 C 0.1167(2) 0.6376(4) -0.4534(2) 0.119(5) Uani 0.5 1 d G U P B -1
C45 C 0.1327(2) 0.7054(3) -0.4002(3) 0.106(5) Uani 0.5 1 d G U P B -1
C46 C 0.1061(2) 0.7117(3) -0.3380(3) 0.105(5) Uani 0.5 1 d G U P B -1
C47 C 0.1317(2) 0.7291(3) -0.2707(3) 0.117(5) Uani 0.5 1 d G U P B -1
C48 C 0.1130(2) 0.6684(3) -0.2214(3) 0.096(4) Uani 0.5 1 d G U P B -1
C49 C 0.1487(2) 0.6445(3) -0.1656(2) 0.115(5) Uani 0.5 1 d G U P B -1
C50 C 0.2023(3) 0.6716(3) -0.1536(2) 0.100(5) Uani 0.5 1 d G U P B -1
C51 C 0.2515(2) 0.6247(4) -0.12613(19) 0.092(4) Uani 0.5 1 d G U P B -1
C52 C 0.2379(3) 0.5436(4) -0.09458(14) 0.106(5) Uani 0.5 1 d G U P B -1
C53 C 0.2719(2) 0.4723(4) -0.10584(16) 0.108(5) Uani 0.5 1 d G U P B -1
C54 C 0.3174(2) 0.4826(4) -0.1380(2) 0.122(5) Uani 0.5 1 d G U P B -1
C55 C 0.3316(2) 0.4065(4) -0.1716(3) 0.130(6) Uani 0.5 1 d G U P B -1
C56 C 0.36011(15) 0.4196(5) -0.2287(3) 0.145(6) Uani 0.5 1 d G U P B -1
C57 C 0.35210(17) 0.3654(4) -0.2833(3) 0.135(6) Uani 0.5 1 d G U P B -1
C58 C 0.36773(15) 0.4116(5) -0.3373(3) 0.144(6) Uani 0.5 1 d G U P B -1
C59 C 0.34402(19) 0.3928(5) -0.3986(3) 0.130(5) Uani 0.5 1 d G U P B -1
C60 C 0.3341(2) 0.4584(5) -0.4482(3) 0.136(5) Uani 0.5 1 d G U P B -1
C61 C 0.2853(3) 0.4352(5) -0.4871(2) 0.120(5) Uani 0.5 1 d G U P B -1
C62 C 0.2444(3) 0.4956(5) -0.51553(16) 0.130(5) Uani 0.5 1 d G U P B -1
C63 C 0.2496(3) 0.5844(5) -0.50208(19) 0.120(5) Uani 0.5 1 d G U P B -1
C64 C 0.2069(3) 0.6421(4) -0.48755(19) 0.134(6) Uani 0.5 1 d G U P B -1
C65 C 0.2267(3) 0.7027(4) -0.4344(3) 0.122(5) Uani 0.5 1 d G U P B -1
C66 C 0.1873(3) 0.7387(3) -0.3894(3) 0.112(5) Uani 0.5 1 d G U P B -1
C67 C 0.2117(3) 0.7670(3) -0.3264(3) 0.127(5) Uani 0.5 1 d G U P B -1
C68 C 0.1844(3) 0.7576(3) -0.2647(3) 0.120(5) Uani 0.5 1 d G U P B -1
C69 C 0.2207(2) 0.7246(3) -0.2103(3) 0.127(5) Uani 0.5 1 d G U P B -1
C70 C 0.2735(2) 0.7303(3) -0.2355(3) 0.136(6) Uani 0.5 1 d G U P B -1
C71 C 0.3032(2) 0.6917(4) -0.2122(3) 0.133(6) Uani 0.5 1 d G U P B -1
C72 C 0.2944(2) 0.6298(4) -0.1561(2) 0.119(5) Uani 0.5 1 d G U P B -1
C73 C 0.33583(19) 0.5617(5) -0.1589(3) 0.129(6) Uani 0.5 1 d G U P B -1
C74 C 0.36071(14) 0.5726(5) -0.2227(3) 0.141(6) Uani 0.5 1 d G U P B -1
C75 C 0.37478(11) 0.4980(5) -0.2521(3) 0.142(5) Uani 0.5 1 d G U P B -1
C76 C 0.37554(11) 0.4966(5) -0.3217(3) 0.142(5) Uani 0.5 1 d G U P B -1
C77 C 0.36032(15) 0.5621(5) -0.3695(3) 0.140(6) Uani 0.5 1 d G U P B -1
C78 C 0.3281(2) 0.5423(5) -0.4287(3) 0.147(6) Uani 0.5 1 d G U P B -1
C79 C 0.2965(2) 0.6122(5) -0.4578(3) 0.135(5) Uani 0.5 1 d G U P B -1
C80 C 0.2829(2) 0.6871(4) -0.4207(3) 0.138(6) Uani 0.5 1 d G U P B -1
C81 C 0.3061(2) 0.6959(4) -0.3540(3) 0.145(6) Uani 0.5 1 d G U P B -1
C82 C 0.2678(2) 0.7455(3) -0.3093(3) 0.127(5) Uani 0.5 1 d G U P B -1
C83 C 0.34818(17) 0.6409(5) -0.3391(3) 0.133(5) Uani 0.5 1 d G U P B -1
C84 C 0.34247(17) 0.6549(4) -0.2572(3) 0.125(5) Uani 0.5 1 d G U P B -1
Ni1A Ni 0.02253(3) 0.5000 -0.08024(4) 0.0208(3) Uani 1 2 d S T P C 3
C1A C -0.0830(3) 0.3567(5) -0.3500(3) 0.0456(15) Uani 1 1 d . . . C 3
H1AA H -0.1039 0.3224 -0.3830 0.068 Uiso 1 1 calc R U . C 3
H1AB H -0.0566 0.3214 -0.3252 0.068 Uiso 1 1 calc R U . C 3
H1AC H -0.0655 0.4014 -0.3731 0.068 Uiso 1 1 calc R U . C 3
N2A N 0.02388(15) 0.3740(3) -0.0816(2) 0.0233(9) Uani 1 1 d . . . C 3
C2A C -0.1193(2) 0.3963(4) -0.3004(3) 0.0363(13) Uani 1 1 d . . . C 3
H2AA H -0.1480 0.4269 -0.3263 0.044 Uiso 1 1 calc R U . C 3
H2AB H -0.1352 0.3508 -0.2754 0.044 Uiso 1 1 calc R U . C 3
N3A N 0.0791(2) 0.5000 -0.0044(3) 0.0227(12) Uani 1 2 d S T P C 3
C18A C 0.2297(3) 0.3703(5) 0.0743(4) 0.0537(18) Uani 1 1 d . . . C 3
H18A H 0.2153 0.3371 0.0357 0.081 Uiso 1 1 calc R U . C 3
H18B H 0.2551 0.3363 0.1020 0.081 Uiso 1 1 calc R U . C 3
H18C H 0.2470 0.4203 0.0584 0.081 Uiso 1 1 calc R U . C 3
C17A C 0.1846(2) 0.3973(4) 0.1167(3) 0.0342(12) Uani 1 1 d . . . C 3
H17A H 0.1656 0.3467 0.1301 0.041 Uiso 1 1 calc R U . C 3
H17B H 0.1996 0.4256 0.1580 0.041 Uiso 1 1 calc R U . C 3
C16A C 0.14575(19) 0.4568(4) 0.0777(2) 0.0272(10) Uani 1 1 d . . . C 3
C15A C 0.10418(18) 0.4300(3) 0.0268(2) 0.0239(10) Uani 1 1 d . . . C 3
C14A C 0.09255(19) 0.3463(3) 0.0115(3) 0.0255(10) Uani 1 1 d . . . C 3
H14A H 0.1111 0.3043 0.0376 0.031 Uiso 1 1 calc R U . C 3
C13A C 0.05538(18) 0.3197(3) -0.0398(3) 0.0242(10) Uani 1 1 d . . . C 3
C12A C 0.1291(3) 0.1398(5) -0.0480(4) 0.0539(17) Uani 1 1 d . . . C 3
H12A H 0.1253 0.1289 -0.0963 0.081 Uiso 1 1 calc R U . C 3
H12B H 0.1453 0.0911 -0.0245 0.081 Uiso 1 1 calc R U . C 3
H12C H 0.1514 0.1893 -0.0388 0.081 Uiso 1 1 calc R U . C 3
C11A C 0.0742(2) 0.1561(4) -0.0230(3) 0.0345(12) Uani 1 1 d . . . C 3
H11A H 0.0523 0.1052 -0.0311 0.041 Uiso 1 1 calc R U . C 3
H11B H 0.0783 0.1663 0.0260 0.041 Uiso 1 1 calc R U . C 3
C10A C 0.0458(2) 0.2315(3) -0.0578(3) 0.0290(11) Uani 1 1 d . . . C 3
C9A C 0.0103(3) 0.1416(5) -0.2184(4) 0.0594(19) Uani 1 1 d . . . C 3
H9AA H -0.0070 0.0942 -0.2425 0.089 Uiso 1 1 calc R U . C 3
H9AB H 0.0476 0.1291 -0.2084 0.089 Uiso 1 1 calc R U . C 3
H9AC H 0.0063 0.1922 -0.2463 0.089 Uiso 1 1 calc R U . C 3
C8A C -0.0155(2) 0.1566(4) -0.1513(3) 0.0376(13) Uani 1 1 d . . . C 3
H8AA H -0.0535 0.1659 -0.1617 0.045 Uiso 1 1 calc R U . C 3
H8AB H -0.0110 0.1054 -0.1233 0.045 Uiso 1 1 calc R U . C 3
C7A C 0.0075(2) 0.2308(3) -0.1116(3) 0.0292(11) Uani 1 1 d . . . C 3
C6A C -0.00588(19) 0.3197(3) -0.1258(3) 0.0243(10) Uani 1 1 d . . . C 3
C5A C -0.0429(2) 0.3460(3) -0.1771(3) 0.0268(10) Uani 1 1 d . . . C 3
H5A H -0.0616 0.3040 -0.2029 0.032 Uiso 1 1 calc R U . C 3
C4A C -0.05421(19) 0.4305(3) -0.1932(3) 0.0253(10) Uani 1 1 d . . . C 3
C3A C -0.0907(2) 0.4566(4) -0.2505(3) 0.0297(11) Uani 1 1 d . . . C 3
N1A N -0.0316(2) 0.5000 -0.1583(3) 0.0225(12) Uani 1 2 d S T P C 3
Cl1B Cl -0.26000(19) 0.5000 -0.3064(3) 0.1110(15) Uani 1 2 d S T P D 4
C1B C -0.3235(9) 0.4786(11) -0.2863(12) 0.089(7) Uani 0.5 1 d . . P D 4
Cl3B Cl -0.3699(4) 0.5334(5) -0.3462(6) 0.170(5) Uani 0.5 1 d . . P D 4
Cl2B Cl -0.3335(3) 0.5000 -0.2068(3) 0.165(3) Uani 1 2 d S T P D 4
Cl1C Cl 0.0001(5) 0.1419(10) -0.4057(6) 0.184(5) Uani 0.5 1 d D . P E -5
C5C C 0.0036(10) 0.122(2) -0.4913(10) 0.57(10) Uani 0.5 1 d D . P E -5
H5C H 0.0207 0.0661 -0.4967 0.678 Uiso 0.5 1 calc R U P E -5
Cl3C Cl 0.0335(6) 0.1973(14) -0.5395(8) 0.262(10) Uani 0.5 1 d D . P E -5
Cl2C Cl -0.0627(3) 0.1159(9) -0.5240(8) 0.191(6) Uani 0.5 1 d D . P E -5
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 '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 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.1246 0.1234 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ni Ni 0.3393 1.1124 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Lu Lu -0.4720 5.8584 '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
Lu7 Lu1 Lu7 104.7(10) . 6_565
Lu7 Lu1 Lu12 88.7(7) . .
Lu7 Lu1 Lu12 116.1(7) 6_565 .
Lu7 Lu1 Lu12 116.1(7) . 6_565
Lu7 Lu1 Lu12 88.7(7) 6_565 6_565
Lu12 Lu1 Lu12 34.0(9) . 6_565
Lu7 Lu1 Lu3 16.0(4) . .
Lu7 Lu1 Lu3 91.1(5) 6_565 .
Lu12 Lu1 Lu3 87.1(7) . .
Lu12 Lu1 Lu3 108.1(7) 6_565 .
Lu7 Lu1 Lu3 91.1(5) . 6_565
Lu7 Lu1 Lu3 16.0(4) 6_565 6_565
Lu12 Lu1 Lu3 108.1(7) . 6_565
Lu12 Lu1 Lu3 87.1(7) 6_565 6_565
Lu3 Lu1 Lu3 76.6(3) . 6_565
Lu7 Lu1 Lu10 25.6(5) . .
Lu7 Lu1 Lu10 115.1(6) 6_565 .
Lu12 Lu1 Lu10 63.1(6) . .
Lu12 Lu1 Lu10 92.1(6) 6_565 .
Lu3 Lu1 Lu10 28.7(3) . .
Lu3 Lu1 Lu10 99.2(4) 6_565 .
Lu7 Lu1 Lu10 115.1(6) . 6_565
Lu7 Lu1 Lu10 25.6(5) 6_565 6_565
Lu12 Lu1 Lu10 92.1(6) . 6_565
Lu12 Lu1 Lu10 63.1(6) 6_565 6_565
Lu3 Lu1 Lu10 99.2(4) . 6_565
Lu3 Lu1 Lu10 28.7(3) 6_565 6_565
Lu10 Lu1 Lu10 113.7(7) . 6_565
Lu7 Lu1 Lu4 52.9(5) . .
Lu7 Lu1 Lu4 53.0(5) 6_565 .
Lu12 Lu1 Lu4 100.8(8) . .
Lu12 Lu1 Lu4 100.8(8) 6_565 .
Lu3 Lu1 Lu4 38.31(16) . .
Lu3 Lu1 Lu4 38.31(17) 6_565 .
Lu10 Lu1 Lu4 63.3(4) . .
Lu10 Lu1 Lu4 63.3(4) 6_565 .
Lu7 Lu1 Lu13 44.0(5) . .
Lu7 Lu1 Lu13 102.9(6) 6_565 .
Lu12 Lu1 Lu13 49.1(8) . .
Lu12 Lu1 Lu13 72.2(7) 6_565 .
Lu3 Lu1 Lu13 38.2(5) . .
Lu3 Lu1 Lu13 87.3(5) 6_565 .
Lu10 Lu1 Lu13 22.7(4) . .
Lu10 Lu1 Lu13 94.3(4) 6_565 .
Lu4 Lu1 Lu13 58.9(5) . .
Lu7 Lu1 Lu13 102.9(6) . 6_565
Lu7 Lu1 Lu13 44.0(5) 6_565 6_565
Lu12 Lu1 Lu13 72.2(7) . 6_565
Lu12 Lu1 Lu13 49.1(8) 6_565 6_565
Lu3 Lu1 Lu13 87.3(5) . 6_565
Lu3 Lu1 Lu13 38.2(5) 6_565 6_565
Lu10 Lu1 Lu13 94.3(4) . 6_565
Lu10 Lu1 Lu13 22.7(4) 6_565 6_565
Lu4 Lu1 Lu13 58.9(5) . 6_565
Lu13 Lu1 Lu13 73.1(6) . 6_565
Lu7 Lu1 Lu9 65.6(6) . 6_565
Lu7 Lu1 Lu9 104.2(5) 6_565 6_565
Lu12 Lu1 Lu9 28.6(7) . 6_565
Lu12 Lu1 Lu9 50.6(7) 6_565 6_565
Lu3 Lu1 Lu9 60.2(5) . 6_565
Lu3 Lu1 Lu9 91.1(3) 6_565 6_565
Lu10 Lu1 Lu9 41.8(6) . 6_565
Lu10 Lu1 Lu9 87.2(5) 6_565 6_565
Lu4 Lu1 Lu9 73.5(2) . 6_565
Lu13 Lu1 Lu9 22.2(4) . 6_565
Lu13 Lu1 Lu9 64.5(5) 6_565 6_565
Lu8 Lu2 Lu8 81.5(13) 6_565 .
Lu8 Lu2 Lu6 40.7(7) 6_565 .
Lu8 Lu2 Lu6 40.7(7) . .
Lu8 Lu2 Lu5 26.8(6) 6_565 6_565
Lu8 Lu2 Lu5 57.0(7) . 6_565
Lu6 Lu2 Lu5 18.74(19) . 6_565
Lu8 Lu2 Lu5 57.0(7) 6_565 .
Lu8 Lu2 Lu5 26.8(6) . .
Lu6 Lu2 Lu5 18.74(19) . .
Lu5 Lu2 Lu5 30.9(4) 6_565 .
Lu8 Lu2 Lu13 37.5(8) 6_565 .
Lu8 Lu2 Lu13 101.0(9) . .
Lu6 Lu2 Lu13 66.9(7) . .
Lu5 Lu2 Lu13 48.2(7) 6_565 .
Lu5 Lu2 Lu13 74.7(7) . .
Lu8 Lu2 Lu13 101.0(9) 6_565 6_565
Lu8 Lu2 Lu13 37.5(8) . 6_565
Lu6 Lu2 Lu13 66.9(7) . 6_565
Lu5 Lu2 Lu13 74.7(7) 6_565 6_565
Lu5 Lu2 Lu13 48.2(7) . 6_565
Lu13 Lu2 Lu13 98.0(10) . 6_565
Lu8 Lu2 Lu9 20.1(6) 6_565 6_565
Lu8 Lu2 Lu9 75.6(8) . 6_565
Lu6 Lu2 Lu9 38.7(6) . 6_565
Lu5 Lu2 Lu9 20.0(6) 6_565 6_565
Lu5 Lu2 Lu9 48.9(6) . 6_565
Lu13 Lu2 Lu9 28.3(6) . 6_565
Lu13 Lu2 Lu9 85.3(8) 6_565 6_565
Lu8 Lu2 Lu9 75.6(8) 6_565 .
Lu8 Lu2 Lu9 20.1(6) . .
Lu6 Lu2 Lu9 38.7(6) . .
Lu5 Lu2 Lu9 48.9(6) 6_565 .
Lu5 Lu2 Lu9 20.0(6) . .
Lu13 Lu2 Lu9 85.3(8) . .
Lu13 Lu2 Lu9 28.3(6) 6_565 .
Lu9 Lu2 Lu9 63.8(9) 6_565 .
Lu8 Lu2 Lu4 107.4(7) 6_565 .
Lu8 Lu2 Lu4 107.4(7) . .
Lu6 Lu2 Lu4 113.8(3) . .
Lu5 Lu2 Lu4 102.6(3) 6_565 .
Lu5 Lu2 Lu4 102.6(3) . .
Lu13 Lu2 Lu4 71.2(4) . .
Lu13 Lu2 Lu4 71.2(4) 6_565 .
Lu9 Lu2 Lu4 90.6(5) 6_565 .
Lu9 Lu2 Lu4 90.6(5) . .
Lu8 Lu2 Lu3 105.6(6) 6_565 6_565
Lu8 Lu2 Lu3 73.5(7) . 6_565
Lu6 Lu2 Lu3 90.0(2) . 6_565
Lu5 Lu2 Lu3 87.2(2) 6_565 6_565
Lu5 Lu2 Lu3 73.99(19) . 6_565
Lu13 Lu2 Lu3 81.0(4) . 6_565
Lu13 Lu2 Lu3 37.2(4) 6_565 6_565
Lu9 Lu2 Lu3 85.5(3) 6_565 6_565
Lu9 Lu2 Lu3 58.2(6) . 6_565
Lu4 Lu2 Lu3 34.10(19) . 6_565
Lu8 Lu2 Lu3 73.5(7) 6_565 .
Lu8 Lu2 Lu3 105.6(6) . .
Lu6 Lu2 Lu3 90.0(2) . .
Lu5 Lu2 Lu3 73.99(19) 6_565 .
Lu5 Lu2 Lu3 87.2(2) . .
Lu13 Lu2 Lu3 37.2(4) . .
Lu13 Lu2 Lu3 81.0(4) 6_565 .
Lu9 Lu2 Lu3 58.2(6) 6_565 .
Lu9 Lu2 Lu3 85.5(3) . .
Lu4 Lu2 Lu3 34.10(19) . .
Lu3 Lu2 Lu3 50.3(4) 6_565 .
Lu7 Lu3 Lu10 69.5(10) . .
Lu7 Lu3 Lu4 108.7(9) . .
Lu10 Lu3 Lu4 142.2(8) . .
Lu7 Lu3 Lu13 100.6(11) . .
Lu10 Lu3 Lu13 43.1(12) . .
Lu4 Lu3 Lu13 104.7(7) . .
Lu7 Lu3 Lu1 18.4(5) . .
Lu10 Lu3 Lu1 77.0(9) . .
Lu4 Lu3 Lu1 92.4(4) . .
Lu13 Lu3 Lu1 97.2(8) . .
Lu7 Lu3 Lu11 21.7(6) . .
Lu10 Lu3 Lu11 72.1(10) . .
Lu4 Lu3 Lu11 93.3(5) . .
Lu13 Lu3 Lu11 90.3(10) . .
Lu1 Lu3 Lu11 7.0(5) . .
Lu7 Lu3 Lu7 45.5(10) . 6_565
Lu10 Lu3 Lu7 101.6(9) . 6_565
Lu4 Lu3 Lu7 63.6(6) . 6_565
Lu13 Lu3 Lu7 105.7(6) . 6_565
Lu1 Lu3 Lu7 28.9(5) . 6_565
Lu11 Lu3 Lu7 31.1(5) . 6_565
Lu7 Lu3 Lu3 68.7(7) . 6_565
Lu10 Lu3 Lu3 117.2(7) . 6_565
Lu4 Lu3 Lu3 40.8(4) . 6_565
Lu13 Lu3 Lu3 104.6(4) . 6_565
Lu1 Lu3 Lu3 51.71(16) . 6_565
Lu11 Lu3 Lu3 52.7(4) . 6_565
Lu7 Lu3 Lu3 23.2(4) 6_565 6_565
Lu7 Lu3 Lu9 83.3(6) . 6_565
Lu10 Lu3 Lu9 41.0(8) . 6_565
Lu4 Lu3 Lu9 101.5(5) . 6_565
Lu13 Lu3 Lu9 19.9(7) . 6_565
Lu1 Lu3 Lu9 77.8(3) . 6_565
Lu11 Lu3 Lu9 70.7(6) . 6_565
Lu7 Lu3 Lu9 86.7(4) 6_565 6_565
Lu3 Lu3 Lu9 89.4(4) 6_565 6_565
Lu7 Lu3 Lu12 48.7(9) . .
Lu10 Lu3 Lu12 42.4(8) . .
Lu4 Lu3 Lu12 106.7(4) . .
Lu13 Lu3 Lu12 53.4(12) . .
Lu1 Lu3 Lu12 44.2(8) . .
Lu11 Lu3 Lu12 37.4(8) . .
Lu7 Lu3 Lu12 61.4(6) 6_565 .
Lu3 Lu3 Lu12 74.8(4) 6_565 .
Lu9 Lu3 Lu12 34.7(9) 6_565 .
Lu7 Lu3 Lu8 105.5(6) . 6_565
Lu10 Lu3 Lu8 73.2(9) . 6_565
Lu4 Lu3 Lu8 71.1(5) . 6_565
Lu13 Lu3 Lu8 34.1(6) . 6_565
Lu1 Lu3 Lu8 92.5(2) . 6_565
Lu11 Lu3 Lu8 86.2(5) . 6_565
Lu7 Lu3 Lu8 85.4(3) 6_565 6_565
Lu3 Lu3 Lu8 75.3(3) 6_565 6_565
Lu9 Lu3 Lu8 33.3(4) 6_565 6_565
Lu12 Lu3 Lu8 60.1(8) . 6_565
Lu7 Lu3 Lu2 110.4(6) . .
Lu10 Lu3 Lu2 89.3(8) . .
Lu4 Lu3 Lu2 55.0(3) . .
Lu13 Lu3 Lu2 49.8(6) . .
Lu1 Lu3 Lu2 94.35(16) . .
Lu11 Lu3 Lu2 89.1(4) . .
Lu7 Lu3 Lu2 79.8(3) 6_565 .
Lu3 Lu3 Lu2 64.87(19) 6_565 .
Lu9 Lu3 Lu2 48.8(3) 6_565 .
Lu12 Lu3 Lu2 70.8(7) . .
Lu8 Lu3 Lu2 16.2(3) 6_565 .
Lu3 Lu4 Lu3 98.5(7) 6_565 .
Lu3 Lu4 Lu7 73.6(7) 6_565 .
Lu3 Lu4 Lu7 25.4(5) . .
Lu3 Lu4 Lu7 25.4(5) 6_565 6_565
Lu3 Lu4 Lu7 73.6(7) . 6_565
Lu7 Lu4 Lu7 48.4(10) . 6_565
Lu3 Lu4 Lu2 90.9(4) 6_565 .
Lu3 Lu4 Lu2 90.9(4) . .
Lu7 Lu4 Lu2 96.0(2) . .
Lu7 Lu4 Lu2 96.0(2) 6_565 .
Lu3 Lu4 Lu10 93.2(5) 6_565 .
Lu3 Lu4 Lu10 14.1(3) . .
Lu7 Lu4 Lu10 26.7(5) . .
Lu7 Lu4 Lu10 70.2(6) 6_565 .
Lu2 Lu4 Lu10 77.8(3) . .
Lu3 Lu4 Lu10 14.1(3) 6_565 6_565
Lu3 Lu4 Lu10 93.2(5) . 6_565
Lu7 Lu4 Lu10 70.2(6) . 6_565
Lu7 Lu4 Lu10 26.7(5) 6_565 6_565
Lu2 Lu4 Lu10 77.8(3) . 6_565
Lu10 Lu4 Lu10 85.3(6) . 6_565
Lu3 Lu4 Lu1 49.3(4) 6_565 .
Lu3 Lu4 Lu1 49.3(4) . .
Lu7 Lu4 Lu1 24.4(5) . .
Lu7 Lu4 Lu1 24.4(5) 6_565 .
Lu2 Lu4 Lu1 93.31(16) . .
Lu10 Lu4 Lu1 46.3(4) . .
Lu10 Lu4 Lu1 46.3(4) 6_565 .
Lu3 Lu4 Lu11 49.3(3) 6_565 .
Lu3 Lu4 Lu11 49.3(3) . .
Lu7 Lu4 Lu11 25.6(4) . .
Lu7 Lu4 Lu11 25.6(4) 6_565 .
Lu2 Lu4 Lu11 88.0(4) . .
Lu10 Lu4 Lu11 44.7(4) . .
Lu10 Lu4 Lu11 44.7(4) 6_565 .
Lu1 Lu4 Lu11 5.3(4) . .
Lu3 Lu4 Lu13 100.0(6) 6_565 .
Lu3 Lu4 Lu13 39.4(5) . .
Lu7 Lu4 Lu13 51.7(5) . .
Lu7 Lu4 Lu13 83.9(7) 6_565 .
Lu2 Lu4 Lu13 51.7(3) . .
Lu10 Lu4 Lu13 27.3(5) . .
Lu10 Lu4 Lu13 87.7(6) 6_565 .
Lu1 Lu4 Lu13 64.1(5) . .
Lu11 Lu4 Lu13 60.4(6) . .
Lu3 Lu4 Lu13 39.4(5) 6_565 6_565
Lu3 Lu4 Lu13 100.0(6) . 6_565
Lu7 Lu4 Lu13 83.9(7) . 6_565
Lu7 Lu4 Lu13 51.7(5) 6_565 6_565
Lu2 Lu4 Lu13 51.7(3) . 6_565
Lu10 Lu4 Lu13 87.7(6) . 6_565
Lu10 Lu4 Lu13 27.3(5) 6_565 6_565
Lu1 Lu4 Lu13 64.1(5) . 6_565
Lu11 Lu4 Lu13 60.4(6) . 6_565
Lu13 Lu4 Lu13 77.5(8) . 6_565
Lu3 Lu4 Lu8 74.5(5) 6_565 .
Lu3 Lu4 Lu8 91.5(3) . .
Lu7 Lu4 Lu8 89.6(3) . .
Lu7 Lu4 Lu8 80.5(4) 6_565 .
Lu2 Lu4 Lu8 16.4(4) . .
Lu10 Lu4 Lu8 77.4(3) . .
Lu10 Lu4 Lu8 61.3(4) 6_565 .
Lu1 Lu4 Lu8 81.3(3) . .
Lu11 Lu4 Lu8 76.1(5) . .
Lu13 Lu4 Lu8 55.1(4) . .
Lu13 Lu4 Lu8 35.5(5) 6_565 .
Lu6 Lu5 Lu9 140.7(16) . .
Lu6 Lu5 Lu5 48.3(8) . 6_565
Lu9 Lu5 Lu5 148.8(8) . 6_565
Lu6 Lu5 Lu8 46.5(9) . .
Lu9 Lu5 Lu8 95.0(13) . .
Lu5 Lu5 Lu8 90.8(7) 6_565 .
Lu6 Lu5 Lu8 16.0(6) . 6_565
Lu9 Lu5 Lu8 128.6(12) . 6_565
Lu5 Lu5 Lu8 50.2(6) 6_565 6_565
Lu8 Lu5 Lu8 40.5(12) . 6_565
Lu6 Lu5 Lu13 109.7(13) . 6_565
Lu9 Lu5 Lu13 31.4(9) . 6_565
Lu5 Lu5 Lu13 132.9(5) 6_565 6_565
Lu8 Lu5 Lu13 65.7(11) . 6_565
Lu8 Lu5 Lu13 97.2(9) 6_565 6_565
Lu6 Lu5 Lu9 56.5(6) . 6_565
Lu9 Lu5 Lu9 135.1(12) . 6_565
Lu5 Lu5 Lu9 13.7(5) 6_565 6_565
Lu8 Lu5 Lu9 93.3(8) . 6_565
Lu8 Lu5 Lu9 54.1(7) 6_565 6_565
Lu13 Lu5 Lu9 122.4(8) 6_565 6_565
Lu6 Lu5 Lu12 130.2(10) . 6_565
Lu9 Lu5 Lu12 61.5(10) . 6_565
Lu5 Lu5 Lu12 90.9(6) 6_565 6_565
Lu8 Lu5 Lu12 127.3(8) . 6_565
Lu8 Lu5 Lu12 118.4(9) 6_565 6_565
Lu13 Lu5 Lu12 75.3(10) 6_565 6_565
Lu9 Lu5 Lu12 78.6(8) 6_565 6_565
Lu6 Lu5 Lu2 34.5(7) . .
Lu9 Lu5 Lu2 106.3(12) . .
Lu5 Lu5 Lu2 74.53(18) 6_565 .
Lu8 Lu5 Lu2 17.0(5) . .
Lu8 Lu5 Lu2 24.7(6) 6_565 .
Lu13 Lu5 Lu2 75.2(9) 6_565 .
Lu9 Lu5 Lu2 76.4(5) 6_565 .
Lu12 Lu5 Lu2 121.3(8) 6_565 .
Lu6 Lu5 Lu12 102.0(9) . .
Lu9 Lu5 Lu12 92.2(12) . .
Lu5 Lu5 Lu12 59.3(8) 6_565 .
Lu8 Lu5 Lu12 121.9(6) . .
Lu8 Lu5 Lu12 94.2(7) 6_565 .
Lu13 Lu5 Lu12 97.9(12) 6_565 .
Lu9 Lu5 Lu12 47.3(8) 6_565 .
Lu12 Lu5 Lu12 31.6(13) 6_565 .
Lu2 Lu5 Lu12 107.9(4) . .
Lu6 Lu5 Lu13 49.0(7) . .
Lu9 Lu5 Lu13 123.9(10) . .
Lu5 Lu5 Lu13 29.8(4) 6_565 .
Lu8 Lu5 Lu13 74.9(8) . .
Lu8 Lu5 Lu13 40.1(8) 6_565 .
Lu13 Lu5 Lu13 103.0(8) 6_565 .
Lu9 Lu5 Lu13 22.0(5) 6_565 .
Lu12 Lu5 Lu13 81.3(9) 6_565 .
Lu2 Lu5 Lu13 58.1(7) . .
Lu12 Lu5 Lu13 54.2(7) . .
Lu6 Lu5 Lu10 116.1(7) . 6_565
Lu9 Lu5 Lu10 34.6(9) . 6_565
Lu5 Lu5 Lu10 117.3(3) 6_565 6_565
Lu8 Lu5 Lu10 81.3(6) . 6_565
Lu8 Lu5 Lu10 100.5(4) 6_565 6_565
Lu13 Lu5 Lu10 24.8(7) 6_565 6_565
Lu9 Lu5 Lu10 104.4(6) 6_565 6_565
Lu12 Lu5 Lu10 51.9(7) 6_565 6_565
Lu2 Lu5 Lu10 84.8(3) . 6_565
Lu12 Lu5 Lu10 73.1(10) . 6_565
Lu13 Lu5 Lu10 89.7(4) . 6_565
Lu5 Lu6 Lu5 83.4(16) . 6_565
Lu5 Lu6 Lu8 150.5(9) . 6_565
Lu5 Lu6 Lu8 95.7(11) 6_565 6_565
Lu5 Lu6 Lu8 95.7(11) . .
Lu5 Lu6 Lu8 150.5(9) 6_565 .
Lu8 Lu6 Lu8 71(2) 6_565 .
Lu5 Lu6 Lu2 126.8(8) . .
Lu5 Lu6 Lu2 126.8(8) 6_565 .
Lu8 Lu6 Lu2 35.4(11) 6_565 .
Lu8 Lu6 Lu2 35.4(11) . .
Lu5 Lu6 Lu9 20.2(9) . .
Lu5 Lu6 Lu9 98.0(10) 6_565 .
Lu8 Lu6 Lu9 134.4(11) 6_565 .
Lu8 Lu6 Lu9 76.1(13) . .
Lu2 Lu6 Lu9 106.6(8) . .
Lu5 Lu6 Lu9 98.0(10) . 6_565
Lu5 Lu6 Lu9 20.2(9) 6_565 6_565
Lu8 Lu6 Lu9 76.1(13) 6_565 6_565
Lu8 Lu6 Lu9 134.4(11) . 6_565
Lu2 Lu6 Lu9 106.6(8) . 6_565
Lu9 Lu6 Lu9 108.2(8) . 6_565
Lu5 Lu6 Lu13 50.1(10) . 6_565
Lu5 Lu6 Lu13 114.9(9) 6_565 6_565
Lu8 Lu6 Lu13 105.7(11) 6_565 6_565
Lu8 Lu6 Lu13 49.1(13) . 6_565
Lu2 Lu6 Lu13 76.6(8) . 6_565
Lu9 Lu6 Lu13 30.1(7) . 6_565
Lu9 Lu6 Lu13 115.4(6) 6_565 6_565
Lu5 Lu6 Lu13 114.9(9) . .
Lu5 Lu6 Lu13 50.1(10) 6_565 .
Lu8 Lu6 Lu13 49.1(13) 6_565 .
Lu8 Lu6 Lu13 105.7(11) . .
Lu2 Lu6 Lu13 76.6(8) . .
Lu9 Lu6 Lu13 115.4(6) . .
Lu9 Lu6 Lu13 30.1(7) 6_565 .
Lu13 Lu6 Lu13 106.0(6) 6_565 .
Lu5 Lu6 Lu12 35.2(9) . 6_565
Lu5 Lu6 Lu12 59.3(8) 6_565 6_565
Lu8 Lu6 Lu12 121.0(10) 6_565 6_565
Lu8 Lu6 Lu12 104.3(10) . 6_565
Lu2 Lu6 Lu12 118.4(7) . 6_565
Lu9 Lu6 Lu12 40.8(6) . 6_565
Lu9 Lu6 Lu12 67.4(7) 6_565 6_565
Lu13 Lu6 Lu12 56.9(8) 6_565 6_565
Lu13 Lu6 Lu12 79.7(10) . 6_565
Lu5 Lu6 Lu12 59.3(8) . .
Lu5 Lu6 Lu12 35.2(9) 6_565 .
Lu8 Lu6 Lu12 104.3(10) 6_565 .
Lu8 Lu6 Lu12 121.0(10) . .
Lu2 Lu6 Lu12 118.4(7) . .
Lu9 Lu6 Lu12 67.4(7) . .
Lu9 Lu6 Lu12 40.8(6) 6_565 .
Lu13 Lu6 Lu12 79.7(10) 6_565 .
Lu13 Lu6 Lu12 56.9(8) . .
Lu12 Lu6 Lu12 26.6(11) 6_565 .
Lu5 Lu6 Lu10 50.5(6) . 6_565
Lu5 Lu6 Lu10 96.7(7) 6_565 6_565
Lu8 Lu6 Lu10 100.7(7) 6_565 6_565
Lu8 Lu6 Lu10 61.9(9) . 6_565
Lu2 Lu6 Lu10 80.3(3) . 6_565
Lu9 Lu6 Lu10 34.6(7) . 6_565
Lu9 Lu6 Lu10 95.4(5) 6_565 6_565
Lu13 Lu6 Lu10 20.0(5) 6_565 6_565
Lu13 Lu6 Lu10 88.0(4) . 6_565
Lu12 Lu6 Lu10 42.6(5) 6_565 6_565
Lu12 Lu6 Lu10 61.6(8) . 6_565
Lu3 Lu7 Lu1 145.7(7) . .
Lu3 Lu7 Lu10 56.1(12) . .
Lu1 Lu7 Lu10 129.0(12) . .
Lu3 Lu7 Lu11 140.7(9) . .
Lu1 Lu7 Lu11 12.0(9) . .
Lu10 Lu7 Lu11 117.3(12) . .
Lu3 Lu7 Lu7 111.3(7) . 6_565
Lu1 Lu7 Lu7 37.7(5) . 6_565
Lu10 Lu7 Lu7 136.1(6) . 6_565
Lu11 Lu7 Lu7 42.3(9) . 6_565
Lu3 Lu7 Lu12 111.3(11) . .
Lu1 Lu7 Lu12 59.9(11) . .
Lu10 Lu7 Lu12 69.1(10) . .
Lu11 Lu7 Lu12 48.2(11) . .
Lu7 Lu7 Lu12 80.8(6) 6_565 .
Lu3 Lu7 Lu4 45.9(6) . .
Lu1 Lu7 Lu4 102.6(4) . .
Lu10 Lu7 Lu4 93.9(12) . .
Lu11 Lu7 Lu4 103.1(8) . .
Lu7 Lu7 Lu4 65.8(5) 6_565 .
Lu12 Lu7 Lu4 108.8(7) . .
Lu3 Lu7 Lu13 53.1(10) . .
Lu1 Lu7 Lu13 115.1(8) . .
Lu10 Lu7 Lu13 24.8(6) . .
Lu11 Lu7 Lu13 103.4(10) . .
Lu7 Lu7 Lu13 111.7(4) 6_565 .
Lu12 Lu7 Lu13 59.5(11) . .
Lu4 Lu7 Lu13 77.0(8) . .
Lu3 Lu7 Lu3 88.2(6) . 6_565
Lu1 Lu7 Lu3 60.0(3) . 6_565
Lu10 Lu7 Lu3 122.5(7) . 6_565
Lu11 Lu7 Lu3 62.1(9) . 6_565
Lu7 Lu7 Lu3 23.2(4) 6_565 6_565
Lu12 Lu7 Lu3 89.0(6) . 6_565
Lu4 Lu7 Lu3 42.81(19) . 6_565
Lu13 Lu7 Lu3 98.2(4) . 6_565
Lu3 Lu7 Lu12 117.3(8) . 6_565
Lu1 Lu7 Lu12 40.7(8) . 6_565
Lu10 Lu7 Lu12 90.4(9) . 6_565
Lu11 Lu7 Lu12 29.0(9) . 6_565
Lu7 Lu7 Lu12 56.0(4) 6_565 6_565
Lu12 Lu7 Lu12 24.8(7) . 6_565
Lu4 Lu7 Lu12 95.6(6) . 6_565
Lu13 Lu7 Lu12 74.4(9) . 6_565
Lu3 Lu7 Lu12 66.0(5) 6_565 6_565
Lu3 Lu7 Lu9 75.4(7) . 6_565
Lu1 Lu7 Lu9 91.9(6) . 6_565
Lu10 Lu7 Lu9 40.8(7) . 6_565
Lu11 Lu7 Lu9 80.0(9) . 6_565
Lu7 Lu7 Lu9 97.1(5) 6_565 6_565
Lu12 Lu7 Lu9 36.1(10) . 6_565
Lu4 Lu7 Lu9 86.8(4) . 6_565
Lu13 Lu7 Lu9 23.9(6) . 6_565
Lu3 Lu7 Lu9 91.5(5) 6_565 6_565
Lu12 Lu7 Lu9 51.2(7) 6_565 6_565
Lu3 Lu7 Lu10 103.0(6) . 6_565
Lu1 Lu7 Lu10 42.9(4) . 6_565
Lu10 Lu7 Lu10 119.2(8) . 6_565
Lu11 Lu7 Lu10 42.3(8) . 6_565
Lu7 Lu7 Lu10 16.8(3) 6_565 6_565
Lu12 Lu7 Lu10 69.5(6) . 6_565
Lu4 Lu7 Lu10 60.9(3) . 6_565
Lu13 Lu7 Lu10 94.9(4) . 6_565
Lu3 Lu7 Lu10 21.3(3) 6_565 6_565
Lu12 Lu7 Lu10 45.5(5) 6_565 6_565
Lu9 Lu7 Lu10 80.8(5) 6_565 6_565
Lu2 Lu8 Lu6 103.8(14) . .
Lu2 Lu8 Lu8 49.3(7) . 6_565
Lu6 Lu8 Lu8 54.6(11) . 6_565
Lu2 Lu8 Lu5 136.3(10) . .
Lu6 Lu8 Lu5 37.8(7) . .
Lu8 Lu8 Lu5 89.2(7) 6_565 .
Lu2 Lu8 Lu9 149.5(7) . .
Lu6 Lu8 Lu9 69.0(14) . .
Lu8 Lu8 Lu9 116.0(7) 6_565 .
Lu5 Lu8 Lu9 31.5(10) . .
Lu2 Lu8 Lu5 98.3(9) . 6_565
Lu6 Lu8 Lu5 13.5(4) . 6_565
Lu8 Lu8 Lu5 50.2(6) 6_565 6_565
Lu5 Lu8 Lu5 39.0(5) . 6_565
Lu9 Lu8 Lu5 67.7(10) . 6_565
Lu2 Lu8 Lu13 125.2(11) . 6_565
Lu6 Lu8 Lu13 106.3(17) . 6_565
Lu8 Lu8 Lu13 134.0(5) 6_565 6_565
Lu5 Lu8 Lu13 70.7(13) . 6_565
Lu9 Lu8 Lu13 40.1(10) . 6_565
Lu5 Lu8 Lu13 100.6(12) 6_565 6_565
Lu2 Lu8 Lu9 83.8(8) . 6_565
Lu6 Lu8 Lu9 28.6(7) . 6_565
Lu8 Lu8 Lu9 38.7(6) 6_565 6_565
Lu5 Lu8 Lu9 52.5(7) . 6_565
Lu9 Lu8 Lu9 77.2(11) . 6_565
Lu5 Lu8 Lu9 16.6(6) 6_565 6_565
Lu13 Lu8 Lu9 102.8(9) 6_565 6_565
Lu2 Lu8 Lu13 60.5(8) . .
Lu6 Lu8 Lu13 53.8(8) . .
Lu8 Lu8 Lu13 28.3(5) 6_565 .
Lu5 Lu8 Lu13 76.4(8) . .
Lu9 Lu8 Lu13 94.7(9) . .
Lu5 Lu8 Lu13 42.7(6) 6_565 .
Lu13 Lu8 Lu13 105.7(9) 6_565 .
Lu9 Lu8 Lu13 26.1(6) 6_565 .
Lu2 Lu8 Lu10 111.0(6) . 6_565
Lu6 Lu8 Lu10 100.6(10) . 6_565
Lu8 Lu8 Lu10 115.7(3) 6_565 6_565
Lu5 Lu8 Lu10 71.2(7) . 6_565
Lu9 Lu8 Lu10 45.9(9) . 6_565
Lu5 Lu8 Lu10 91.4(6) 6_565 6_565
Lu13 Lu8 Lu10 19.1(4) 6_565 6_565
Lu9 Lu8 Lu10 89.2(5) 6_565 6_565
Lu13 Lu8 Lu10 87.5(5) . 6_565
Lu2 Lu8 Lu12 121.7(8) . 6_565
Lu6 Lu8 Lu12 56.7(10) . 6_565
Lu8 Lu8 Lu12 90.2(4) 6_565 6_565
Lu5 Lu8 Lu12 31.3(8) . 6_565
Lu9 Lu8 Lu12 29.1(6) . 6_565
Lu5 Lu8 Lu12 49.1(5) 6_565 6_565
Lu13 Lu8 Lu12 51.5(10) 6_565 6_565
Lu9 Lu8 Lu12 52.9(5) 6_565 6_565
Lu13 Lu8 Lu12 66.1(8) . 6_565
Lu10 Lu8 Lu12 44.1(6) 6_565 6_565
Lu2 Lu8 Lu4 56.2(5) . .
Lu6 Lu8 Lu4 111.3(5) . .
Lu8 Lu8 Lu4 78.8(3) 6_565 .
Lu5 Lu8 Lu4 109.7(5) . .
Lu9 Lu8 Lu4 97.6(8) . .
Lu5 Lu8 Lu4 97.9(3) 6_565 .
Lu13 Lu8 Lu4 70.5(6) 6_565 .
Lu9 Lu8 Lu4 83.2(6) 6_565 .
Lu13 Lu8 Lu4 61.4(5) . .
Lu10 Lu8 Lu4 54.8(3) 6_565 .
Lu12 Lu8 Lu4 79.3(8) 6_565 .
Lu5 Lu9 Lu13 126.1(13) . 6_565
Lu5 Lu9 Lu6 19.1(8) . .
Lu13 Lu9 Lu6 107.2(12) 6_565 .
Lu5 Lu9 Lu8 53.5(8) . .
Lu13 Lu9 Lu8 75.0(11) 6_565 .
Lu6 Lu9 Lu8 34.8(5) . .
Lu5 Lu9 Lu12 91.2(15) . 6_565
Lu13 Lu9 Lu12 105(2) 6_565 6_565
Lu6 Lu9 Lu12 100.5(11) . 6_565
Lu8 Lu9 Lu12 122.0(9) . 6_565
Lu5 Lu9 Lu5 17.4(4) . 6_565
Lu13 Lu9 Lu5 121.1(10) 6_565 6_565
Lu6 Lu9 Lu5 25.5(5) . 6_565
Lu8 Lu9 Lu5 58.2(7) . 6_565
Lu12 Lu9 Lu5 76.2(10) 6_565 6_565
Lu5 Lu9 Lu10 131.7(9) . 6_565
Lu13 Lu9 Lu10 36.0(15) 6_565 6_565
Lu6 Lu9 Lu10 119.6(7) . 6_565
Lu8 Lu9 Lu10 99.2(9) . 6_565
Lu12 Lu9 Lu10 69.6(13) 6_565 6_565
Lu5 Lu9 Lu10 116.6(5) 6_565 6_565
Lu5 Lu9 Lu8 34.9(7) . 6_565
Lu13 Lu9 Lu8 91.3(11) 6_565 6_565
Lu6 Lu9 Lu8 17.0(4) . 6_565
Lu8 Lu9 Lu8 25.3(7) . 6_565
Lu12 Lu9 Lu8 99.5(9) 6_565 6_565
Lu5 Lu9 Lu8 34.1(5) 6_565 6_565
Lu10 Lu9 Lu8 103.2(6) 6_565 6_565
Lu5 Lu9 Lu12 66.6(14) . .
Lu13 Lu9 Lu12 112.6(14) 6_565 .
Lu6 Lu9 Lu12 74.8(11) . .
Lu8 Lu9 Lu12 99.1(9) . .
Lu12 Lu9 Lu12 25.8(10) 6_565 .
Lu5 Lu9 Lu12 50.8(11) 6_565 .
Lu10 Lu9 Lu12 82.9(11) 6_565 .
Lu8 Lu9 Lu12 74.9(9) 6_565 .
Lu5 Lu9 Lu2 53.7(8) . .
Lu13 Lu9 Lu2 72.7(11) 6_565 .
Lu6 Lu9 Lu2 34.7(4) . .
Lu8 Lu9 Lu2 10.4(3) . .
Lu12 Lu9 Lu2 112.4(8) 6_565 .
Lu5 Lu9 Lu2 54.7(4) 6_565 .
Lu10 Lu9 Lu2 92.2(6) 6_565 .
Lu8 Lu9 Lu2 20.6(4) 6_565 .
Lu12 Lu9 Lu2 90.6(7) . .
Lu5 Lu9 Lu9 31.2(8) . 6_565
Lu13 Lu9 Lu9 115.2(10) 6_565 6_565
Lu6 Lu9 Lu9 35.9(4) . 6_565
Lu8 Lu9 Lu9 64.0(7) . 6_565
Lu12 Lu9 Lu9 64.6(10) 6_565 6_565
Lu5 Lu9 Lu9 13.7(5) 6_565 6_565
Lu10 Lu9 Lu9 104.2(5) 6_565 6_565
Lu8 Lu9 Lu9 38.7(6) 6_565 6_565
Lu12 Lu9 Lu9 38.9(10) . 6_565
Lu2 Lu9 Lu9 58.1(4) . 6_565
Lu5 Lu9 Lu3 114.2(8) . 6_565
Lu13 Lu9 Lu3 32.8(9) 6_565 6_565
Lu6 Lu9 Lu3 100.4(5) . 6_565
Lu8 Lu9 Lu3 80.6(7) . 6_565
Lu12 Lu9 Lu3 74.8(12) 6_565 6_565
Lu5 Lu9 Lu3 101.2(4) 6_565 6_565
Lu10 Lu9 Lu3 19.6(4) 6_565 6_565
Lu8 Lu9 Lu3 83.7(4) 6_565 6_565
Lu12 Lu9 Lu3 79.8(9) . 6_565
Lu2 Lu9 Lu3 73.0(4) . 6_565
Lu9 Lu9 Lu3 90.6(4) 6_565 6_565
Lu3 Lu10 Lu7 54.3(10) . .
Lu3 Lu10 Lu13 103.7(17) . .
Lu7 Lu10 Lu13 132.9(10) . .
Lu3 Lu10 Lu9 119.4(10) . 6_565
Lu7 Lu10 Lu9 117.0(10) . 6_565
Lu13 Lu10 Lu9 31.6(12) . 6_565
Lu3 Lu10 Lu11 79.2(11) . .
Lu7 Lu10 Lu11 32.4(9) . .
Lu13 Lu10 Lu11 112.3(10) . .
Lu9 Lu10 Lu11 87.5(8) 6_565 .
Lu3 Lu10 Lu1 74.3(9) . .
Lu7 Lu10 Lu1 25.4(9) . .
Lu13 Lu10 Lu1 118.2(9) . .
Lu9 Lu10 Lu1 94.4(6) 6_565 .
Lu11 Lu10 Lu1 7.1(6) . .
Lu3 Lu10 Lu12 118.3(11) . .
Lu7 Lu10 Lu12 79.8(14) . .
Lu13 Lu10 Lu12 77.4(17) . .
Lu9 Lu10 Lu12 46.2(12) 6_565 .
Lu11 Lu10 Lu12 47.4(11) . .
Lu1 Lu10 Lu12 54.4(11) . .
Lu3 Lu10 Lu4 23.6(5) . .
Lu7 Lu10 Lu4 59.4(9) . .
Lu13 Lu10 Lu4 85.1(11) . .
Lu9 Lu10 Lu4 96.0(5) 6_565 .
Lu11 Lu10 Lu4 72.8(7) . .
Lu1 Lu10 Lu4 70.4(4) . .
Lu12 Lu10 Lu4 100.4(6) . .
Lu3 Lu10 Lu5 107.3(8) . 6_565
Lu7 Lu10 Lu5 105.3(8) . 6_565
Lu13 Lu10 Lu5 35.6(11) . 6_565
Lu9 Lu10 Lu5 13.7(4) 6_565 6_565
Lu11 Lu10 Lu5 78.1(6) . 6_565
Lu1 Lu10 Lu5 84.6(4) . 6_565
Lu12 Lu10 Lu5 43.6(11) . 6_565
Lu4 Lu10 Lu5 83.7(4) . 6_565
Lu3 Lu10 Lu8 86.0(9) . 6_565
Lu7 Lu10 Lu8 107.0(7) . 6_565
Lu13 Lu10 Lu8 26.0(6) . 6_565
Lu9 Lu10 Lu8 34.9(4) 6_565 6_565
Lu11 Lu10 Lu8 90.6(5) . 6_565
Lu1 Lu10 Lu8 95.3(4) . 6_565
Lu12 Lu10 Lu8 69.2(10) . 6_565
Lu4 Lu10 Lu8 63.9(4) . 6_565
Lu5 Lu10 Lu8 27.5(3) 6_565 6_565
Lu3 Lu10 Lu7 57.1(8) . 6_565
Lu7 Lu10 Lu7 27.1(6) . 6_565
Lu13 Lu10 Lu7 106.2(8) . 6_565
Lu9 Lu10 Lu7 91.6(6) 6_565 6_565
Lu11 Lu10 Lu7 23.9(5) . 6_565
Lu1 Lu10 Lu7 22.1(4) . 6_565
Lu12 Lu10 Lu7 63.5(9) . 6_565
Lu4 Lu10 Lu7 48.9(5) . 6_565
Lu5 Lu10 Lu7 79.0(3) 6_565 6_565
Lu8 Lu10 Lu7 80.7(4) 6_565 6_565
Lu3 Lu10 Lu12 99.7(9) . 6_565
Lu7 Lu10 Lu12 65.9(10) . 6_565
Lu13 Lu10 Lu12 80.7(13) . 6_565
Lu9 Lu10 Lu12 53.2(9) 6_565 6_565
Lu11 Lu10 Lu12 34.5(8) . 6_565
Lu1 Lu10 Lu12 41.5(8) . 6_565
Lu12 Lu10 Lu12 18.7(6) . 6_565
Lu4 Lu10 Lu12 82.4(4) . 6_565
Lu5 Lu10 Lu12 45.2(8) 6_565 6_565
Lu8 Lu10 Lu12 64.7(8) 6_565 6_565
Lu7 Lu10 Lu12 45.9(5) 6_565 6_565
Lu7 Lu11 Lu7 95.5(17) . 6_565
Lu7 Lu11 Lu12 98.3(9) . .
Lu7 Lu11 Lu12 129.9(12) 6_565 .
Lu7 Lu11 Lu12 129.9(12) . 6_565
Lu7 Lu11 Lu12 98.3(9) 6_565 6_565
Lu12 Lu11 Lu12 39.3(11) . 6_565
Lu7 Lu11 Lu10 113.7(12) . 6_565
Lu7 Lu11 Lu10 30.3(6) 6_565 6_565
Lu12 Lu11 Lu10 101.6(9) . 6_565
Lu12 Lu11 Lu10 68.0(7) 6_565 6_565
Lu7 Lu11 Lu10 30.3(6) . .
Lu7 Lu11 Lu10 113.7(12) 6_565 .
Lu12 Lu11 Lu10 68.0(7) . .
Lu12 Lu11 Lu10 101.6(9) 6_565 .
Lu10 Lu11 Lu10 117.6(10) 6_565 .
Lu7 Lu11 Lu3 17.6(5) . .
Lu7 Lu11 Lu3 86.8(11) 6_565 .
Lu12 Lu11 Lu3 92.3(8) . .
Lu12 Lu11 Lu3 116.6(10) 6_565 .
Lu10 Lu11 Lu3 99.1(8) 6_565 .
Lu10 Lu11 Lu3 28.6(4) . .
Lu7 Lu11 Lu3 86.8(11) . 6_565
Lu7 Lu11 Lu3 17.6(5) 6_565 6_565
Lu12 Lu11 Lu3 116.6(10) . 6_565
Lu12 Lu11 Lu3 92.3(8) 6_565 6_565
Lu10 Lu11 Lu3 28.6(4) 6_565 6_565
Lu10 Lu11 Lu3 99.1(8) . 6_565
Lu3 Lu11 Lu3 74.6(7) . 6_565
Lu7 Lu11 Lu4 51.3(7) . .
Lu7 Lu11 Lu4 51.3(7) 6_565 .
Lu12 Lu11 Lu4 105.8(11) . .
Lu12 Lu11 Lu4 105.8(11) 6_565 .
Lu10 Lu11 Lu4 62.5(6) 6_565 .
Lu10 Lu11 Lu4 62.5(6) . .
Lu3 Lu11 Lu4 37.4(3) . .
Lu3 Lu11 Lu4 37.4(3) 6_565 .
Lu7 Lu11 Lu13 51.2(8) . .
Lu7 Lu11 Lu13 107.1(10) 6_565 .
Lu12 Lu11 Lu13 52.2(9) . .
Lu12 Lu11 Lu13 78.7(9) 6_565 .
Lu10 Lu11 Lu13 99.1(7) 6_565 .
Lu10 Lu11 Lu13 25.1(5) . .
Lu3 Lu11 Lu13 40.7(6) . .
Lu3 Lu11 Lu13 89.8(7) 6_565 .
Lu4 Lu11 Lu13 59.8(6) . .
Lu7 Lu11 Lu13 107.1(10) . 6_565
Lu7 Lu11 Lu13 51.2(8) 6_565 6_565
Lu12 Lu11 Lu13 78.8(9) . 6_565
Lu12 Lu11 Lu13 52.2(9) 6_565 6_565
Lu10 Lu11 Lu13 25.1(5) 6_565 6_565
Lu10 Lu11 Lu13 99.1(7) . 6_565
Lu3 Lu11 Lu13 89.8(7) . 6_565
Lu3 Lu11 Lu13 40.7(6) 6_565 6_565
Lu4 Lu11 Lu13 59.8(6) . 6_565
Lu13 Lu11 Lu13 77.0(7) . 6_565
Lu7 Lu11 Lu9 74.4(9) . 6_565
Lu7 Lu11 Lu9 113.0(8) 6_565 6_565
Lu12 Lu11 Lu9 30.6(9) . 6_565
Lu12 Lu11 Lu9 55.9(9) 6_565 6_565
Lu10 Lu11 Lu9 93.8(7) 6_565 6_565
Lu10 Lu11 Lu9 45.8(7) . 6_565
Lu3 Lu11 Lu9 64.1(6) . 6_565
Lu3 Lu11 Lu9 95.9(5) 6_565 6_565
Lu4 Lu11 Lu9 76.0(4) . 6_565
Lu13 Lu11 Lu9 23.6(5) . 6_565
Lu13 Lu11 Lu9 68.8(6) 6_565 6_565
Lu12 Lu12 Lu9 115.4(10) 6_565 6_565
Lu12 Lu12 Lu11 70.4(6) 6_565 .
Lu9 Lu12 Lu11 117.7(11) 6_565 .
Lu12 Lu12 Lu5 89.1(6) 6_565 6_565
Lu9 Lu12 Lu5 27.3(11) 6_565 6_565
Lu11 Lu12 Lu5 117.5(9) . 6_565
Lu12 Lu12 Lu1 73.0(5) 6_565 .
Lu9 Lu12 Lu1 117.0(10) 6_565 .
Lu11 Lu12 Lu1 2.6(2) . .
Lu5 Lu12 Lu1 118.2(8) 6_565 .
Lu12 Lu12 Lu10 124.5(7) 6_565 .
Lu9 Lu12 Lu10 64.2(11) 6_565 .
Lu11 Lu12 Lu10 64.6(9) . .
Lu5 Lu12 Lu10 84.5(10) 6_565 .
Lu1 Lu12 Lu10 62.5(9) . .
Lu12 Lu12 Lu5 59.3(8) 6_565 .
Lu9 Lu12 Lu5 56.5(14) 6_565 .
Lu11 Lu12 Lu5 103.3(8) . .
Lu5 Lu12 Lu5 29.8(5) 6_565 .
Lu1 Lu12 Lu5 105.1(7) . .
Lu10 Lu12 Lu5 101.4(9) . .
Lu12 Lu12 Lu13 122.3(6) 6_565 .
Lu9 Lu12 Lu13 30.0(9) 6_565 .
Lu11 Lu12 Lu13 91.3(9) . .
Lu5 Lu12 Lu13 51.1(8) 6_565 .
Lu1 Lu12 Lu13 90.0(8) . .
Lu10 Lu12 Lu13 34.5(6) . .
Lu5 Lu12 Lu13 74.0(10) . .
Lu12 Lu12 Lu7 99.2(6) 6_565 .
Lu9 Lu12 Lu7 90.4(11) 6_565 .
Lu11 Lu12 Lu7 33.5(6) . .
Lu5 Lu12 Lu7 102.4(8) 6_565 .
Lu1 Lu12 Lu7 31.4(7) . .
Lu10 Lu12 Lu7 31.1(6) . .
Lu5 Lu12 Lu7 105.3(6) . .
Lu13 Lu12 Lu7 60.9(7) . .
Lu12 Lu12 Lu9 38.9(10) 6_565 .
Lu9 Lu12 Lu9 76.5(17) 6_565 .
Lu11 Lu12 Lu9 87.8(10) . .
Lu5 Lu12 Lu9 50.6(9) 6_565 .
Lu1 Lu12 Lu9 90.0(10) . .
Lu10 Lu12 Lu9 107.9(7) . .
Lu5 Lu12 Lu9 21.2(6) . .
Lu13 Lu12 Lu9 88.5(10) . .
Lu7 Lu12 Lu9 100.1(8) . .
Lu12 Lu12 Lu6 76.7(5) 6_565 .
Lu9 Lu12 Lu6 38.7(10) 6_565 .
Lu11 Lu12 Lu6 105.5(8) . .
Lu5 Lu12 Lu6 14.5(2) 6_565 .
Lu1 Lu12 Lu6 106.7(6) . .
Lu10 Lu12 Lu6 85.6(9) . .
Lu5 Lu12 Lu6 18.7(3) . .
Lu13 Lu12 Lu6 55.8(8) . .
Lu7 Lu12 Lu6 96.7(7) . .
Lu9 Lu12 Lu6 37.8(7) . .
Lu12 Lu12 Lu7 56.0(4) 6_565 6_565
Lu9 Lu12 Lu7 107.6(7) 6_565 6_565
Lu11 Lu12 Lu7 21.0(5) . 6_565
Lu5 Lu12 Lu7 99.7(7) 6_565 6_565
Lu1 Lu12 Lu7 23.2(5) . 6_565
Lu10 Lu12 Lu7 71.0(9) . 6_565
Lu5 Lu12 Lu7 82.4(6) . 6_565
Lu13 Lu12 Lu7 87.8(7) . 6_565
Lu7 Lu12 Lu7 43.2(8) . 6_565
Lu9 Lu12 Lu7 66.9(8) . 6_565
Lu6 Lu12 Lu7 86.5(6) . 6_565
Lu9 Lu13 Lu10 112(2) 6_565 .
Lu9 Lu13 Lu8 64.8(11) 6_565 6_565
Lu10 Lu13 Lu8 134.9(9) . 6_565
Lu9 Lu13 Lu5 22.6(8) 6_565 6_565
Lu10 Lu13 Lu5 119.6(17) . 6_565
Lu8 Lu13 Lu5 43.6(6) 6_565 6_565
Lu9 Lu13 Lu3 127.4(14) 6_565 .
Lu10 Lu13 Lu3 33.3(7) . .
Lu8 Lu13 Lu3 109.4(9) 6_565 .
Lu5 Lu13 Lu3 120.1(7) 6_565 .
Lu9 Lu13 Lu6 42.7(10) 6_565 .
Lu10 Lu13 Lu6 124.4(11) . .
Lu8 Lu13 Lu6 24.6(5) 6_565 .
Lu5 Lu13 Lu6 20.2(4) 6_565 .
Lu3 Lu13 Lu6 112.0(5) . .
Lu9 Lu13 Lu12 45.0(16) 6_565 .
Lu10 Lu13 Lu12 68.1(16) . .
Lu8 Lu13 Lu12 91.0(11) 6_565 .
Lu5 Lu13 Lu12 53.7(12) 6_565 .
Lu3 Lu13 Lu12 85.1(12) . .
Lu6 Lu13 Lu12 67.3(10) . .
Lu9 Lu13 Lu7 103.8(16) 6_565 .
Lu10 Lu13 Lu7 22.3(6) . .
Lu8 Lu13 Lu7 112.6(6) 6_565 .
Lu5 Lu13 Lu7 103.4(10) 6_565 .
Lu3 Lu13 Lu7 26.2(5) . .
Lu6 Lu13 Lu7 103.6(6) . .
Lu12 Lu13 Lu7 59.6(11) . .
Lu9 Lu13 Lu2 79.0(12) 6_565 .
Lu10 Lu13 Lu2 121.7(9) . .
Lu8 Lu13 Lu2 17.3(5) 6_565 .
Lu5 Lu13 Lu2 56.6(5) 6_565 .
Lu3 Lu13 Lu2 93.0(7) . .
Lu6 Lu13 Lu2 36.5(4) . .
Lu12 Lu13 Lu2 95.4(7) . .
Lu7 Lu13 Lu2 100.5(4) . .
Lu9 Lu13 Lu8 62.6(11) 6_565 .
Lu10 Lu13 Lu8 117.9(8) . .
Lu8 Lu13 Lu8 17.7(4) 6_565 .
Lu5 Lu13 Lu8 40.1(5) 6_565 .
Lu3 Lu13 Lu8 96.4(5) . .
Lu6 Lu13 Lu8 20.5(4) . .
Lu12 Lu13 Lu8 77.7(8) . .
Lu7 Lu13 Lu8 95.6(5) . .
Lu2 Lu13 Lu8 18.5(4) . .
Lu9 Lu13 Lu5 36.9(8) 6_565 .
Lu10 Lu13 Lu5 109.7(12) . .
Lu8 Lu13 Lu5 39.3(5) 6_565 .
Lu5 Lu13 Lu5 17.3(2) 6_565 .
Lu3 Lu13 Lu5 103.8(5) . .
Lu6 Lu13 Lu5 16.1(3) . .
Lu12 Lu13 Lu5 51.8(8) . .
Lu7 Lu13 Lu5 90.4(7) . .
Lu2 Lu13 Lu5 47.2(3) . .
Lu8 Lu13 Lu5 28.8(4) . .
Lu9 Lu13 Lu4 115.9(9) 6_565 .
Lu10 Lu13 Lu4 67.6(9) . .
Lu8 Lu13 Lu4 74.0(7) 6_565 .
Lu5 Lu13 Lu4 97.7(5) 6_565 .
Lu3 Lu13 Lu4 36.0(4) . .
Lu6 Lu13 Lu4 82.4(4) . .
Lu12 Lu13 Lu4 91.9(8) . .
Lu7 Lu13 Lu4 51.3(5) . .
Lu2 Lu13 Lu4 57.2(4) . .
Lu8 Lu13 Lu4 63.5(4) . .
Lu5 Lu13 Lu4 80.6(3) . .
C9 C1 C5 116.9 . .
C9 C1 C2 113.4 . .
C5 C1 C2 111.5 . .
C12 C2 C3 123.4 . .
C12 C2 C1 124.9 . .
C3 C2 C1 105.5 . .
C2 C3 C15 120.7 . .
C2 C3 C4 107.7 . .
C15 C3 C4 122.4 . .
C18 C4 C5 127.2 . .
C18 C4 C3 115.1 . .
C5 C4 C3 111.0 . .
C4 C5 C1 103.2 . .
C4 C5 C6 128.8 . .
C1 C5 C6 124.3 . .
C5 C6 C20 105.0 . .
C5 C6 C7 118.8 . .
C20 C6 C7 120.5 . .
C8 C7 C6 114.3 . .
C8 C7 C23 121.6 . .
C6 C7 C23 114.2 . .
C9 C8 C7 124.2 . .
C9 C8 C26 100.8 . .
C7 C8 C26 130.4 . .
C1 C9 C10 120.3 . .
C1 C9 C8 119.8 . .
C10 C9 C8 113.2 . .
C11 C10 C9 127.2 . .
C11 C10 C27 124.3 . .
C9 C10 C27 107.1 . .
C10 C11 C30 108.8 . .
C10 C11 C12 110.0 . .
C30 C11 C12 121.0 . .
C13 C12 C2 116.1 . .
C13 C12 C11 116.5 . .
C2 C12 C11 122.1 . .
C12 C13 C14 121.5 . .
C12 C13 C32 122.0 . .
C14 C13 C32 106.1 . .
C15 C14 C34 121.4 . .
C15 C14 C13 121.6 . .
C34 C14 C13 107.4 . .
C14 C15 C3 116.1 . .
C14 C15 C16 117.0 . .
C3 C15 C16 120.5 . .
C17 C16 C36 120.9 . .
C17 C16 C15 113.7 . .
C36 C16 C15 120.4 . .
C39 C17 C18 105.0 . .
C39 C17 C16 121.3 . .
C18 C17 C16 125.4 . .
C19 C18 C4 109.9 . .
C19 C18 C17 110.4 . .
C4 C18 C17 122.0 . .
C18 C19 C40 105.6 . .
C18 C19 C20 125.6 . .
C40 C19 C20 125.0 . .
C6 C20 C21 122.9 . .
C6 C20 C19 122.9 . .
C21 C20 C19 108.8 . .
C20 C21 C22 115.0 . .
C20 C21 C42 128.3 . .
C22 C21 C42 106.8 . .
C23 C22 C21 121.7 . .
C23 C22 C44 115.9 . .
C21 C22 C44 110.9 . .
C22 C23 C7 124.4 . .
C22 C23 C24 112.9 . .
C7 C23 C24 109.3 . .
C25 C24 C46 103.6 . .
C25 C24 C23 118.1 . .
C46 C24 C23 129.8 . .
C26 C25 C24 126.0 . .
C26 C25 C48 109.2 . .
C24 C25 C48 114.0 . .
C25 C26 C27 122.9 . .
C25 C26 C8 114.3 . .
C27 C26 C8 112.9 . .
C10 C27 C26 105.2 . .
C10 C27 C28 122.5 . .
C26 C27 C28 125.0 . .
C49 C28 C27 115.2 . .
C49 C28 C29 119.2 . .
C27 C28 C29 117.1 . .
C52 C29 C30 109.3 . .
C52 C29 C28 125.6 . .
C30 C29 C28 110.8 . .
C11 C30 C31 118.6 . .
C11 C30 C29 134.6 . .
C31 C30 C29 103.4 . .
C32 C31 C53 120.0 . .
C32 C31 C30 119.0 . .
C53 C31 C30 113.5 . .
C31 C32 C33 115.9 . .
C31 C32 C13 121.6 . .
C33 C32 C13 111.5 . .
C32 C33 C55 124.1 . .
C32 C33 C34 104.0 . .
C55 C33 C34 120.8 . .
C35 C34 C14 121.5 . .
C35 C34 C33 123.3 . .
C14 C34 C33 110.9 . .
C34 C35 C57 113.3 . .
C34 C35 C36 116.0 . .
C57 C35 C36 122.4 . .
C16 C36 C37 113.4 . .
C16 C36 C35 123.0 . .
C37 C36 C35 110.0 . .
C36 C37 C59 128.0 . .
C36 C37 C38 123.6 . .
C59 C37 C38 104.6 . .
C39 C38 C37 116.0 . .
C39 C38 C61 126.2 . .
C37 C38 C61 110.5 . .
C38 C39 C17 124.1 . .
C38 C39 C40 120.3 . .
C17 C39 C40 109.7 . .
C39 C40 C19 107.9 . .
C39 C40 C41 118.7 . .
C19 C40 C41 125.6 . .
C62 C41 C42 113.6 . .
C62 C41 C40 123.7 . .
C42 C41 C40 112.3 . .
C43 C42 C21 106.7 . .
C43 C42 C41 125.7 . .
C21 C42 C41 119.4 . .
C64 C43 C42 119.3 . .
C64 C43 C44 116.8 . .
C42 C43 C44 111.8 . .
C43 C44 C22 102.9 . .
C43 C44 C45 119.2 . .
C22 C44 C45 130.5 . .
C46 C45 C66 110.6 . .
C46 C45 C44 121.0 . .
C66 C45 C44 122.3 . .
C47 C46 C24 109.7 . .
C47 C46 C45 125.7 . .
C24 C46 C45 109.5 . .
C68 C47 C46 118.8 . .
C68 C47 C48 120.8 . .
C46 C47 C48 109.9 . .
C49 C48 C25 132.1 . .
C49 C48 C47 117.9 . .
C25 C48 C47 102.3 . .
C48 C49 C50 125.8 . .
C48 C49 C28 114.9 . .
C50 C49 C28 113.4 . .
C49 C50 C69 113.4 . .
C49 C50 C51 131.2 . .
C69 C50 C51 103.9 . .
C72 C51 C52 119.2 . .
C72 C51 C50 120.5 . .
C52 C51 C50 111.2 . .
C29 C52 C53 109.9 . .
C29 C52 C51 118.3 . .
C53 C52 C51 116.2 . .
C54 C53 C31 126.9 . .
C54 C53 C52 121.1 . .
C31 C53 C52 103.2 . .
C53 C54 C73 123.8 . .
C53 C54 C55 111.9 . .
C73 C54 C55 119.9 . .
C56 C55 C33 116.1 . .
C56 C55 C54 114.8 . .
C33 C55 C54 120.4 . .
C57 C56 C75 108.3 . .
C57 C56 C55 119.3 . .
C75 C56 C55 124.9 . .
C56 C57 C58 104.5 . .
C56 C57 C35 126.7 . .
C58 C57 C35 123.6 . .
C59 C58 C57 116.7 . .
C59 C58 C76 117.4 . .
C57 C58 C76 112.4 . .
C58 C59 C37 118.6 . .
C58 C59 C60 120.0 . .
C37 C59 C60 112.5 . .
C78 C60 C59 120.7 . .
C78 C60 C61 106.1 . .
C59 C60 C61 105.8 . .
C60 C61 C38 106.4 . .
C60 C61 C62 125.3 . .
C38 C61 C62 120.0 . .
C41 C62 C63 119.8 . .
C41 C62 C61 110.6 . .
C63 C62 C61 120.6 . .
C62 C63 C64 126.1 . .
C62 C63 C79 117.1 . .
C64 C63 C79 105.6 . .
C43 C64 C63 114.7 . .
C43 C64 C65 127.5 . .
C63 C64 C65 109.4 . .
C80 C65 C64 106.9 . .
C80 C65 C66 130.2 . .
C64 C65 C66 117.7 . .
C67 C66 C45 124.7 . .
C67 C66 C65 112.4 . .
C45 C66 C65 116.3 . .
C66 C67 C68 120.1 . .
C66 C67 C82 117.9 . .
C68 C67 C82 107.8 . .
C47 C68 C69 119.0 . .
C47 C68 C67 118.6 . .
C69 C68 C67 109.9 . .
C68 C69 C70 105.1 . .
C68 C69 C50 122.4 . .
C70 C69 C50 129.6 . .
C71 C70 C69 117.2 . .
C71 C70 C82 122.4 . .
C69 C70 C82 109.6 . .
C70 C71 C84 116.7 . .
C70 C71 C72 123.5 . .
C84 C71 C72 109.7 . .
C51 C72 C73 126.4 . .
C51 C72 C71 124.5 . .
C73 C72 C71 106.3 . .
C54 C73 C74 122.5 . .
C54 C73 C72 111.5 . .
C74 C73 C72 107.7 . .
C75 C74 C73 114.3 . .
C75 C74 C84 128.4 . .
C73 C74 C84 110.5 . .
C74 C75 C56 122.3 . .
C74 C75 C76 117.6 . .
C56 C75 C76 110.5 . .
C75 C76 C58 102.9 . .
C75 C76 C77 128.6 . .
C58 C76 C77 121.7 . .
C78 C77 C83 114.5 . .
C78 C77 C76 119.8 . .
C83 C77 C76 113.8 . .
C60 C78 C77 111.9 . .
C60 C78 C79 133.0 . .
C77 C78 C79 115.1 . .
C80 C79 C78 124.4 . .
C80 C79 C63 109.0 . .
C78 C79 C63 113.5 . .
C81 C80 C65 118.8 . .
C81 C80 C79 117.3 . .
C65 C80 C79 108.5 . .
C83 C81 C80 112.8 . .
C83 C81 C82 133.7 . .
C80 C81 C82 110.5 . .
C67 C82 C70 105.8 . .
C67 C82 C81 128.0 . .
C70 C82 C81 117.7 . .
C81 C83 C77 130.2 . .
C81 C83 C84 89.5 . .
C77 C83 C84 124.8 . .
C71 C84 C74 104.5 . .
C71 C84 C83 138.6 . .
C74 C84 C83 106.1 . .
N1A Ni1A N3A 177.7(2) . .
N1A Ni1A N2A 90.06(11) . .
N3A Ni1A N2A 89.89(11) . .
N1A Ni1A N2A 90.05(11) . 6_565
N3A Ni1A N2A 89.89(11) . 6_565
N2A Ni1A N2A 177.4(2) . 6_565
C13A N2A C6A 104.3(4) . .
C13A N2A Ni1A 128.0(3) . .
C6A N2A Ni1A 127.7(3) . .
C3A C2A C1A 113.2(5) . .
C15A N3A C15A 105.0(5) . 6_565
C15A N3A Ni1A 127.4(3) . .
C15A N3A Ni1A 127.4(3) 6_565 .
C16A C17A C18A 111.9(5) . .
C16A C16A C15A 106.9(3) 6_565 .
C16A C16A C17A 128.1(3) 6_565 .
C15A C16A C17A 124.7(5) . .
C14A C15A N3A 125.5(4) . .
C14A C15A C16A 123.9(5) . .
N3A C15A C16A 110.6(4) . .
C15A C14A C13A 124.6(5) . .
C14A C13A N2A 124.6(5) . .
C14A C13A C10A 123.9(5) . .
N2A C13A C10A 111.5(4) . .
C10A C11A C12A 112.9(5) . .
C7A C10A C13A 106.9(4) . .
C7A C10A C11A 128.1(5) . .
C13A C10A C11A 125.0(5) . .
C7A C8A C9A 113.2(5) . .
C10A C7A C6A 106.1(4) . .
C10A C7A C8A 128.9(5) . .
C6A C7A C8A 125.0(5) . .
C5A C6A N2A 124.8(5) . .
C5A C6A C7A 124.0(5) . .
N2A C6A C7A 111.2(4) . .
C6A C5A C4A 124.5(5) . .
N1A C4A C5A 124.8(4) . .
N1A C4A C3A 111.7(5) . .
C5A C4A C3A 123.4(5) . .
C3A C3A C4A 106.4(3) 6_565 .
C3A C3A C2A 129.0(3) 6_565 .
C4A C3A C2A 124.5(5) . .
C4A N1A C4A 103.9(5) . 6_565
C4A N1A Ni1A 128.0(3) . .
C4A N1A Ni1A 128.0(3) 6_565 .
C1B Cl1B C1B 22.5(12) 6_565 .
C1B C1B Cl3B 96.7(7) 6_565 6_565
C1B C1B Cl2B 78.2(6) 6_565 .
Cl3B C1B Cl2B 124.3(14) 6_565 .
C1B C1B Cl1B 78.7(6) 6_565 .
Cl3B C1B Cl1B 119.3(15) 6_565 .
Cl2B C1B Cl1B 114.0(14) . .
C1B C1B Cl3B 61.6(6) 6_565 .
Cl3B C1B Cl3B 35.2(7) 6_565 .
Cl2B C1B Cl3B 112.4(12) . .
Cl1B C1B Cl3B 108.6(12) . .
Cl3B Cl3B C1B 83.3(7) 6_565 6_565
Cl3B Cl3B C1B 61.6(6) 6_565 .
C1B Cl3B C1B 21.7(11) 6_565 .
C1B Cl2B C1B 23.5(13) . 6_565
Cl1C C5C Cl3C 118(2) . .
Cl1C C5C Cl2C 103.9(15) . .
Cl3C C5C Cl2C 106.6(15) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Lu1 Lu7 1.24(2) .
Lu1 Lu7 1.24(2) 6_565
Lu1 Lu12 2.06(4) .
Lu1 Lu12 2.06(4) 6_565
Lu1 Lu3 2.220(10) .
Lu1 Lu3 2.220(10) 6_565
Lu1 Lu10 2.247(15) .
Lu1 Lu10 2.247(15) 6_565
Lu1 Lu4 2.928(10) .
Lu1 Lu13 3.142(17) .
Lu1 Lu13 3.142(17) 6_565
Lu1 Lu9 3.242(13) 6_565
Lu2 Lu8 0.904(18) 6_565
Lu2 Lu8 0.904(18) .
Lu2 Lu6 1.514(12) .
Lu2 Lu5 2.141(11) 6_565
Lu2 Lu5 2.141(11) .
Lu2 Lu13 2.479(18) .
Lu2 Lu13 2.479(18) 6_565
Lu2 Lu9 2.549(11) 6_565
Lu2 Lu9 2.549(11) .
Lu2 Lu4 2.655(9) .
Lu2 Lu3 3.240(7) 6_565
Lu2 Lu3 3.240(7) .
Lu3 Lu7 1.08(2) .
Lu3 Lu10 1.107(13) .
Lu3 Lu4 1.817(8) .
Lu3 Lu13 1.961(18) .
Lu3 Lu11 2.271(19) .
Lu3 Lu7 2.564(12) 6_565
Lu3 Lu3 2.752(16) 6_565
Lu3 Lu9 2.88(2) 6_565
Lu3 Lu12 2.95(2) .
Lu3 Lu8 3.106(13) 6_565
Lu4 Lu3 1.817(8) 6_565
Lu4 Lu7 2.395(16) .
Lu4 Lu7 2.395(16) 6_565
Lu4 Lu10 2.776(13) .
Lu4 Lu10 2.776(13) 6_565
Lu4 Lu11 2.99(2) .
Lu4 Lu13 2.991(19) .
Lu4 Lu13 2.991(19) 6_565
Lu4 Lu8 3.050(11) .
Lu5 Lu6 0.859(11) .
Lu5 Lu9 0.91(3) .
Lu5 Lu5 1.142(12) 6_565
Lu5 Lu8 1.395(17) .
Lu5 Lu8 1.815(12) 6_565
Lu5 Lu13 1.91(2) 6_565
Lu5 Lu9 1.97(3) 6_565
Lu5 Lu12 1.98(4) 6_565
Lu5 Lu12 2.30(3) .
Lu5 Lu13 2.815(19) .
Lu5 Lu10 2.854(12) 6_565
Lu6 Lu5 0.859(11) 6_565
Lu6 Lu8 1.018(12) 6_565
Lu6 Lu8 1.018(12) .
Lu6 Lu9 1.66(2) .
Lu6 Lu9 1.66(2) 6_565
Lu6 Lu13 2.344(16) 6_565
Lu6 Lu13 2.344(16) .
Lu6 Lu12 2.62(4) 6_565
Lu6 Lu12 2.62(4) .
Lu6 Lu10 3.322(12) 6_565
Lu7 Lu10 1.25(2) .
Lu7 Lu11 1.33(2) .
Lu7 Lu7 1.96(3) 6_565
Lu7 Lu12 2.38(3) .
Lu7 Lu13 2.409(19) .
Lu7 Lu3 2.564(12) 6_565
Lu7 Lu12 2.83(3) 6_565
Lu7 Lu9 2.95(2) 6_565
Lu7 Lu10 2.991(19) 6_565
Lu8 Lu8 1.18(3) 6_565
Lu8 Lu9 1.73(2) .
Lu8 Lu5 1.815(12) 6_565
Lu8 Lu13 1.85(2) 6_565
Lu8 Lu9 2.483(18) 6_565
Lu8 Lu13 2.796(17) .
Lu8 Lu10 2.981(19) 6_565
Lu8 Lu12 3.03(3) 6_565
Lu9 Lu13 1.23(3) 6_565
Lu9 Lu12 1.74(4) 6_565
Lu9 Lu5 1.97(3) 6_565
Lu9 Lu10 2.17(3) 6_565
Lu9 Lu8 2.483(18) 6_565
Lu9 Lu12 2.50(2) .
Lu9 Lu9 2.69(4) 6_565
Lu9 Lu3 2.88(2) 6_565
Lu10 Lu13 1.38(2) .
Lu10 Lu9 2.17(3) 6_565
Lu10 Lu11 2.200(17) .
Lu10 Lu12 2.26(2) .
Lu10 Lu5 2.854(12) 6_565
Lu10 Lu8 2.981(19) 6_565
Lu10 Lu7 2.991(19) 6_565
Lu10 Lu12 3.10(3) 6_565
Lu11 Lu7 1.33(2) 6_565
Lu11 Lu12 1.79(4) .
Lu11 Lu12 1.79(4) 6_565
Lu11 Lu10 2.200(17) 6_565
Lu11 Lu3 2.271(19) 6_565
Lu11 Lu13 3.01(2) .
Lu11 Lu13 3.01(2) 6_565
Lu11 Lu9 3.022(18) 6_565
Lu12 Lu12 1.20(4) 6_565
Lu12 Lu9 1.74(4) 6_565
Lu12 Lu5 1.98(4) 6_565
Lu12 Lu13 2.38(4) .
Lu12 Lu7 2.83(3) 6_565
Lu13 Lu9 1.23(3) 6_565
Lu13 Lu8 1.85(2) 6_565
Lu13 Lu5 1.91(2) 6_565
C1 C9 1.3513 .
C1 C5 1.3854 .
C1 C2 1.3957 .
C2 C12 1.3607 .
C2 C3 1.3749 .
C3 C15 1.3758 .
C3 C4 1.3845 .
C4 C18 1.3273 .
C4 C5 1.3835 .
C5 C6 1.3896 .
C6 C20 1.4254 .
C6 C7 1.4393 .
C7 C8 1.4124 .
C7 C23 1.4432 .
C8 C9 1.4104 .
C8 C26 1.4367 .
C9 C10 1.4056 .
C10 C11 1.3582 .
C10 C27 1.4073 .
C11 C30 1.3901 .
C11 C12 1.4173 .
C12 C13 1.3501 .
C13 C14 1.4025 .
C13 C32 1.4104 .
C14 C15 1.3699 .
C14 C34 1.3999 .
C15 C16 1.3854 .
C16 C17 1.3566 .
C16 C36 1.3651 .
C17 C39 1.2971 .
C17 C18 1.3300 .
C18 C19 1.3000 .
C19 C40 1.3204 .
C19 C20 1.5199 .
C20 C21 1.4304 .
C21 C22 1.4453 .
C21 C42 1.4553 .
C22 C23 1.3678 .
C22 C44 1.4675 .
C23 C24 1.7608 .
C24 C25 1.4390 .
C24 C46 1.4440 .
C25 C26 1.3617 .
C25 C48 1.4526 .
C26 C27 1.4216 .
C27 C28 1.4325 .
C28 C49 1.4123 .
C28 C29 1.4582 .
C29 C52 1.4257 .
C29 C30 1.4310 .
C30 C31 1.4290 .
C31 C32 1.3165 .
C31 C53 1.4231 .
C32 C33 1.4017 .
C33 C55 1.4030 .
C33 C34 1.4081 .
C34 C35 1.3607 .
C35 C57 1.3854 .
C35 C36 1.3871 .
C36 C37 1.3866 .
C37 C59 1.3939 .
C37 C38 1.4188 .
C38 C39 1.2647 .
C38 C61 1.4340 .
C39 C40 1.3154 .
C40 C41 1.5086 .
C41 C62 1.4129 .
C41 C42 1.4627 .
C42 C43 1.4381 .
C43 C64 1.3876 .
C43 C44 1.4553 .
C44 C45 1.5162 .
C45 C46 1.4466 .
C45 C66 1.4644 .
C46 C47 1.4412 .
C47 C68 1.3901 .
C47 C48 1.4622 .
C48 C49 1.4028 .
C49 C50 1.4110 .
C50 C69 1.4911 .
C50 C51 1.4935 .
C51 C72 1.2760 .
C51 C52 1.4618 .
C52 C53 1.4311 .
C53 C54 1.3622 .
C54 C73 1.3927 .
C54 C55 1.4203 .
C55 C56 1.3979 .
C56 C57 1.3659 .
C56 C75 1.3689 .
C57 C58 1.3676 .
C58 C59 1.3255 .
C58 C76 1.3716 .
C59 C60 1.4192 .
C60 C78 1.3770 .
C60 C61 1.4318 .
C61 C62 1.4662 .
C62 C63 1.4143 .
C63 C64 1.4469 .
C63 C79 1.4652 .
C64 C65 1.4604 .
C65 C80 1.4333 .
C65 C66 1.4941 .
C66 C67 1.4012 .
C67 C68 1.4514 .
C67 C82 1.4573 .
C68 C69 1.4361 .
C69 C70 1.4605 .
C70 C71 1.0343 .
C70 C82 1.4611 .
C71 C84 1.4959 .
C71 C72 1.4963 .
C72 C73 1.4922 .
C73 C74 1.4584 .
C74 C75 1.3595 .
C74 C84 1.5043 .
C75 C76 1.3689 .
C76 C77 1.4149 .
C77 C78 1.3898 .
C77 C83 1.4127 .
C78 C79 1.4354 .
C79 C80 1.4348 .
C80 C81 1.3919 .
C81 C83 1.3726 .
C81 C82 1.5629 .
C83 C84 1.6399 .
Ni1A N1A 1.956(6) .
Ni1A N3A 1.964(6) .
Ni1A N2A 1.967(4) .
Ni1A N2A 1.967(4) 6_565
C1A C2A 1.523(9) .
N2A C13A 1.378(6) .
N2A C6A 1.382(6) .
C2A C3A 1.494(7) .
N3A C15A 1.376(6) .
N3A C15A 1.376(6) 6_565
C18A C17A 1.524(9) .
C17A C16A 1.505(7) .
C16A C16A 1.346(11) 6_565
C16A C15A 1.441(7) .
C15A C14A 1.366(7) .
C14A C13A 1.374(7) .
C13A C10A 1.437(7) .
C12A C11A 1.528(9) .
C11A C10A 1.507(7) .
C10A C7A 1.362(8) .
C9A C8A 1.537(10) .
C8A C7A 1.483(7) .
C7A C6A 1.449(7) .
C6A C5A 1.370(7) .
C5A C4A 1.379(7) .
C4A N1A 1.377(6) .
C4A C3A 1.444(7) .
C3A C3A 1.353(12) 6_565
N1A C4A 1.377(6) 6_565
Cl1B C1B 1.71(2) 6_565
Cl1B C1B 1.71(2) .
C1B C1B 0.67(3) 6_565
C1B Cl3B 1.59(2) 6_565
C1B Cl2B 1.64(2) .
C1B Cl3B 1.80(2) .
Cl3B Cl3B 1.041(17) 6_565
Cl3B C1B 1.59(2) 6_565
Cl2B C1B 1.64(2) 6_565
Cl1C C5C 1.72(2) .
C5C Cl3C 1.72(2) .
C5C Cl2C 1.73(2) .
