#------------------------------------------------------------------------------
#$Date: 2019-11-08 02:03:28 +0200 (Fri, 08 Nov 2019) $
#$Revision: 224655 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/55/18/1551819.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_1551819
loop_
_publ_author_name
'Hu, Shuaifeng'
'Zhao, Pei'
'Shen, Wangqiang'
'Yu, Pengyuan'
'Huang, Wenhuan'
'Ehara, Masahiro'
'Xie, Yunpeng'
'Akasaka, Takeshi'
'Lu, Xing'
_publ_section_title
;
 Crystallographic characterization of Er₃N@C₂ₙ (2n =
 80, 82, 84, 88): the importance of a planar Er₃N cluster.
;
_journal_issue                   28
_journal_name_full               Nanoscale
_journal_page_first              13415
_journal_page_last               13422
_journal_paper_doi               10.1039/c9nr04330f
_journal_volume                  11
_journal_year                    2019
_chemical_formula_moiety         'C82,Er3 N,C36 H44 N4 Ni,2(C6 H6)'
_chemical_formula_sum            'C130 H56 Er3 N5 Ni S0'
_chemical_formula_weight         2248.28
_chemical_name_common            'Er3N@C2v-C82 Ni(OEP)'
_chemical_name_systematic        'Er3N@C2v-C82 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-2018/1
_audit_update_record
;
2019-05-12 deposited with the CCDC.    2019-06-19 downloaded from the CCDC.
;
_cell_angle_alpha                90.000(5)
_cell_angle_beta                 95.273(5)
_cell_angle_gamma                90.000(5)
_cell_formula_units_Z            4
_cell_length_a                   25.548(5)
_cell_length_b                   15.259(5)
_cell_length_c                   19.989(5)
_cell_measurement_reflns_used    9858
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      27.9048
_cell_measurement_theta_min      2.8595
_cell_volume                     7759(4)
_computing_cell_refinement       'SAINT (Bruker, 2017)'
_computing_data_collection       'Apex3 (Bruker, 2017)'
_computing_data_reduction        'SAINT (Bruker, 2017)'
_computing_publication_material  'SHELXL-2018/1 (Sheldrick, 2018)'
_computing_structure_refinement  'SHELXL-2018/1 (Sheldrick, 2018)'
_computing_structure_solution    'SHELXTL XT-2018/1 (Sheldrick, 2018)'
_diffrn_ambient_temperature      173(2)
_diffrn_detector_area_resol_mean 0.76
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device_type  'Bruker D8 Quest'
_diffrn_measurement_method       ω
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0582
_diffrn_reflns_av_unetI/netI     0.0429
_diffrn_reflns_Laue_measured_fraction_full 0.995
_diffrn_reflns_Laue_measured_fraction_max 0.991
_diffrn_reflns_limit_h_max       33
_diffrn_reflns_limit_h_min       -33
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       26
_diffrn_reflns_limit_l_min       -26
_diffrn_reflns_number            58620
_diffrn_reflns_point_group_measured_fraction_full 0.995
_diffrn_reflns_point_group_measured_fraction_max 0.991
_diffrn_reflns_theta_full        25.240
_diffrn_reflns_theta_max         27.999
_diffrn_reflns_theta_min         2.859
_diffrn_source                   'fine-focus sealed tube'
_exptl_absorpt_coefficient_mu    3.521
_exptl_absorpt_correction_T_max  0.7456
_exptl_absorpt_correction_T_min  0.5074
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            Black
_exptl_crystal_density_diffrn    1.925
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
_exptl_crystal_F_000             4412
_exptl_crystal_size_max          0.220
_exptl_crystal_size_mid          0.200
_exptl_crystal_size_min          0.100
_refine_diff_density_max         1.473
_refine_diff_density_min         -1.311
_refine_diff_density_rms         0.127
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.045
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     1250
_refine_ls_number_reflns         9633
_refine_ls_number_restraints     1973
_refine_ls_restrained_S_all      1.060
_refine_ls_R_factor_all          0.1326
_refine_ls_R_factor_gt           0.0917
_refine_ls_shift/su_max          0.060
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.1741P)²+55.8904P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2555
_refine_ls_wR_factor_ref         0.3079
_reflns_Friedel_coverage         0.000
_reflns_number_gt                6715
_reflns_number_total             9633
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            c9nr04330f2.cif
_cod_data_source_block           Er3N@C2v-C82
_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 

 Adding full bibliography for 1551818--1551822.cif.
;
_cod_database_code               1551819
_shelx_shelxl_version_number     2018/1
_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   0.511
_shelx_estimated_absorpt_t_max   0.720
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
N1 N 0.7057(3) 0.000000 0.1896(4) 0.0485(16) Uani 1 2 d S T P A 2
Er1 Er 0.67382(15) -0.08868(19) 0.2479(2) 0.0769(8) Uani 0.2155 1 d . U P A 2
Er2 Er 0.76649(10) -0.02552(17) 0.13175(13) 0.0579(7) Uani 0.1834 1 d . U P A 2
Er3 Er 0.6662(2) -0.1256(2) 0.1795(2) 0.0623(8) Uani 0.1833 1 d . U P A 2
Er4 Er 0.78111(14) -0.0254(3) 0.1648(3) 0.0822(15) Uani 0.1235 1 d . U P A 2
Er5 Er 0.6547(3) -0.1007(5) 0.2104(6) 0.0782(15) Uani 0.1105 1 d . U P A 2
Er6 Er 0.7394(6) 0.000000 0.1020(6) 0.098(3) Uani 0.0877 2 d S TU P A 2
Er7 Er 0.6839(4) -0.1287(6) 0.2050(8) 0.078(3) Uani 0.0832 1 d . U P A 2
Er8 Er 0.7058(6) -0.1053(7) 0.2531(6) 0.110(3) Uani 0.0689 1 d . U P A 2
Er9 Er 0.7008(6) -0.0363(12) 0.2861(6) 0.123(5) Uani 0.0534 1 d . U P A 2
Er10 Er 0.7028(12) 0.000000 0.0871(11) 0.137(6) Uani 0.0507 2 d S TU P A 2
Er11 Er 0.6344(6) -0.0656(11) 0.1837(12) 0.110(4) Uani 0.0505 1 d . U P A 2
Er12 Er 0.7695(7) -0.0578(14) 0.2329(11) 0.158(5) Uani 0.0492 1 d . U P A 2
Er13 Er 0.6327(7) -0.0309(13) 0.1364(12) 0.132(5) Uani 0.0431 1 d . U P A 2
Er14 Er 0.6766(11) -0.0560(19) 0.1015(13) 0.160(6) Uani 0.0424 1 d . U P A 2
Er15 Er 0.6581(10) -0.0971(15) 0.1421(13) 0.115(5) Uani 0.0408 1 d . U P A 2
Er16 Er 0.6972(11) -0.1263(14) 0.1484(13) 0.131(5) Uani 0.0408 1 d . U P A 2
Er17 Er 0.7419(15) 0.000000 0.2861(11) 0.130(8) Uani 0.0366 2 d S TU P A 2
Er18 Er 0.7372(11) -0.074(2) 0.2764(15) 0.132(6) Uani 0.034 1 d . U P A 2
Er19 Er 0.6220(15) 0.000000 0.185(3) 0.132(8) Uani 0.0304 2 d S TU P A 2
Er20 Er 0.7357(14) -0.127(2) 0.1924(19) 0.138(6) Uani 0.0263 1 d . U P A 2
Er21 Er 0.7290(17) -0.083(3) 0.121(2) 0.145(7) Uani 0.0249 1 d . U P A 2
Er22 Er 0.7542(15) -0.074(3) 0.164(2) 0.139(7) Uani 0.0237 1 d . U P A 2
C1 C 0.7749(11) 0.2031(16) 0.0922(12) 0.134(7) Uani 0.5 1 d D U P B -3
C2 C 0.7208(12) 0.2080(19) 0.0686(13) 0.131(8) Uani 0.5 1 d D U P B -3
C3 C 0.700(2) 0.139(2) 0.0151(17) 0.135(8) Uani 0.5 1 d . U P B -3
C4 C 0.7437(17) 0.084(2) 0.0053(11) 0.128(7) Uani 0.5 1 d . U P B -3
C5 C 0.7920(14) 0.128(2) 0.0554(15) 0.151(8) Uani 0.5 1 d D U P B -3
C6 C 0.8346(11) 0.076(2) 0.0858(15) 0.142(8) Uani 0.5 1 d D U P B -3
C7 C 0.8558(11) 0.091(2) 0.1558(16) 0.137(8) Uani 0.5 1 d D U P B -3
C8 C 0.8311(15) 0.158(2) 0.1950(17) 0.145(8) Uani 0.5 1 d D U P B -3
C9 C 0.7928(10) 0.2168(18) 0.1617(14) 0.129(7) Uani 0.5 1 d D U P B -3
C10 C 0.7551(9) 0.2562(12) 0.2016(12) 0.105(6) Uani 0.5 1 d D U P B -3
C11 C 0.7003(11) 0.272(2) 0.1751(14) 0.120(7) Uani 0.5 1 d D U P B -3
C12 C 0.6818(14) 0.246(2) 0.1080(15) 0.130(8) Uani 0.5 1 d D U P B -3
C13 C 0.6366(16) 0.2067(18) 0.0886(15) 0.142(8) Uani 0.5 1 d D U P B -3
C14 C 0.6252(15) 0.1372(17) 0.0367(16) 0.136(9) Uani 0.5 1 d D U P B -3
C15 C 0.648(2) 0.112(3) 0.010(2) 0.142(8) Uani 0.5 1 d . U P B -3
C16 C 0.6476(14) 0.016(2) -0.0102(10) 0.137(8) Uani 0.5 1 d . U P B -3
C17 C 0.6914(13) -0.047(2) -0.0151(10) 0.133(7) Uani 0.5 1 d D U P B -3
C18 C 0.7436(12) -0.018(2) -0.0036(11) 0.144(8) Uani 0.5 1 d D U P B -3
C19 C 0.7827(13) -0.074(2) 0.0247(15) 0.140(8) Uani 0.5 1 d D U P B -3
C20 C 0.8231(10) -0.021(3) 0.0539(13) 0.132(8) Uani 0.5 1 d . U P B -3
C21 C 0.8571(13) -0.051(2) 0.1239(15) 0.140(8) Uani 0.5 1 d D U P B -3
C22 C 0.8678(9) 0.018(2) 0.1730(14) 0.139(7) Uani 0.5 1 d D U P B -3
C23 C 0.8671(6) -0.003(2) 0.2437(11) 0.140(6) Uani 0.5 1 d D U P B -3
C24 C 0.8550(11) 0.0708(18) 0.2836(14) 0.140(8) Uani 0.5 1 d D U P B -3
C25 C 0.8370(12) 0.150(2) 0.2535(15) 0.137(8) Uani 0.5 1 d D U P B -3
C26 C 0.8000(13) 0.1885(19) 0.2920(18) 0.131(8) Uani 0.5 1 d D U P B -3
C27 C 0.7593(17) 0.233(3) 0.275(2) 0.118(7) Uani 0.5 1 d . U P B -3
C28 C 0.7097(12) 0.242(2) 0.2936(16) 0.124(7) Uani 0.5 1 d D U P B -3
C29 C 0.6756(11) 0.2735(19) 0.2357(18) 0.149(8) Uani 0.5 1 d D U P B -3
C30 C 0.6208(10) 0.2498(15) 0.2214(14) 0.157(9) Uani 0.5 1 d D U P B -3
C31 C 0.6143(11) 0.2085(16) 0.1550(13) 0.169(9) Uani 0.5 1 d D U P B -3
C32 C 0.5716(11) 0.1458(18) 0.1596(12) 0.159(9) Uani 0.5 1 d D U P B -3
C33 C 0.5589(11) 0.0735(18) 0.1098(13) 0.142(8) Uani 0.5 1 d D U P B -3
C34 C 0.5852(17) 0.0685(17) 0.0472(15) 0.165(8) Uani 0.5 1 d D U P B -3
C35 C 0.5968(10) -0.0185(15) 0.0204(11) 0.158(8) Uani 0.5 1 d D U P B -3
C36 C 0.5828(17) -0.0966(18) 0.0577(17) 0.176(9) Uani 0.5 1 d D U P B -3
C37 C 0.6186(15) -0.168(2) 0.0500(16) 0.157(9) Uani 0.5 1 d D U P B -3
C38 C 0.6743(14) -0.128(2) 0.007(2) 0.141(9) Uani 0.5 1 d D U P B -3
C39 C 0.7125(14) -0.184(2) 0.0393(16) 0.145(8) Uani 0.5 1 d D U P B -3
C40 C 0.7648(14) -0.157(2) 0.0475(15) 0.144(8) Uani 0.5 1 d D U P B -3
C41 C 0.8057(14) -0.168(2) 0.1035(14) 0.130(7) Uani 0.5 1 d . U P B -3
C42 C 0.8386(14) -0.1366(19) 0.1413(15) 0.145(8) Uani 0.5 1 d D U P B -3
C43 C 0.8397(13) -0.157(2) 0.2127(14) 0.131(8) Uani 0.5 1 d D U P B -3
C44 C 0.8514(11) -0.0902(19) 0.2606(13) 0.147(8) Uani 0.5 1 d D U P B -3
C45 C 0.8265(9) -0.0964(17) 0.3217(12) 0.125(7) Uani 0.5 1 d D U P B -3
C46 C 0.8149(9) -0.0188(16) 0.3579(11) 0.133(8) Uani 0.5 1 d D U P B -3
C47 C 0.8325(12) 0.0668(17) 0.3451(13) 0.152(9) Uani 0.5 1 d D U P B -3
C48 C 0.7924(14) 0.130(2) 0.3449(17) 0.143(9) Uani 0.5 1 d D U P B -3
C49 C 0.7347(17) 0.128(3) 0.367(2) 0.121(8) Uani 0.5 1 d . U P B -3
C50 C 0.6914(13) 0.186(3) 0.3435(17) 0.143(9) Uani 0.5 1 d D U P B -3
C51 C 0.6381(11) 0.1535(19) 0.3294(12) 0.138(7) Uani 0.5 1 d D U P B -3
C52 C 0.6064(10) 0.1856(19) 0.2707(12) 0.151(8) Uani 0.5 1 d D U P B -3
C53 C 0.5669(13) 0.1336(16) 0.2313(13) 0.156(8) Uani 0.5 1 d D U P B -3
C54 C 0.5645(7) 0.0496(15) 0.2647(12) 0.116(6) Uani 0.5 1 d D U P B -3
C55 C 0.5463(6) -0.0210(17) 0.2126(11) 0.112(6) Uani 0.5 1 d D U P B -3
C56 C 0.5415(7) -0.008(2) 0.1418(11) 0.145(7) Uani 0.5 1 d D U P B -3
C57 C 0.5529(14) -0.0955(18) 0.1151(16) 0.151(9) Uani 0.5 1 d D U P B -3
C58 C 0.5628(11) -0.1572(18) 0.1721(12) 0.133(8) Uani 0.5 1 d D U P B -3
C59 C 0.5993(10) -0.2261(17) 0.1617(12) 0.153(8) Uani 0.5 1 d D U P B -3
C60 C 0.6306(16) -0.231(2) 0.1034(17) 0.138(8) Uani 0.5 1 d D U P B -3
C61 C 0.700(2) -0.236(3) 0.090(2) 0.135(8) Uani 0.5 1 d . U P B -3
C62 C 0.7240(12) -0.2627(19) 0.1492(13) 0.129(7) Uani 0.5 1 d D U P B -3
C63 C 0.7753(13) -0.240(3) 0.1589(14) 0.134(8) Uani 0.5 1 d D U P B -3
C64 C 0.7997(10) -0.2150(16) 0.2206(13) 0.118(6) Uani 0.5 1 d D U P B -3
C65 C 0.7722(11) -0.219(3) 0.2765(17) 0.119(8) Uani 0.5 1 d D U P B -3
C66 C 0.7865(14) -0.163(2) 0.3279(19) 0.114(7) Uani 0.5 1 d . U P B -3
C67 C 0.7576(13) -0.122(2) 0.3715(17) 0.096(7) Uani 0.5 1 d . U P B -3
C68 C 0.7757(12) -0.0308(17) 0.3855(12) 0.112(7) Uani 0.5 1 d . U P B -3
C69 C 0.7355(12) 0.0310(17) 0.3947(9) 0.105(6) Uani 0.5 1 d . U P B -3
C70 C 0.6856(10) 0.002(18) 0.3918(7) 0.102(5) Uani 0.5 1 d . U P B -3
C71 C 0.6415(16) 0.066(2) 0.3643(15) 0.117(7) Uani 0.5 1 d . U P B -3
C72 C 0.5936(8) 0.016(3) 0.3195(11) 0.112(7) Uani 0.5 1 d . U P B -3
C73 C 0.6129(12) -0.078(3) 0.3351(16) 0.120(7) Uani 0.5 1 d . U P B -3
C74 C 0.5641(12) -0.1031(19) 0.2342(13) 0.128(7) Uani 0.5 1 d D U P B -3
C75 C 0.5976(8) -0.1404(15) 0.2913(9) 0.113(6) Uani 0.5 1 d D U P B -3
C76 C 0.6344(9) -0.2147(16) 0.2799(10) 0.124(6) Uani 0.5 1 d D U P B -3
C77 C 0.6405(9) -0.2444(16) 0.2119(10) 0.146(8) Uani 0.5 1 d D U P B -3
C78 C 0.6936(10) -0.268(2) 0.2043(12) 0.138(8) Uani 0.5 1 d D U P B -3
C79 C 0.7214(10) -0.244(2) 0.2666(12) 0.125(8) Uani 0.5 1 d D U P B -3
C80 C 0.6861(10) -0.2126(17) 0.3111(10) 0.108(6) Uani 0.5 1 d D U P B -3
C81 C 0.7023(15) -0.1522(19) 0.3605(14) 0.102(6) Uani 0.5 1 d . U P B -3
C82 C 0.6708(10) -0.0889(19) 0.3744(9) 0.086(5) Uani 0.5 1 d . U P B -3
Ni1A Ni 0.51939(3) 0.000000 0.41902(4) 0.0262(2) Uani 1 2 d S T P C 1
C1A C 0.64470(16) -0.0444(3) 0.5697(2) 0.0334(10) Uani 1 1 d . . . C 1
N1A N 0.46439(18) 0.000000 0.3439(3) 0.0275(10) Uani 1 2 d S T P C 1
C2A C 0.49037(16) -0.1834(3) 0.3762(2) 0.0294(9) Uani 1 1 d . . . C 1
N2A N 0.52041(13) -0.1283(2) 0.41787(19) 0.0273(7) Uani 1 1 d . . . C 1
C3A C 0.45257(17) -0.1578(3) 0.3262(2) 0.0324(9) Uani 1 1 d . . . C 1
H3A H 0.433143 -0.201678 0.301021 0.039 Uiso 1 1 calc R U . C 1
N3A N 0.57657(18) 0.000000 0.4913(3) 0.0268(10) Uani 1 2 d S T P C 1
C4A C 0.44194(16) -0.0712(3) 0.3114(2) 0.0307(9) Uani 1 1 d . . . C 1
C6A C 0.55246(16) -0.1835(3) 0.4566(2) 0.0292(9) Uani 1 1 d . . . C 1
C5A C 0.68293(19) -0.1057(4) 0.6067(3) 0.0419(12) Uani 1 1 d . . . C 1
H5A H 0.663790 -0.157944 0.620762 0.050 Uiso 1 1 calc R U . C 1
H5B H 0.698916 -0.076262 0.647711 0.050 Uiso 1 1 calc R U . C 1
C7A C 0.54244(18) -0.2746(3) 0.4398(3) 0.0358(10) Uani 1 1 d . . . C 1
C8A C 0.50379(18) -0.2744(3) 0.3890(3) 0.0357(10) Uani 1 1 d . . . C 1
C9A C 0.4795(2) -0.3507(3) 0.3499(3) 0.0503(14) Uani 1 1 d . . . C 1
H9A H 0.441099 -0.341498 0.342364 0.060 Uiso 1 1 calc R U . C 1
H9B H 0.485632 -0.404731 0.376936 0.060 Uiso 1 1 calc R U . C 1
C10A C 0.5016(3) -0.3635(5) 0.2821(4) 0.0669(19) Uani 1 1 d . . . C 1
H10A H 0.484441 -0.413829 0.258949 0.100 Uiso 1 1 calc R U . C 1
H10B H 0.539575 -0.374135 0.289256 0.100 Uiso 1 1 calc R U . C 1
H10C H 0.495090 -0.310717 0.254694 0.100 Uiso 1 1 calc R U . C 1
C11A C 0.6258(3) -0.3655(4) 0.4461(4) 0.0616(17) Uani 1 1 d . . . C 1
H11A H 0.642621 -0.417323 0.467544 0.092 Uiso 1 1 calc R U . C 1
H11B H 0.648047 -0.314013 0.456242 0.092 Uiso 1 1 calc R U . C 1
H11C H 0.621090 -0.374371 0.397311 0.092 Uiso 1 1 calc R U . C 1
C12A C 0.5721(2) -0.3511(3) 0.4727(3) 0.0461(13) Uani 1 1 d . . . C 1
H12A H 0.550760 -0.404919 0.464987 0.055 Uiso 1 1 calc R U . C 1
H12B H 0.577275 -0.340957 0.521785 0.055 Uiso 1 1 calc R U . C 1
C13A C 0.59083(15) -0.1578(3) 0.5065(3) 0.0315(9) Uani 1 1 d . . . C 1
H13A H 0.610016 -0.201941 0.531689 0.038 Uiso 1 1 calc R U . C 1
C14A C 0.60241(15) -0.0715(3) 0.5213(2) 0.0294(9) Uani 1 1 d . . . C 1
C15A C 0.7265(2) -0.1350(5) 0.5643(4) 0.0625(18) Uani 1 1 d . . . C 1
H15A H 0.751126 -0.173087 0.591153 0.094 Uiso 1 1 calc R U . C 1
H15B H 0.745281 -0.083456 0.549565 0.094 Uiso 1 1 calc R U . C 1
H15C H 0.711089 -0.167215 0.524860 0.094 Uiso 1 1 calc R U . C 1
C16A C 0.40514(18) -0.0447(3) 0.2551(3) 0.0377(11) Uani 1 1 d . . . C 1
C17A C 0.3767(2) -0.1057(4) 0.2057(3) 0.0484(13) Uani 1 1 d . . . C 1
H17A H 0.347248 -0.073935 0.180881 0.058 Uiso 1 1 calc R U . C 1
H17B H 0.361690 -0.154526 0.230375 0.058 Uiso 1 1 calc R U . C 1
C18A C 0.4121(3) -0.1431(5) 0.1558(3) 0.0605(17) Uani 1 1 d . . . C 1
H18A H 0.392267 -0.185327 0.126538 0.091 Uiso 1 1 calc R U . C 1
H18B H 0.442161 -0.172584 0.180178 0.091 Uiso 1 1 calc R U . C 1
H18C H 0.424723 -0.095515 0.128572 0.091 Uiso 1 1 calc R U . C 1
C1C C 0.7288(3) -0.509(3) 0.2348(4) 0.060(5) Uani 0.5 1 d G . P D -3
H1C H 0.765025 -0.518200 0.248549 0.072 Uiso 0.5 1 calc R U P D -3
C2C C 0.7127(4) -0.493(3) 0.1676(4) 0.081(5) Uani 0.5 1 d G . P D -3
H2C H 0.737847 -0.490976 0.135467 0.097 Uiso 0.5 1 calc R U P D -3
C3C C 0.6597(5) -0.4799(14) 0.1475(4) 0.092(8) Uani 0.5 1 d G . P D -3
H3C H 0.648712 -0.468863 0.101544 0.111 Uiso 0.5 1 calc R U P D -3
C6C C 0.6229(4) -0.4830(17) 0.1945(5) 0.098(10) Uani 0.5 1 d G . P D -3
H6C H 0.586755 -0.473973 0.180703 0.118 Uiso 0.5 1 calc R U P D -3
C5C C 0.6391(3) -0.4991(19) 0.2616(5) 0.083(5) Uani 0.5 1 d G . P D -3
H5C H 0.613933 -0.501196 0.293784 0.100 Uiso 0.5 1 calc R U P D -3
C4C C 0.6920(3) -0.5123(19) 0.2818(3) 0.057(6) Uani 0.5 1 d G . P D -3
H4C H 0.703068 -0.523310 0.327708 0.069 Uiso 0.5 1 calc R U P D -3
C107 C 0.5425(19) -0.426(3) 0.025(3) 0.146(17) Uani 0.24 1 d G U P E -7
H107 H 0.564819 -0.475751 0.023862 0.175 Uiso 0.24 1 calc R U P E -7
C108 C 0.513(2) -0.414(3) 0.079(3) 0.146(18) Uani 0.24 1 d G U P E -7
H108 H 0.514682 -0.454726 0.114796 0.176 Uiso 0.24 1 calc R U P E -7
C109 C 0.480(2) -0.341(3) 0.081(2) 0.129(18) Uani 0.24 1 d G U P E -7
H109 H 0.459810 -0.332248 0.117598 0.155 Uiso 0.24 1 calc R U P E -7
C110 C 0.477(2) -0.281(2) 0.028(3) 0.116(16) Uani 0.24 1 d G U P E -7
H110 H 0.455075 -0.230794 0.029465 0.140 Uiso 0.24 1 calc R U P E -7
C111 C 0.507(2) -0.293(3) -0.026(3) 0.114(14) Uani 0.24 1 d G U P E -7
H111 H 0.505212 -0.251818 -0.061470 0.137 Uiso 0.24 1 calc R U P E -7
C112 C 0.5397(19) -0.366(4) -0.027(3) 0.137(17) Uani 0.24 1 d G U P E -7
H112 H 0.560084 -0.374296 -0.064272 0.164 Uiso 0.24 1 calc R U P E -7
C101 C 0.5562(10) -0.382(3) 0.019(2) 0.104(12) Uani 0.26 1 d G U P F -8
H101 H 0.591954 -0.399484 0.020431 0.125 Uiso 0.26 1 calc R U P F -8
C102 C 0.5309(11) -0.380(2) 0.0775(16) 0.099(12) Uani 0.26 1 d G U P F -8
H102 H 0.549313 -0.395720 0.119107 0.119 Uiso 0.26 1 calc R U P F -8
C103 C 0.4786(12) -0.354(3) 0.0752(16) 0.088(12) Uani 0.26 1 d G U P F -8
H103 H 0.461262 -0.352200 0.115275 0.105 Uiso 0.26 1 calc R U P F -8
C104 C 0.4516(11) -0.330(2) 0.0143(19) 0.098(13) Uani 0.26 1 d G U P F -8
H104 H 0.415852 -0.312443 0.012767 0.117 Uiso 0.26 1 calc R U P F -8
C105 C 0.4769(16) -0.332(3) -0.0443(15) 0.136(15) Uani 0.26 1 d G U P F -8
H105 H 0.458492 -0.316206 -0.085910 0.164 Uiso 0.26 1 calc R U P F -8
C106 C 0.5292(16) -0.358(3) -0.0420(16) 0.131(17) Uani 0.26 1 d G U P F -8
H106 H 0.546543 -0.359726 -0.082079 0.157 Uiso 0.26 1 calc R U P F -8
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'
Ni Ni 0.3393 1.1124 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Er Er -0.2586 4.9576 '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
Er22 N1 Er22 78(3) 6 .
Er22 N1 Er12 80.7(15) 6 .
Er22 N1 Er12 43.6(15) . .
Er12 N1 Er12 52.8(13) 6 .
Er22 N1 Er21 87.0(18) 6 .
Er22 N1 Er21 31.4(14) . .
Er12 N1 Er21 107.2(14) 6 .
Er12 N1 Er21 74.5(14) . .
Er22 N1 Er1 156.9(15) 6 .
Er22 N1 Er1 93.9(14) . .
Er12 N1 Er1 114.0(8) 6 .
Er12 N1 Er1 78.9(7) . .
Er21 N1 Er1 97.7(12) . .
Er21 N1 Er1 171.5(13) 6 .
Er22 N1 Er6 52.6(15) 6 .
Er22 N1 Er6 52.6(15) . .
Er12 N1 Er6 88.8(9) 6 .
Er12 N1 Er6 88.8(9) . .
Er21 N1 Er6 39.4(12) . .
Er21 N1 Er6 39.4(12) 6 .
Er1 N1 Er6 137.0(2) . .
Er1 N1 Er6 137.0(2) 6 .
Er22 N1 Er9 123.2(16) 6 .
Er22 N1 Er9 101.6(16) . .
Er12 N1 Er9 79.9(9) 6 .
Er12 N1 Er9 65.3(8) . .
Er21 N1 Er9 122.0(13) . .
Er21 N1 Er9 151.3(14) 6 .
Er1 N1 Er9 36.6(6) . .
Er1 N1 Er9 64.3(6) 6 .
Er6 N1 Er9 153.5(6) . .
Er22 N1 Er14 103.3(18) 6 .
Er22 N1 Er14 72.5(16) . .
Er12 N1 Er14 141.7(12) 6 .
Er12 N1 Er14 114.3(11) . .
Er21 N1 Er14 41.2(14) . .
Er21 N1 Er14 77.3(15) 6 .
Er1 N1 Er14 94.9(9) . .
Er1 N1 Er14 130.6(9) 6 .
Er6 N1 Er14 53.2(9) . .
Er9 N1 Er14 131.4(11) . .
Er9 N1 Er14 153.0(10) 6 .
Er8 Er1 Er5 119.6(13) . .
Er8 Er1 Er7 68.9(10) . .
Er5 Er1 Er7 50.9(7) . .
Er8 Er1 Er9 69.6(11) . .
Er5 Er1 Er9 151.5(7) . .
Er7 Er1 Er9 131.8(8) . .
Er8 Er1 Er3 92.5(11) . .
Er5 Er1 Er3 27.1(6) . .
Er7 Er1 Er3 24.2(4) . .
Er9 Er1 Er3 145.0(6) . .
Er8 Er1 Er11 133.6(12) . .
Er5 Er1 Er11 25.4(8) . .
Er7 Er1 Er11 70.8(9) . .
Er9 Er1 Er11 127.9(8) . .
Er3 Er1 Er11 47.1(8) . .
Er8 Er1 Er18 27.9(15) . .
Er5 Er1 Er18 139.5(12) . .
Er7 Er1 Er18 92.9(12) . .
Er9 Er1 Er18 42.0(12) . .
Er3 Er1 Er18 113.9(12) . .
Er11 Er1 Er18 139.4(10) . .
Er8 Er1 N1 80.6(6) . .
Er5 Er1 N1 82.3(4) . .
Er7 Er1 N1 77.6(4) . .
Er9 Er1 N1 72.4(6) . .
Er3 Er1 N1 75.2(2) . .
Er11 Er1 N1 69.1(5) . .
Er18 Er1 N1 71.2(8) . .
Er8 Er1 Er20 38.8(13) . .
Er5 Er1 Er20 82.9(12) . .
Er7 Er1 Er20 36.2(11) . .
Er9 Er1 Er20 95.7(12) . .
Er3 Er1 Er20 56.3(10) . .
Er11 Er1 Er20 94.9(12) . .
Er18 Er1 Er20 57.7(15) . .
N1 Er1 Er20 60.8(10) . .
Er8 Er1 Er15 101.2(12) . .
Er5 Er1 Er15 24.9(8) . .
Er7 Er1 Er15 39.4(9) . .
Er9 Er1 Er15 133.1(8) . .
Er3 Er1 Er15 19.2(7) . .
Er11 Er1 Er15 33.2(9) . .
Er18 Er1 Er15 115.7(12) . .
N1 Er1 Er15 60.7(6) . .
Er20 Er1 Er15 62.4(12) . .
Er8 Er1 Er16 72.3(12) . .
Er5 Er1 Er16 49.3(10) . .
Er7 Er1 Er16 18.6(7) . .
Er9 Er1 Er16 122.1(8) . .
Er3 Er1 Er16 24.2(7) . .
Er11 Er1 Er16 62.3(10) . .
Er18 Er1 Er16 90.4(13) . .
N1 Er1 Er16 59.5(6) . .
Er20 Er1 Er16 33.9(11) . .
Er15 Er1 Er16 29.1(8) . .
Er9 Er1 Er16 116.6(7) 6 .
Er4 Er2 Er6 147.8(6) . .
Er2 Er2 Er6 65.9(4) 6 .
Er4 Er2 Er22 66(2) . .
Er2 Er2 Er22 135(2) 6 .
Er6 Er2 Er22 116(2) . .
Er4 Er2 Er21 117.5(19) . .
Er2 Er2 Er21 132.4(18) 6 .
Er6 Er2 Er21 72.0(19) . .
Er22 Er2 Er21 51(2) . .
Er4 Er2 Er21 143.8(17) 6 .
Er4 Er2 Er10 143.4(8) . .
Er2 Er2 Er10 77.7(2) 6 .
Er6 Er2 Er10 17.0(6) . .
Er22 Er2 Er10 99(2) . .
Er4 Er2 Er10 113.2(4) 6 .
Er21 Er2 Er10 56.9(19) . .
Er22 Er2 Er10 79.0(14) 6 .
Er4 Er2 N1 80.8(4) . .
Er2 Er2 N1 79.09(8) 6 .
Er6 Er2 N1 74.3(5) . .
Er22 Er2 N1 60(2) . .
Er4 Er2 N1 75.7(3) 6 .
Er21 Er2 N1 69.0(17) . .
Er22 Er2 N1 55.8(14) 6 .
Er10 Er2 N1 63.2(7) . .
Er21 Er2 N1 60.4(12) 6 .
Er4 Er2 Er12 31.5(7) . .
Er2 Er2 Er12 103.7(6) 6 .
Er6 Er2 Er12 131.6(7) . .
Er22 Er2 Er12 38(2) . .
Er4 Er2 Er12 65.7(7) 6 .
Er21 Er2 Er12 88.0(19) . .
Er22 Er2 Er12 80.1(17) 6 .
Er10 Er2 Er12 118.6(8) . .
Er21 Er2 Er12 106.9(13) 6 .
N1 Er2 Er12 57.3(5) . .
Er4 Er2 Er20 71.1(11) . .
Er2 Er2 Er20 135.7(9) 6 .
Er6 Er2 Er20 111.2(10) . .
Er22 Er2 Er20 5(3) . .
Er4 Er2 Er20 107.4(10) 6 .
Er21 Er2 Er20 46(2) . .
Er22 Er2 Er20 109.6(17) 6 .
Er10 Er2 Er20 94.2(10) . .
Er21 Er2 Er20 118.7(14) 6 .
N1 Er2 Er20 59.1(9) . .
Er12 Er2 Er20 42.7(11) . .
Er7 Er3 Er5 73.1(13) . .
Er7 Er3 Er15 143.0(17) . .
Er5 Er3 Er15 110(2) . .
Er7 Er3 Er16 87(2) . .
Er5 Er3 Er16 143.8(12) . .
Er15 Er3 Er16 68(2) . .
Er7 Er3 Er11 114.6(19) . .
Er5 Er3 Er11 46.1(12) . .
Er15 Er3 Er11 65.4(18) . .
Er16 Er3 Er11 125.9(16) . .
Er7 Er3 Er1 43.9(16) . .
Er5 Er3 Er1 29.9(8) . .
Er15 Er3 Er1 127.2(16) . .
Er16 Er3 Er1 120.6(13) . .
Er11 Er3 Er1 71.6(11) . .
Er7 Er3 Er8 16.5(15) . .
Er5 Er3 Er8 59.2(10) . .
Er15 Er3 Er8 135.3(13) . .
Er16 Er3 Er8 95.2(15) . .
Er11 Er3 Er8 98.4(11) . .
Er1 Er3 Er8 29.4(5) . .
Er7 Er3 Er20 43(2) . .
Er5 Er3 Er20 108.9(15) . .
Er15 Er3 Er20 106(2) . .
Er16 Er3 Er20 44.3(18) . .
Er11 Er3 Er20 131.0(13) . .
Er1 Er3 Er20 79.8(12) . .
Er8 Er3 Er20 51.7(13) . .
Er7 Er3 Er13 132.8(12) . .
Er5 Er3 Er13 78.6(12) . .
Er15 Er3 Er13 32(2) . .
Er16 Er3 Er13 94.3(17) . .
Er11 Er3 Er13 34.1(12) . .
Er1 Er3 Er13 98.6(8) . .
Er8 Er3 Er13 117.6(7) . .
Er20 Er3 Er13 119.3(13) . .
Er7 Er3 Er14 122.5(13) . .
Er5 Er3 Er14 116.7(11) . .
Er15 Er3 Er14 21.7(17) . .
Er16 Er3 Er14 50.2(17) . .
Er11 Er3 Er14 77.6(13) . .
Er1 Er3 Er14 121.6(8) . .
Er8 Er3 Er14 118.4(8) . .
Er20 Er3 Er14 85.0(15) . .
Er13 Er3 Er14 44.3(11) . .
Er7 Er3 N1 73.1(7) . .
Er5 Er3 N1 73.1(4) . .
Er15 Er3 N1 73.1(12) . .
Er16 Er3 N1 72.2(10) . .
Er11 Er3 N1 68.9(5) . .
Er1 Er3 N1 63.6(2) . .
Er8 Er3 N1 62.2(4) . .
Er20 Er3 N1 62.8(11) . .
Er13 Er3 N1 62.9(6) . .
Er14 Er3 N1 59.3(8) . .
Er7 Er3 Er21 87.1(18) . .
Er5 Er3 Er21 127.9(12) . .
Er15 Er3 Er21 61(2) . .
Er16 Er3 Er21 18.0(15) . .
Er11 Er3 Er21 109.9(14) . .
Er1 Er3 Er21 110.2(12) . .
Er8 Er3 Er21 90.2(13) . .
Er20 Er3 Er21 45.6(16) . .
Er13 Er3 Er21 81.3(14) . .
Er14 Er3 Er21 40.0(13) . .
N1 Er3 Er21 55.0(12) . .
Er2 Er4 Er22 72(3) . .
Er4 Er4 Er22 137(2) 6 .
Er2 Er4 Er12 133.9(9) . .
Er4 Er4 Er12 109.2(9) 6 .
Er22 Er4 Er12 65(3) . .
Er2 Er4 Er12 135.6(8) 6 .
Er2 Er4 Er6 18.3(3) . .
Er4 Er4 Er6 76.2(2) 6 .
Er22 Er4 Er6 77(3) . .
Er2 Er4 Er6 34.4(2) 6 .
Er12 Er4 Er6 127.7(7) . .
Er2 Er4 Er21 41.0(14) . .
Er4 Er4 Er21 120.0(14) 6 .
Er22 Er4 Er21 32(3) . .
Er2 Er4 Er21 81.3(14) 6 .
Er12 Er4 Er21 94.9(15) . .
Er6 Er4 Er21 47.1(14) . .
Er22 Er4 Er21 99(2) 6 .
Er2 Er4 Er20 89.2(12) . .
Er4 Er4 Er20 139.3(9) 6 .
Er22 Er4 Er20 17(3) . .
Er2 Er4 Er20 123.0(10) 6 .
Er12 Er4 Er20 48.8(13) . .
Er6 Er4 Er20 92.3(10) . .
Er22 Er4 Er20 116.5(16) 6 .
Er21 Er4 Er20 48.2(17) . .
Er12 Er4 Er20 100.5(12) 6 .
Er2 Er4 N1 78.8(4) . .
Er4 Er4 N1 79.23(14) 6 .
Er22 Er4 N1 59(2) . .
Er2 Er4 N1 74.4(3) 6 .
Er12 Er4 N1 65.2(6) . .
Er6 Er4 N1 65.1(4) . .
Er22 Er4 N1 55.8(14) 6 .
Er21 Er4 N1 62.4(13) . .
Er12 Er4 N1 59.7(5) 6 .
Er20 Er4 N1 60.8(9) . .
Er3 Er5 Er7 45.5(10) . .
Er3 Er5 Er1 123.0(13) . .
Er7 Er5 Er1 78.1(15) . .
Er3 Er5 Er11 93(2) . .
Er7 Er5 Er11 133(2) . .
Er1 Er5 Er11 129.5(17) . .
Er3 Er5 Er15 36.5(13) . .
Er7 Er5 Er15 76.5(19) . .
Er1 Er5 Er15 139.5(11) . .
Er11 Er5 Er15 57.8(16) . .
Er3 Er5 Er8 93.3(11) . .
Er7 Er5 Er8 48.6(14) . .
Er1 Er5 Er8 29.7(8) . .
Er11 Er5 Er8 143.4(10) . .
Er15 Er5 Er8 116.0(13) . .
Er3 Er5 Er16 20.6(8) . .
Er7 Er5 Er16 38.6(15) . .
Er1 Er5 Er16 108.5(11) . .
Er11 Er5 Er16 94.3(18) . .
Er15 Er5 Er16 38.2(13) . .
Er8 Er5 Er16 80.2(11) . .
Er3 Er5 Er19 112(2) . .
Er7 Er5 Er19 139.5(18) . .
Er1 Er5 Er19 105.9(17) . .
Er11 Er5 Er19 24(2) . .
Er15 Er5 Er19 76(2) . .
Er8 Er5 Er19 124.2(13) . .
Er16 Er5 Er19 107(2) . .
Er3 Er5 Er13 76.4(13) . .
Er7 Er5 Er13 112.4(17) . .
Er1 Er5 Er13 131.5(8) . .
Er11 Er5 Er13 20.6(15) . .
Er15 Er5 Er13 40.0(14) . .
Er8 Er5 Er13 131.6(7) . .
Er16 Er5 Er13 74.4(12) . .
Er19 Er5 Er13 35.7(15) . .
Er3 Er5 Er9 124.2(10) . .
Er7 Er5 Er9 83.6(15) . .
Er1 Er5 Er9 16.9(5) . .
Er11 Er5 Er9 114.4(14) . .
Er15 Er5 Er9 128.4(9) . .
Er8 Er5 Er9 36.8(7) . .
Er16 Er5 Er9 105.8(9) . .
Er19 Er5 Er9 91.3(15) . .
Er13 Er5 Er9 114.6(8) . .
Er3 Er5 N1 85.2(4) . .
Er7 Er5 N1 77.4(6) . .
Er1 Er5 N1 73.0(4) . .
Er11 Er5 N1 77.1(8) . .
Er15 Er5 N1 71.0(8) . .
Er8 Er5 N1 67.6(4) . .
Er16 Er5 N1 65.6(7) . .
Er19 Er5 N1 66.1(12) . .
Er13 Er5 N1 64.5(6) . .
Er9 Er5 N1 58.2(5) . .
Er3 Er5 Er20 50.6(12) . .
Er7 Er5 Er20 18.8(10) . .
Er1 Er5 Er20 73.5(12) . .
Er11 Er5 Er20 121.6(16) . .
Er15 Er5 Er20 72.2(16) . .
Er8 Er5 Er20 44.8(11) . .
Er16 Er5 Er20 35.4(12) . .
Er19 Er5 Er20 122.2(17) . .
Er13 Er5 Er20 101.3(12) . .
Er9 Er5 Er20 73.9(11) . .
N1 Er5 Er20 58.6(9) . .
Er2 Er6 Er10 146.0(11) . .
Er2 Er6 Er10 146.0(11) 6 .
Er2 Er6 Er21 66.1(19) . .
Er2 Er6 Er21 111(2) 6 .
Er10 Er6 Er21 83(2) . .
Er2 Er6 Er4 13.9(3) . .
Er2 Er6 Er4 39.2(6) 6 .
Er10 Er6 Er4 143.1(14) . .
Er21 Er6 Er4 72(2) . .
Er21 Er6 Er4 98(2) 6 .
Er2 Er6 Er22 33.9(13) . .
Er2 Er6 Er22 73.3(16) 6 .
Er10 Er6 Er22 112.1(16) . .
Er21 Er6 Er22 38.0(19) . .
Er21 Er6 Er22 117(3) 6 .
Er4 Er6 Er22 35.4(13) . .
Er4 Er6 Er22 60.1(15) 6 .
Er22 Er6 Er22 83(3) 6 .
Er2 Er6 Er14 113.7(10) . .
Er2 Er6 Er14 141.8(11) 6 .
Er10 Er6 Er14 32.8(11) . .
Er21 Er6 Er14 51(2) . .
Er21 Er6 Er14 104(2) 6 .
Er4 Er6 Er14 114.3(10) . .
Er4 Er6 Er14 129.5(10) 6 .
Er22 Er6 Er14 117.0(16) 6 .
Er22 Er6 Er14 80.2(16) . .
Er14 Er6 Er14 56.1(19) 6 .
Er2 Er6 N1 78.7(6) . .
Er2 Er6 N1 78.7(6) 6 .
Er10 Er6 N1 77.7(14) . .
Er21 Er6 N1 69.6(17) . .
Er21 Er6 N1 69.6(17) 6 .
Er4 Er6 N1 68.4(5) . .
Er4 Er6 N1 68.4(5) 6 .
Er22 Er6 N1 56.5(14) 6 .
Er22 Er6 N1 56.5(14) . .
Er14 Er6 N1 63.8(8) 6 .
Er14 Er6 N1 63.8(8) . .
Er3 Er7 Er5 61.4(8) . .
Er3 Er7 Er1 111.9(19) . .
Er5 Er7 Er1 51.0(15) . .
Er3 Er7 Er8 154(2) . .
Er5 Er7 Er8 96(2) . .
Er1 Er7 Er8 44.9(10) . .
Er3 Er7 Er16 60(2) . .
Er5 Er7 Er16 115(2) . .
Er1 Er7 Er16 144.6(12) . .
Er8 Er7 Er16 128.9(15) . .
Er3 Er7 Er20 118(3) . .
Er5 Er7 Er20 149.3(16) . .
Er1 Er7 Er20 115.4(17) . .
Er8 Er7 Er20 74.8(18) . .
Er16 Er7 Er20 57.9(19) . .
Er3 Er7 Er15 21.3(10) . .
Er5 Er7 Er15 67.6(16) . .
Er1 Er7 Er15 111.8(14) . .
Er8 Er7 Er15 141.8(12) . .
Er16 Er7 Er15 47.4(15) . .
Er20 Er7 Er15 102(2) . .
Er3 Er7 Er11 43.9(14) . .
Er5 Er7 Er11 23.8(12) . .
Er1 Er7 Er11 69.0(11) . .
Er8 Er7 Er11 110.5(15) . .
Er16 Er7 Er11 90.9(16) . .
Er20 Er7 Er11 133.1(16) . .
Er15 Er7 Er11 44.7(11) . .
Er3 Er7 Er18 151.7(13) . .
Er5 Er7 Er18 103(2) . .
Er1 Er7 Er18 54.7(10) . .
Er8 Er7 Er18 14.7(10) . .
Er16 Er7 Er18 114.2(15) . .
Er20 Er7 Er18 61.9(18) . .
Er15 Er7 Er18 133.3(10) . .
Er11 Er7 Er18 113.1(13) . .
Er3 Er7 N1 89.4(8) . .
Er5 Er7 N1 78.3(7) . .
Er1 Er7 N1 71.1(5) . .
Er8 Er7 N1 72.9(6) . .
Er16 Er7 N1 74.3(10) . .
Er20 Er7 N1 71.0(14) . .
Er15 Er7 N1 70.2(8) . .
Er11 Er7 N1 67.0(5) . .
Er18 Er7 N1 63.2(7) . .
Er3 Er7 Er9 127.9(17) . .
Er5 Er7 Er9 72.7(17) . .
Er1 Er7 Er9 25.8(5) . .
Er8 Er7 Er9 26.2(9) . .
Er16 Er7 Er9 128.8(11) . .
Er20 Er7 Er9 89.6(17) . .
Er15 Er7 Er9 118.5(12) . .
Er11 Er7 Er9 84.6(11) . .
Er18 Er7 Er9 30.8(8) . .
N1 Er7 Er9 57.0(5) . .
Er3 Er7 Er22 102.4(19) . .
Er5 Er7 Er22 126.3(13) . .
Er1 Er7 Er22 109.4(12) . .
Er8 Er7 Er22 80.6(14) . .
Er16 Er7 Er22 48.4(16) . .
Er20 Er7 Er22 24.4(17) . .
Er15 Er7 Er22 82.8(16) . .
Er11 Er7 Er22 108.8(13) . .
Er18 Er7 Er22 65.9(14) . .
N1 Er7 Er22 49.2(11) . .
Er9 Er7 Er22 85.1(12) . .
Er1 Er8 Er18 129(2) . .
Er1 Er8 Er7 66.2(11) . .
Er18 Er8 Er7 149(2) . .
Er1 Er8 Er9 70.9(15) . .
Er18 Er8 Er9 58.4(19) . .
Er7 Er8 Er9 130.5(15) . .
Er1 Er8 Er5 30.7(8) . .
Er18 Er8 Er5 148.9(17) . .
Er7 Er8 Er5 35.6(10) . .
Er9 Er8 Er5 97.8(13) . .
Er1 Er8 Er20 120.7(17) . .
Er18 Er8 Er20 92(3) . .
Er7 Er8 Er20 59.9(17) . .
Er9 Er8 Er20 132.8(17) . .
Er5 Er8 Er20 91.7(15) . .
Er1 Er8 Er3 58.2(9) . .
Er18 Er8 Er3 148.4(17) . .
Er7 Er8 Er3 9.5(7) . .
Er9 Er8 Er3 121.1(12) . .
Er5 Er8 Er3 27.5(4) . .
Er20 Er8 Er3 65.4(14) . .
Er1 Er8 Er12 134.9(9) . .
Er18 Er8 Er12 40.7(18) . .
Er7 Er8 Er12 108.3(13) . .
Er9 Er8 Er12 85.5(13) . .
Er5 Er8 Er12 126.4(8) . .
Er20 Er8 Er12 53.1(16) . .
Er3 Er8 Er12 109.8(9) . .
Er1 Er8 Er17 102.5(16) . .
Er18 Er8 Er17 28.1(18) . .
Er7 Er8 Er17 137.6(8) . .
Er9 Er8 Er17 36.3(13) . .
Er5 Er8 Er17 121.3(10) . .
Er20 Er8 Er17 101.0(19) . .
Er3 Er8 Er17 131.2(6) . .
Er12 Er8 Er17 49.6(14) . .
Er1 Er8 N1 75.2(5) . .
Er18 Er8 N1 82.6(14) . .
Er7 Er8 N1 75.4(5) . .
Er9 Er8 N1 71.0(6) . .
Er5 Er8 N1 69.9(4) . .
Er20 Er8 N1 69.3(13) . .
Er3 Er8 N1 69.3(4) . .
Er12 Er8 N1 60.7(6) . .
Er17 Er8 N1 62.2(6) . .
Er1 Er8 Er16 85.1(12) . .
Er18 Er8 Er16 122(2) . .
Er7 Er8 Er16 26.6(10) . .
Er9 Er8 Er16 130.0(10) . .
Er5 Er8 Er16 55.5(9) . .
Er20 Er8 Er16 36.2(14) . .
Er3 Er8 Er16 29.8(8) . .
Er12 Er8 Er16 81.8(11) . .
Er17 Er8 Er16 117.8(11) . .
N1 Er8 Er16 60.6(7) . .
Er9 Er9 Er18 121(2) 6 .
Er9 Er9 Er17 62.2(13) 6 .
Er18 Er9 Er17 60(2) . .
Er9 Er9 Er8 147.0(7) 6 .
Er18 Er9 Er8 49.8(18) . .
Er17 Er9 Er8 105.0(18) . .
Er9 Er9 Er1 129.2(6) 6 .
Er18 Er9 Er1 89(2) . .
Er17 Er9 Er1 136.6(18) . .
Er8 Er9 Er1 39.5(10) . .
Er9 Er9 N1 74.1(6) 6 .
Er18 Er9 N1 81.4(14) . .
Er17 Er9 N1 74.9(12) . .
Er8 Er9 N1 73.1(7) . .
Er1 Er9 N1 71.0(6) . .
Er18 Er9 N1 66.1(9) 6 .
Er9 Er9 Er5 118.2(5) 6 .
Er18 Er9 Er5 93(2) . .
Er17 Er9 Er5 131.4(16) . .
Er8 Er9 Er5 45.4(10) . .
Er1 Er9 Er5 11.6(3) . .
Er18 Er9 Er5 125.5(11) 6 .
N1 Er9 Er5 61.0(5) . .
Er9 Er9 Er12 98.7(8) 6 .
Er18 Er9 Er12 27.8(13) . .
Er17 Er9 Er12 46.5(14) . .
Er8 Er9 Er12 59.2(11) . .
Er1 Er9 Er12 91.7(10) . .
Er18 Er9 Er12 70.3(12) 6 .
N1 Er9 Er12 56.5(6) . .
Er5 Er9 Er12 90.1(9) . .
Er1 Er9 Er12 102.0(8) 6 .
Er9 Er9 Er7 130.7(4) 6 .
Er18 Er9 Er7 69(2) . .
Er17 Er9 Er7 114.8(17) . .
Er8 Er9 Er7 23.3(8) . .
Er1 Er9 Er7 22.4(5) . .
Er18 Er9 Er7 123.7(10) 6 .
N1 Er9 Er7 59.3(5) . .
Er5 Er9 Er7 23.7(4) . .
Er1 Er9 Er7 106.1(5) 6 .
Er12 Er9 Er7 69.3(8) . .
Er6 Er10 Er14 120(2) . .
Er14 Er10 Er14 97(3) 6 .
Er6 Er10 Er21 59.7(19) . .
Er14 Er10 Er21 138(3) 6 .
Er14 Er10 Er21 61(2) . .
Er6 Er10 Er2 17.0(6) . .
Er14 Er10 Er2 124(2) 6 .
Er14 Er10 Er2 103.6(19) . .
Er21 Er10 Er2 44.4(18) . .
Er21 Er10 Er2 69(2) 6 .
Er6 Er10 N1 75.1(14) . .
Er14 Er10 N1 73.4(16) 6 .
Er14 Er10 N1 73.4(16) . .
Er21 Er10 N1 66.0(17) . .
Er21 Er10 N1 66.0(17) 6 .
Er2 Er10 N1 64.0(8) . .
Er2 Er10 N1 64.0(8) 6 .
Er6 Er10 Er13 133.0(18) . .
Er14 Er10 Er13 61.3(18) 6 .
Er14 Er10 Er13 36.3(17) . .
Er21 Er10 Er13 88.1(18) . .
Er21 Er10 Er13 108.7(19) 6 .
Er2 Er10 Er13 117.8(11) . .
Er2 Er10 Er13 124.0(12) 6 .
N1 Er10 Er13 60.0(8) . .
Er13 Er10 Er13 25.0(11) 6 .
Er6 Er10 Er15 112.2(14) . .
Er14 Er10 Er15 92(2) 6 .
Er14 Er10 Er15 14.9(15) . .
Er21 Er10 Er15 57.6(17) . .
Er21 Er10 Er15 123.3(19) 6 .
Er2 Er10 Er15 95.2(10) . .
Er2 Er10 Er15 112.1(12) 6 .
N1 Er10 Er15 58.4(8) . .
Er13 Er10 Er15 55.8(11) 6 .
Er13 Er10 Er15 31.7(9) . .
Er5 Er11 Er19 136(4) . .
Er5 Er11 Er13 143(3) . .
Er19 Er11 Er13 64(3) . .
Er5 Er11 Er15 82(2) . .
Er19 Er11 Er15 125(4) . .
Er13 Er11 Er15 64(2) . .
Er5 Er11 Er3 40.6(11) . .
Er19 Er11 Er3 156(2) . .
Er13 Er11 Er3 106(2) . .
Er15 Er11 Er3 42.5(15) . .
Er5 Er11 Er1 25.0(10) . .
Er19 Er11 Er1 111(3) . .
Er13 Er11 Er1 141.6(14) . .
Er15 Er11 Er1 98.7(19) . .
Er3 Er11 Er1 61.3(10) . .
Er5 Er11 Er7 23.4(12) . .
Er19 Er11 Er7 143(3) . .
Er13 Er11 Er7 119(2) . .
Er15 Er11 Er7 60.1(17) . .
Er3 Er11 Er7 21.5(6) . .
Er1 Er11 Er7 40.2(8) . .
Er5 Er11 Er16 59.8(15) . .
Er19 Er11 Er16 134(3) . .
Er13 Er11 Er16 83.7(19) . .
Er15 Er11 Er16 25.1(16) . .
Er3 Er11 Er16 24.8(9) . .
Er1 Er11 Er16 73.7(11) . .
Er7 Er11 Er16 36.5(10) . .
Er13 Er11 Er16 100.2(13) 6 .
Er11 Er11 Er16 117.1(7) 6 .
Er5 Er11 Er14 101.7(17) . .
Er19 Er11 Er14 97(3) . .
Er13 Er11 Er14 41.1(16) . .
Er15 Er11 Er14 28.3(15) . .
Er3 Er11 Er14 66.5(12) . .
Er1 Er11 Er14 108.7(12) . .
Er7 Er11 Er14 78.3(12) . .
Er13 Er11 Er14 59.7(12) 6 .
Er11 Er11 Er14 85.9(10) 6 .
Er16 Er11 Er14 42.8(11) . .
Er5 Er11 N1 78.2(9) . .
Er19 Er11 N1 79(2) . .
Er13 Er11 N1 77.2(11) . .
Er15 Er11 N1 74.3(11) . .
Er3 Er11 N1 77.4(7) . .
Er1 Er11 N1 64.9(5) . .
Er7 Er11 N1 67.1(6) . .
Er13 Er11 N1 66.6(7) 6 .
Er11 Er11 N1 61.1(6) 6 .
Er16 Er11 N1 61.5(7) . .
Er14 Er11 N1 59.1(8) . .
Er18 Er12 Er22 119(3) . .
Er18 Er12 Er4 150.8(16) . .
Er22 Er12 Er4 40.4(17) . .
Er18 Er12 Er20 82(2) . .
Er22 Er12 Er20 43.9(19) . .
Er4 Er12 Er20 84.0(18) . .
Er18 Er12 Er17 45.6(19) . .
Er22 Er12 Er17 130(2) . .
Er4 Er12 Er17 123.9(14) . .
Er20 Er12 Er17 118(2) . .
Er18 Er12 Er8 31.0(16) . .
Er22 Er12 Er8 88.4(19) . .
Er4 Er12 Er8 125.0(11) . .
Er20 Er12 Er8 52.3(16) . .
Er17 Er12 Er8 67.7(14) . .
Er12 Er12 Er8 112.9(7) 6 .
Er18 Er12 N1 79.9(13) . .
Er22 Er12 N1 60.7(17) . .
Er4 Er12 N1 71.4(7) . .
Er20 Er12 N1 71.0(13) . .
Er17 Er12 N1 69.4(10) . .
Er12 Er12 N1 63.6(7) 6 .
Er8 Er12 N1 64.3(6) . .
Er4 Er12 N1 64.3(6) 6 .
Er18 Er12 Er2 137.7(16) . .
Er22 Er12 Er2 27.6(18) . .
Er4 Er12 Er2 14.7(3) . .
Er20 Er12 Er2 71.4(16) . .
Er17 Er12 Er2 122.6(11) . .
Er12 Er12 Er2 76.3(6) 6 .
Er8 Er12 Er2 110.4(9) . .
Er4 Er12 Er2 30.6(4) 6 .
N1 Er12 Er2 60.9(6) . .
Er18 Er12 Er9 24.2(12) . .
Er22 Er12 Er9 109.8(18) . .
Er4 Er12 Er9 129.2(9) . .
Er20 Er12 Er9 85.4(17) . .
Er17 Er12 Er9 32.6(11) . .
Er12 Er12 Er9 81.3(8) 6 .
Er8 Er12 Er9 35.4(7) . .
Er4 Er12 Er9 116.0(9) 6 .
N1 Er12 Er9 58.3(6) . .
Er2 Er12 Er9 119.0(8) . .
Er13 Er13 Er11 119.4(16) 6 .
Er13 Er13 Er19 65.3(17) 6 .
Er11 Er13 Er19 56.8(19) . .
Er13 Er13 Er15 147.2(13) 6 .
Er11 Er13 Er15 61.8(18) . .
Er19 Er13 Er15 116(3) . .
Er13 Er13 Er14 105.6(15) 6 .
Er11 Er13 Er14 109(2) . .
Er19 Er13 Er14 142(3) . .
Er15 Er13 Er14 51.5(19) . .
Er13 Er13 Er3 141.3(6) 6 .
Er11 Er13 Er3 39.7(13) . .
Er19 Er13 Er3 94(2) . .
Er15 Er13 Er3 22.6(14) . .
Er14 Er13 Er3 70.6(15) . .
Er11 Er13 Er3 114.7(12) 6 .
Er13 Er13 Er5 124.8(7) 6 .
Er11 Er13 Er5 16.8(11) . .
Er19 Er13 Er5 69.0(18) . .
Er15 Er13 Er5 47.5(16) . .
Er14 Er13 Er5 92.3(15) . .
Er11 Er13 Er5 93.5(12) 6 .
Er3 Er13 Er5 24.9(4) . .
Er13 Er13 N1 77.1(5) 6 .
Er11 Er13 N1 72.9(11) . .
Er19 Er13 N1 75(2) . .
Er15 Er13 N1 72.2(12) . .
Er14 Er13 N1 66.9(12) . .
Er11 Er13 N1 64.1(7) 6 .
Er3 Er13 N1 65.9(5) . .
Er5 Er13 N1 62.7(6) . .
Er14 Er13 N1 60.5(9) 6 .
Er15 Er13 N1 60.1(8) 6 .
Er13 Er13 Er10 77.5(5) 6 .
Er11 Er13 Er10 122.2(16) . .
Er19 Er13 Er10 125(2) . .
Er15 Er13 Er10 76.3(17) . .
Er14 Er13 Er10 28.2(14) . .
Er11 Er13 Er10 94.7(11) 6 .
Er3 Er13 Er10 90.9(10) . .
Er5 Er13 Er10 106.3(10) . .
Er14 Er13 Er10 31.5(9) 6 .
Er15 Er13 Er10 63.2(10) 6 .
N1 Er13 Er10 56.9(9) . .
Er10 Er14 Er15 150(3) . .
Er10 Er14 Er21 74(2) . .
Er15 Er14 Er21 95(3) . .
Er10 Er14 Er13 115(3) . .
Er15 Er14 Er13 54(2) . .
Er21 Er14 Er13 135(3) . .
Er10 Er14 Er16 121(3) . .
Er15 Er14 Er16 46.6(18) . .
Er21 Er14 Er16 49(2) . .
Er13 Er14 Er16 98(2) . .
Er10 Er14 Er6 27.0(14) . .
Er15 Er14 Er6 132(2) . .
Er21 Er14 Er6 48(2) . .
Er13 Er14 Er6 127.2(18) . .
Er16 Er14 Er6 94.2(17) . .
Er14 Er14 Er6 62.0(10) 6 .
Er10 Er14 Er3 138(2) . .
Er15 Er14 Er3 16.2(14) . .
Er21 Er14 Er3 79(2) . .
Er13 Er14 Er3 65.1(14) . .
Er16 Er14 Er3 32.8(13) . .
Er14 Er14 Er3 123.5(8) 6 .
Er6 Er14 Er3 116.3(14) . .
Er13 Er14 Er3 87.6(13) 6 .
Er10 Er14 N1 74.2(17) . .
Er15 Er14 N1 76.2(15) . .
Er21 Er14 N1 68.2(19) . .
Er13 Er14 N1 72.9(12) . .
Er16 Er14 N1 71.2(12) . .
Er14 Er14 N1 65.2(9) 6 .
Er6 Er14 N1 63.0(8) . .
Er13 Er14 N1 64.7(9) 6 .
Er3 Er14 N1 66.3(8) . .
Er10 Er14 Er11 128(2) . .
Er15 Er14 Er11 28.8(16) . .
Er21 Er14 Er11 108(2) . .
Er13 Er14 Er11 29.9(10) . .
Er16 Er14 Er11 68.0(16) . .
Er14 Er14 Er11 94.1(10) 6 .
Er6 Er14 Er11 123.9(13) . .
Er13 Er14 Er11 52.2(10) 6 .
Er3 Er14 Er11 35.9(8) . .
N1 Er14 Er11 60.9(9) . .
Er10 Er14 Er22 74(2) . .
Er15 Er14 Er22 86(2) . .
Er21 Er14 Er22 19.8(19) . .
Er13 Er14 Er22 116.7(19) . .
Er16 Er14 Er22 47.3(16) . .
Er14 Er14 Er22 96.9(13) 6 .
Er6 Er14 Er22 47.6(13) . .
Er13 Er14 Er22 113.3(16) 6 .
Er3 Er14 Er22 70.3(14) . .
N1 Er14 Er22 48.6(12) . .
Er11 Er14 Er22 92.5(16) . .
Er3 Er15 Er16 64(2) . .
Er3 Er15 Er14 142(3) . .
Er16 Er15 Er14 83(3) . .
Er3 Er15 Er11 72(2) . .
Er16 Er15 Er11 128(3) . .
Er14 Er15 Er11 123(3) . .
Er3 Er15 Er13 126(3) . .
Er16 Er15 Er13 147(2) . .
Er14 Er15 Er13 74(2) . .
Er11 Er15 Er13 54(2) . .
Er3 Er15 Er5 33.1(11) . .
Er16 Er15 Er5 90(2) . .
Er14 Er15 Er5 141(2) . .
Er11 Er15 Er5 39.7(13) . .
Er13 Er15 Er5 93(2) . .
Er3 Er15 Er7 15.7(7) . .
Er16 Er15 Er7 55(2) . .
Er14 Er15 Er7 127(2) . .
Er11 Er15 Er7 75(2) . .
Er13 Er15 Er7 124(2) . .
Er5 Er15 Er7 35.9(10) . .
Er3 Er15 Er21 95(2) . .
Er16 Er15 Er21 36(2) . .
Er14 Er15 Er21 48(2) . .
Er11 Er15 Er21 132(2) . .
Er13 Er15 Er21 114(2) . .
Er5 Er15 Er21 112(2) . .
Er7 Er15 Er21 82.3(19) . .
Er3 Er15 Er19 95(2) . .
Er16 Er15 Er19 136(2) . .
Er14 Er15 Er19 98(2) . .
Er11 Er15 Er19 25.7(17) . .
Er13 Er15 Er19 30.7(18) . .
Er5 Er15 Er19 62.0(18) . .
Er7 Er15 Er19 94(2) . .
Er21 Er15 Er19 120.1(19) . .
Er3 Er15 N1 83.3(14) . .
Er16 Er15 N1 75.5(14) . .
Er14 Er15 N1 71.2(15) . .
Er11 Er15 N1 72.8(12) . .
Er13 Er15 N1 74.5(12) . .
Er5 Er15 N1 70.4(9) . .
Er7 Er15 N1 69.1(8) . .
Er21 Er15 N1 59.9(14) . .
Er19 Er15 N1 63.1(12) . .
Er13 Er15 N1 61.3(8) 6 .
Er3 Er15 Er1 33.7(11) . .
Er16 Er15 Er1 80(2) . .
Er14 Er15 Er1 127.8(18) . .
Er11 Er15 Er1 48.1(15) . .
Er13 Er15 Er1 95.4(19) . .
Er5 Er15 Er1 15.6(5) . .
Er7 Er15 Er1 28.9(9) . .
Er21 Er15 Er1 96.9(16) . .
Er19 Er15 Er1 65.1(16) . .
Er13 Er15 Er1 91.6(12) 6 .
N1 Er15 Er1 57.0(6) . .
Er3 Er16 Er15 48.1(18) . .
Er3 Er16 Er7 32.5(8) . .
Er15 Er16 Er7 78(2) . .
Er3 Er16 Er21 146(3) . .
Er15 Er16 Er21 112(3) . .
Er7 Er16 Er21 134(3) . .
Er3 Er16 Er20 100(3) . .
Er15 Er16 Er20 137(3) . .
Er7 Er16 Er20 67(2) . .
Er21 Er16 Er20 79(3) . .
Er3 Er16 Er14 97(2) . .
Er15 Er16 Er14 51(2) . .
Er7 Er16 Er14 120(2) . .
Er21 Er16 Er14 62(2) . .
Er20 Er16 Er14 131(3) . .
Er3 Er16 Er22 125(2) . .
Er15 Er16 Er22 127(2) . .
Er7 Er16 Er22 99(2) . .
Er21 Er16 Er22 39(2) . .
Er20 Er16 Er22 42(2) . .
Er14 Er16 Er22 92(2) . .
Er3 Er16 Er5 15.6(6) . .
Er15 Er16 Er5 51.3(19) . .
Er7 Er16 Er5 26.8(8) . .
Er21 Er16 Er5 133(2) . .
Er20 Er16 Er5 90(2) . .
Er14 Er16 Er5 94.4(18) . .
Er22 Er16 Er5 110.0(19) . .
Er3 Er16 Er11 29.4(10) . .
Er15 Er16 Er11 27.3(17) . .
Er7 Er16 Er11 52.5(12) . .
Er21 Er16 Er11 119(2) . .
Er20 Er16 Er11 111(2) . .
Er14 Er16 Er11 69.2(16) . .
Er22 Er16 Er11 114.7(18) . .
Er5 Er16 Er11 25.8(7) . .
Er3 Er16 N1 79.3(11) . .
Er15 Er16 N1 74.3(15) . .
Er7 Er16 N1 71.9(10) . .
Er21 Er16 N1 68(2) . .
Er20 Er16 N1 71.6(17) . .
Er14 Er16 N1 66.6(12) . .
Er22 Er16 N1 55.1(16) . .
Er5 Er16 N1 64.5(7) . .
Er11 Er16 N1 60.1(7) . .
Er3 Er16 Er8 55.1(13) . .
Er15 Er16 Er8 94(2) . .
Er7 Er16 Er8 24.5(8) . .
Er21 Er16 Er8 111(2) . .
Er20 Er16 Er8 45.9(19) . .
Er14 Er16 Er8 120.9(15) . .
Er22 Er16 Er8 74.2(19) . .
Er5 Er16 Er8 44.3(8) . .
Er11 Er16 Er8 66.4(10) . .
N1 Er16 Er8 58.2(6) . .
Er3 Er16 Er13 57.2(15) . .
Er15 Er16 Er13 17.4(13) . .
Er7 Er16 Er13 81.4(16) . .
Er21 Er16 Er13 97(2) . .
Er20 Er16 Er13 128(2) . .
Er14 Er16 Er13 40.0(14) . .
Er22 Er16 Er13 109.7(19) . .
Er5 Er16 Er13 54.9(11) . .
Er11 Er16 Er13 29.3(9) . .
N1 Er16 Er13 58.9(8) . .
Er8 Er16 Er13 90.9(12) . .
Er18 Er17 Er18 158(3) 6 .
Er18 Er17 Er9 112(4) 6 .
Er18 Er17 Er9 57.5(19) . .
Er9 Er17 Er9 56(3) 6 .
Er18 Er17 Er12 118(3) 6 .
Er18 Er17 Er12 52.5(19) . .
Er9 Er17 Er12 134.8(16) 6 .
Er9 Er17 Er12 100.9(13) . .
Er12 Er17 Er12 67(2) 6 .
Er18 Er17 Er8 136(3) 6 .
Er18 Er17 Er8 24.4(15) . .
Er9 Er17 Er8 90(2) 6 .
Er9 Er17 Er8 38.7(9) . .
Er12 Er17 Er8 117.3(15) 6 .
Er12 Er17 Er8 62.7(10) . .
Er18 Er17 N1 79.1(17) 6 .
Er18 Er17 N1 79.1(17) . .
Er9 Er17 N1 71.3(11) 6 .
Er9 Er17 N1 71.3(11) . .
Er12 Er17 N1 64.2(9) 6 .
Er12 Er17 N1 64.2(9) . .
Er8 Er17 N1 61.5(6) . .
Er8 Er17 N1 61.5(6) 6 .
Er18 Er17 Er1 118(3) 6 .
Er18 Er17 Er1 45.2(19) . .
Er9 Er17 Er1 68.3(16) 6 .
Er9 Er17 Er1 22.4(9) . .
Er12 Er17 Er1 118.5(11) 6 .
Er12 Er17 Er1 79.6(9) . .
Er8 Er17 Er1 21.4(6) . .
Er8 Er17 Er1 93.1(13) 6 .
N1 Er17 Er1 54.8(6) . .
Er18 Er17 Er20 126(2) 6 .
Er18 Er17 Er20 34.7(19) . .
Er9 Er17 Er20 110.0(15) 6 .
Er9 Er17 Er20 70.7(13) . .
Er12 Er17 Er20 86.2(15) 6 .
Er12 Er17 Er20 30.6(11) . .
Er8 Er17 Er20 34.0(10) . .
Er8 Er17 Er20 111.4(11) 6 .
N1 Er17 Er20 49.8(8) . .
Er1 Er17 Er20 49.1(8) . .
Er1 Er17 Er20 101.5(10) 6 .
Er8 Er18 Er9 72(2) . .
Er8 Er18 Er17 127(3) . .
Er9 Er18 Er17 63(3) . .
Er8 Er18 Er12 108(3) . .
Er9 Er18 Er12 128(2) . .
Er17 Er18 Er12 82(3) . .
Er8 Er18 Er1 23.2(11) . .
Er9 Er18 Er1 48.8(16) . .
Er17 Er18 Er1 106(3) . .
Er12 Er18 Er1 117(2) . .
Er8 Er18 Er20 55(2) . .
Er9 Er18 Er20 115(2) . .
Er17 Er18 Er20 125(3) . .
Er12 Er18 Er20 55.3(19) . .
Er1 Er18 Er20 72.4(17) . .
Er8 Er18 Er7 16.5(13) . .
Er9 Er18 Er7 80(2) . .
Er17 Er18 Er7 125(2) . .
Er12 Er18 Er7 92(2) . .
Er1 Er18 Er7 32.4(7) . .
Er20 Er18 Er7 40.6(14) . .
Er9 Er18 Er7 97.4(12) 6 .
Er8 Er18 N1 69.9(13) . .
Er9 Er18 N1 67.6(12) . .
Er17 Er18 N1 69.4(14) . .
Er12 Er18 N1 64.5(12) . .
Er1 Er18 N1 61.5(8) . .
Er20 Er18 N1 61.7(13) . .
Er9 Er18 N1 58.8(7) 6 .
Er7 Er18 N1 58.8(8) . .
Er8 Er18 Er22 77(2) . .
Er9 Er18 Er22 113.5(19) . .
Er17 Er18 Er22 98(2) . .
Er12 Er18 Er22 32.1(15) . .
Er1 Er18 Er22 86.2(15) . .
Er20 Er18 Er22 28.2(14) . .
Er9 Er18 Er22 103.3(15) 6 .
Er7 Er18 Er22 60.1(13) . .
N1 Er18 Er22 46.7(12) . .
Er18 Er18 Er22 90.0(13) 6 .
Er11 Er19 Er11 145(4) 6 .
Er11 Er19 Er13 107(5) 6 .
Er11 Er19 Er13 59(2) . .
Er11 Er19 Er5 133(3) 6 .
Er11 Er19 Er5 19.8(18) . .
Er13 Er19 Er5 75.3(15) . .
Er13 Er19 Er5 117(3) 6 .
Er11 Er19 Er15 124(4) 6 .
Er11 Er19 Er15 29(2) . .
Er13 Er19 Er15 33.0(14) . .
Er13 Er19 Er15 78(3) 6 .
Er5 Er19 Er15 42.4(10) . .
Er5 Er19 Er15 123(2) 6 .
Er15 Er19 Er15 97(3) 6 .
Er11 Er19 N1 72(2) 6 .
Er11 Er19 N1 72(2) . .
Er13 Er19 N1 74(2) . .
Er13 Er19 N1 74(2) 6 .
Er5 Er19 N1 63.2(11) . .
Er5 Er19 N1 63.2(11) 6 .
Er15 Er19 N1 60.9(13) 6 .
Er15 Er19 N1 60.9(13) . .
Er11 Er19 Er1 115(3) 6 .
Er11 Er19 Er1 42(2) . .
Er13 Er19 Er1 93.1(18) . .
Er13 Er19 Er1 124(3) 6 .
Er5 Er19 Er1 22.4(6) . .
Er5 Er19 Er1 96.9(19) 6 .
Er15 Er19 Er1 115.2(19) 6 .
Er15 Er19 Er1 60.6(11) . .
N1 Er19 Er1 55.1(9) . .
Er1 Er19 Er1 75.5(14) 6 .
Er11 Er19 Er3 132(3) 6 .
Er11 Er19 Er3 13.1(14) . .
Er13 Er19 Er3 55.9(13) . .
Er13 Er19 Er3 99(3) 6 .
Er5 Er19 Er3 19.5(5) . .
Er5 Er19 Er3 121(2) 6 .
Er15 Er19 Er3 111(2) 6 .
Er15 Er19 Er3 23.0(8) . .
N1 Er19 Er3 59.5(9) . .
Er1 Er19 Er3 105.8(16) 6 .
Er1 Er19 Er3 38.8(5) . .
Er22 Er20 Er16 89(3) . .
Er22 Er20 Er7 125(3) . .
Er16 Er20 Er7 54.7(19) . .
Er22 Er20 Er8 121(4) . .
Er16 Er20 Er8 98(3) . .
Er7 Er20 Er8 45.3(15) . .
Er22 Er20 Er12 62(3) . .
Er16 Er20 Er12 137(3) . .
Er7 Er20 Er12 115(3) . .
Er8 Er20 Er12 74.6(19) . .
Er22 Er20 Er21 42(3) . .
Er16 Er20 Er21 49(2) . .
Er7 Er20 Er21 99(3) . .
Er8 Er20 Er21 128(3) . .
Er12 Er20 Er21 101(3) . .
Er22 Er20 Er3 113(3) . .
Er16 Er20 Er3 35.8(15) . .
Er7 Er20 Er3 19.0(8) . .
Er8 Er20 Er3 63.0(14) . .
Er12 Er20 Er3 125(2) . .
Er21 Er20 Er3 81(2) . .
Er22 Er20 Er18 100(3) . .
Er16 Er20 Er18 125(3) . .
Er7 Er20 Er18 77(2) . .
Er8 Er20 Er18 32.9(11) . .
Er12 Er20 Er18 42.9(14) . .
Er21 Er20 Er18 129(3) . .
Er3 Er20 Er18 93.7(19) . .
Er22 Er20 Er4 15(3) . .
Er16 Er20 Er4 104(2) . .
Er7 Er20 Er4 131(2) . .
Er8 Er20 Er4 113(2) . .
Er12 Er20 Er4 47.2(13) . .
Er21 Er20 Er4 57(2) . .
Er3 Er20 Er4 122.8(17) . .
Er18 Er20 Er4 87.2(18) . .
Er22 Er20 N1 59(3) . .
Er16 Er20 N1 73.4(17) . .
Er7 Er20 N1 70.5(14) . .
Er8 Er20 N1 67.2(13) . .
Er12 Er20 N1 64.4(13) . .
Er21 Er20 N1 64.8(19) . .
Er3 Er20 N1 67.9(11) . .
Er18 Er20 N1 66.4(13) . .
Er4 Er20 N1 60.4(10) . .
Er22 Er20 Er1 116(3) . .
Er16 Er20 Er1 78(2) . .
Er7 Er20 Er1 28.4(10) . .
Er8 Er20 Er1 20.5(7) . .
Er12 Er20 Er1 87.0(18) . .
Er21 Er20 Er1 110(2) . .
Er3 Er20 Er1 43.9(8) . .
Er18 Er20 Er1 49.9(13) . .
Er4 Er20 Er1 114.2(16) . .
N1 Er20 Er1 57.5(9) . .
Er22 Er20 Er2 5(2) . .
Er16 Er20 Er2 85(2) . .
Er7 Er20 Er2 122(2) . .
Er8 Er20 Er2 121.9(19) . .
Er12 Er20 Er2 65.9(16) . .
Er21 Er20 Er2 36.9(19) . .
Er3 Er20 Er2 108.9(16) . .
Er18 Er20 Er2 102.7(18) . .
Er4 Er20 Er2 19.7(4) . .
N1 Er20 Er2 58.1(9) . .
Er1 Er20 Er2 115.6(15) . .
Er22 Er21 Er16 95(4) . .
Er22 Er21 Er2 52(3) . .
Er16 Er21 Er2 143(4) . .
Er22 Er21 Er6 89(4) . .
Er16 Er21 Er6 142(4) . .
Er2 Er21 Er6 41.9(15) . .
Er22 Er21 Er14 133(4) . .
Er16 Er21 Er14 68(3) . .
Er2 Er21 Er14 121(3) . .
Er6 Er21 Er14 82(3) . .
Er22 Er21 Er10 117(4) . .
Er16 Er21 Er10 111(3) . .
Er2 Er21 Er10 79(3) . .
Er6 Er21 Er10 37.4(15) . .
Er14 Er21 Er10 44.6(18) . .
Er22 Er21 Er20 45(3) . .
Er16 Er21 Er20 52(2) . .
Er2 Er21 Er20 97(3) . .
Er6 Er21 Er20 130(4) . .
Er14 Er21 Er20 113(3) . .
Er10 Er21 Er20 138(3) . .
Er22 Er21 Er4 30(3) . .
Er16 Er21 Er4 123(3) . .
Er2 Er21 Er4 21.5(8) . .
Er6 Er21 Er4 60.8(19) . .
Er14 Er21 Er4 130(3) . .
Er10 Er21 Er4 95(3) . .
Er20 Er21 Er4 75(2) . .
Er22 Er21 Er15 111(4) . .
Er16 Er21 Er15 32.1(18) . .
Er2 Er21 Er15 137(3) . .
Er6 Er21 Er15 112(3) . .
Er14 Er21 Er15 37.2(17) . .
Er10 Er21 Er15 79(2) . .
Er20 Er21 Er15 77(2) . .
Er4 Er21 Er15 129(2) . .
Er22 Er21 N1 63(3) . .
Er16 Er21 N1 77(2) . .
Er2 Er21 N1 73.6(19) . .
Er6 Er21 N1 71.0(18) . .
Er14 Er21 N1 70.6(19) . .
Er10 Er21 N1 68.7(17) . .
Er20 Er21 N1 70(2) . .
Er4 Er21 N1 66.4(15) . .
Er15 Er21 N1 64.4(14) . .
Er2 Er21 N1 63.3(13) 6 .
Er22 Er21 Er3 91(3) . .
Er16 Er21 Er3 15.5(14) . .
Er2 Er21 Er3 133(3) . .
Er6 Er21 Er3 127(2) . .
Er14 Er21 Er3 60.5(19) . .
Er10 Er21 Er3 100(2) . .
Er20 Er21 Er3 53.6(18) . .
Er4 Er21 Er3 116(2) . .
Er15 Er21 Er3 23.6(9) . .
Er2 Er21 Er3 126(2) 6 .
N1 Er21 Er3 62.4(11) . .
Er4 Er22 Er21 118(5) . .
Er4 Er22 Er2 41.3(17) . .
Er21 Er22 Er2 77(4) . .
Er4 Er22 Er20 148(5) . .
Er21 Er22 Er20 94(4) . .
Er2 Er22 Er20 170(5) . .
Er4 Er22 Er12 75(3) . .
Er21 Er22 Er12 158(4) . .
Er2 Er22 Er12 114(3) . .
Er20 Er22 Er12 74(3) . .
Er4 Er22 Er16 159(4) . .
Er21 Er22 Er16 47(3) . .
Er2 Er22 Er16 121(4) . .
Er20 Er22 Er16 49(2) . .
Er12 Er22 Er16 115(3) . .
Er4 Er22 Er16 142(3) 6 .
Er4 Er22 Er6 68(3) . .
Er21 Er22 Er6 53(3) . .
Er2 Er22 Er6 30.4(15) . .
Er20 Er22 Er6 141(4) . .
Er12 Er22 Er6 128(3) . .
Er4 Er22 Er6 57.5(16) 6 .
Er16 Er22 Er6 93(2) . .
Er2 Er22 Er6 32.7(10) 6 .
Er4 Er22 N1 91(3) . .
Er21 Er22 N1 86(3) . .
Er2 Er22 N1 89(3) . .
Er20 Er22 N1 89(3) . .
Er12 Er22 N1 76(2) . .
Er4 Er22 N1 73.8(17) 6 .
Er16 Er22 N1 74.9(17) . .
Er2 Er22 N1 72.5(17) 6 .
Er6 Er22 N1 70.9(17) . .
Er4 Er22 Er7 149(4) . .
Er21 Er22 Er7 78(3) . .
Er2 Er22 Er7 143(3) . .
Er20 Er22 Er7 31(2) . .
Er12 Er22 Er7 83(2) . .
Er4 Er22 Er7 134(2) 6 .
Er16 Er22 Er7 32.9(12) . .
Er2 Er22 Er7 132(2) 6 .
Er6 Er22 Er7 113(2) . .
N1 Er22 Er7 61.6(12) . .
Er4 Er22 Er10 89(3) . .
Er21 Er22 Er10 38(3) . .
Er2 Er22 Er10 54(2) . .
Er20 Er22 Er10 118(3) . .
Er12 Er22 Er10 132(3) . .
Er4 Er22 Er10 76.1(18) 6 .
Er16 Er22 Er10 70.3(19) . .
Er2 Er22 Er10 53.1(14) 6 .
Er6 Er22 Er10 23.3(8) . .
N1 Er22 Er10 59.8(14) . .
Er7 Er22 Er10 89.9(16) . .
C2 C1 C9 121.8(19) . .
C2 C1 C5 102(3) . .
C9 C1 C5 121(2) . .
C1 C2 C12 123(2) . .
C1 C2 C3 117(3) . .
C12 C2 C3 115(3) . .
C15 C3 C4 125(4) . .
C15 C3 C2 121(4) . .
C4 C3 C2 105(3) . .
C15 C3 C14 23(2) . .
C4 C3 C14 143(3) . .
C2 C3 C14 98(3) . .
C3 C4 C18 127(3) . .
C3 C4 C5 103(3) . .
C18 C4 C5 118(3) . .
C6 C5 C1 118(2) . .
C6 C5 C4 122(3) . .
C1 C5 C4 113(3) . .
C5 C6 C7 121(2) . .
C5 C6 C20 103(2) . .
C7 C6 C20 123(3) . .
C22 C7 C8 127(3) . .
C22 C7 C6 101(3) . .
C8 C7 C6 118(2) . .
C25 C8 C9 123(3) . .
C25 C8 C7 116(3) . .
C9 C8 C7 120(2) . .
C10 C9 C1 115.3(19) . .
C10 C9 C8 118(3) . .
C1 C9 C8 120(2) . .
C9 C10 C11 122.3(19) . .
C9 C10 C27 117(2) . .
C11 C10 C27 112(3) . .
C29 C11 C12 132(3) . .
C29 C11 C10 100(2) . .
C12 C11 C10 120(2) . .
C13 C12 C11 127(3) . .
C13 C12 C2 107(3) . .
C11 C12 C2 116(2) . .
C12 C13 C31 97(3) . .
C12 C13 C14 129(3) . .
C31 C13 C14 124(2) . .
C15 C14 C13 127(4) . .
C15 C14 C34 106(4) . .
C13 C14 C34 120(2) . .
C15 C14 C3 37(3) . .
C13 C14 C3 91(2) . .
C34 C14 C3 136(2) . .
C14 C15 C3 120(5) . .
C14 C15 C16 125(5) . .
C3 C15 C16 107(4) . .
C14 C15 C34 47(3) . .
C3 C15 C34 154(3) . .
C16 C15 C34 77(2) . .
C17 C16 C15 131(3) . .
C17 C16 C35 117(2) . .
C15 C16 C35 102(3) . .
C38 C17 C18 123(2) . .
C38 C17 C16 107(3) . .
C18 C17 C16 120(3) . .
C19 C18 C17 121(2) . .
C19 C18 C4 125(3) . .
C17 C18 C4 109(3) . .
C18 C19 C20 106(3) . .
C18 C19 C40 116(2) . .
C20 C19 C40 129(3) . .
C19 C20 C6 143(3) . .
C19 C20 C21 120(3) . .
C6 C20 C21 82(2) . .
C42 C21 C22 123(2) . .
C42 C21 C20 108(3) . .
C22 C21 C20 115(3) . .
C7 C22 C21 117(3) . .
C7 C22 C23 117(3) . .
C21 C22 C23 119(2) . .
C24 C23 C44 121.2(18) . .
C24 C23 C22 113(3) . .
C44 C23 C22 117(2) . .
C47 C24 C25 105.6(13) . .
C47 C24 C23 126(2) . .
C25 C24 C23 121(2) . .
C8 C25 C26 118(3) . .
C8 C25 C24 122(3) . .
C26 C25 C24 109.7(14) . .
C27 C26 C25 131(4) . .
C27 C26 C48 112(4) . .
C25 C26 C48 107.0(14) . .
C26 C27 C28 138(5) . .
C26 C27 C10 112(4) . .
C28 C27 C10 105(3) . .
C27 C28 C50 121(3) . .
C27 C28 C29 109(3) . .
C50 C28 C29 123(2) . .
C11 C29 C30 109(3) . .
C11 C29 C28 113(2) . .
C30 C29 C28 125(2) . .
C29 C30 C52 109.4(19) . .
C29 C30 C31 108(2) . .
C52 C30 C31 108.0(13) . .
C32 C31 C30 104.4(13) . .
C32 C31 C13 113.1(18) . .
C30 C31 C13 142(2) . .
C31 C32 C53 106.0(13) . .
C31 C32 C33 123.8(18) . .
C53 C32 C33 121.6(18) . .
C34 C33 C56 120.1(18) . .
C34 C33 C32 120.8(18) . .
C56 C33 C32 112.6(18) . .
C33 C34 C35 119(2) . .
C33 C34 C14 117.0(19) . .
C35 C34 C14 115(2) . .
C33 C34 C15 139(2) . .
C35 C34 C15 88(2) . .
C14 C34 C15 26.6(17) . .
C36 C35 C34 119(2) . .
C36 C35 C16 136(3) . .
C34 C35 C16 92(2) . .
C57 C36 C37 119(2) . .
C57 C36 C35 125(2) . .
C37 C36 C35 112(3) . .
C36 C37 C60 121(2) . .
C36 C37 C38 109(3) . .
C60 C37 C38 117(3) . .
C17 C38 C39 117(2) . .
C17 C38 C37 136(3) . .
C39 C38 C37 97(2) . .
C61 C39 C40 112(4) . .
C61 C39 C38 120(4) . .
C40 C39 C38 120(2) . .
C39 C40 C19 123(2) . .
C39 C40 C41 132(3) . .
C19 C40 C41 96(3) . .
C42 C41 C40 149(4) . .
C42 C41 C63 100(3) . .
C40 C41 C63 103(3) . .
C41 C42 C21 116(3) . .
C41 C42 C43 119(3) . .
C21 C42 C43 117(2) . .
C64 C43 C44 120(3) . .
C64 C43 C42 108(3) . .
C44 C43 C42 119(2) . .
C43 C44 C45 117(2) . .
C43 C44 C23 124(2) . .
C45 C44 C23 114.6(18) . .
C44 C45 C46 120(2) . .
C44 C45 C66 119(3) . .
C46 C45 C66 111(3) . .
C68 C46 C47 121(3) . .
C68 C46 C45 109(3) . .
C47 C46 C45 126(2) . .
C24 C47 C48 108.9(14) . .
C24 C47 C46 111(2) . .
C48 C47 C46 113(3) . .
C26 C48 C47 106.5(14) . .
C26 C48 C49 115(3) . .
C47 C48 C49 133(3) . .
C50 C49 C48 127(4) . .
C50 C49 C69 131(3) . .
C48 C49 C69 98(4) . .
C28 C50 C49 108(3) . .
C28 C50 C51 115(2) . .
C49 C50 C51 122(3) . .
C52 C51 C50 119(2) . .
C52 C51 C71 133(3) . .
C50 C51 C71 101(3) . .
C51 C52 C53 124(2) . .
C51 C52 C30 128(2) . .
C53 C52 C30 101.9(13) . .
C54 C53 C52 107(2) . .
C54 C53 C32 125(2) . .
C52 C53 C32 110.2(13) . .
C72 C54 C53 131(3) . .
C72 C54 C55 113(2) . .
C53 C54 C55 109.2(17) . .
C74 C55 C56 116(2) . .
C74 C55 C54 110.5(19) . .
C56 C55 C54 124.4(19) . .
C55 C56 C33 123(2) . .
C55 C56 C57 103(2) . .
C33 C56 C57 121.7(17) . .
C36 C57 C58 123(2) . .
C36 C57 C56 115.8(19) . .
C58 C57 C56 109(3) . .
C59 C58 C57 115.0(18) . .
C59 C58 C74 124(2) . .
C57 C58 C74 106(2) . .
C77 C59 C58 120(2) . .
C77 C59 C60 97(2) . .
C58 C59 C60 123.9(19) . .
C37 C60 C59 117(2) . .
C37 C60 C61 94(3) . .
C59 C60 C61 136(3) . .
C62 C61 C39 136(4) . .
C62 C61 C60 105(3) . .
C39 C61 C60 112(4) . .
C61 C62 C63 114(3) . .
C61 C62 C78 118(3) . .
C63 C62 C78 120(2) . .
C62 C63 C64 123(2) . .
C62 C63 C41 123(3) . .
C64 C63 C41 102(2) . .
C43 C64 C65 124(3) . .
C43 C64 C63 111(3) . .
C65 C64 C63 119(2) . .
C79 C65 C66 118(3) . .
C79 C65 C64 117(2) . .
C66 C65 C64 118(3) . .
C67 C66 C65 131(3) . .
C67 C66 C45 99(3) . .
C65 C66 C45 121(4) . .
C66 C67 C68 112(3) . .
C66 C67 C81 109(3) . .
C68 C67 C81 127(3) . .
C46 C68 C69 127(3) . .
C46 C68 C67 108(3) . .
C69 C68 C67 115(2) . .
C70 C69 C68 118(10) . .
C70 C69 C49 108(10) . .
C68 C69 C49 124(3) . .
C69 C70 C82 123(10) . .
C69 C70 C71 118(10) . .
C82 C70 C71 110(4) . .
C51 C71 C70 137(7) . .
C51 C71 C72 99(3) . .
C70 C71 C72 113(8) . .
C54 C72 C73 130(3) . .
C54 C72 C71 126(3) . .
C73 C72 C71 97(3) . .
C75 C73 C72 118(3) . .
C75 C73 C82 117(3) . .
C72 C73 C82 117(2) . .
C55 C74 C75 138(2) . .
C55 C74 C58 105(2) . .
C75 C74 C58 113.4(19) . .
C73 C75 C74 110(3) . .
C73 C75 C76 119(3) . .
C74 C75 C76 120.0(17) . .
C80 C76 C77 104.3(12) . .
C80 C76 C75 119(2) . .
C77 C76 C75 119.9(17) . .
C59 C77 C78 129(2) . .
C59 C77 C76 117.8(18) . .
C78 C77 C76 111.2(12) . .
C62 C78 C79 113.8(18) . .
C62 C78 C77 132(3) . .
C79 C78 C77 104.3(12) . .
C65 C79 C80 119(2) . .
C65 C79 C78 127(2) . .
C80 C79 C78 110.0(13) . .
C81 C80 C76 123(3) . .
C81 C80 C79 120(2) . .
C76 C80 C79 109.9(12) . .
C82 C81 C80 120(3) . .
C82 C81 C67 109(3) . .
C80 C81 C67 122(3) . .
C81 C82 C70 127(4) . .
C81 C82 C73 122(3) . .
C70 C82 C73 103(5) . .
N3A Ni1A N2A 89.93(11) . 6
N3A Ni1A N2A 89.93(11) . .
N2A Ni1A N2A 177.9(2) 6 .
N3A Ni1A N1A 177.6(2) . .
N2A Ni1A N1A 90.02(11) 6 .
N2A Ni1A N1A 90.02(11) . .
C1A C1A C14A 106.7(3) 6 .
C1A C1A C5A 128.6(3) 6 .
C14A C1A C5A 124.5(4) . .
C4A N1A C4A 105.4(5) . 6
C4A N1A Ni1A 127.3(3) . .
C4A N1A Ni1A 127.3(3) 6 .
N2A C2A C3A 125.7(4) . .
N2A C2A C8A 111.8(4) . .
C3A C2A C8A 122.5(4) . .
C6A N2A C2A 103.9(4) . .
C6A N2A Ni1A 128.2(3) . .
C2A N2A Ni1A 127.9(3) . .
C4A C3A C2A 122.6(4) . .
C14A N3A C14A 104.2(5) . 6
C14A N3A Ni1A 127.9(2) . .
C14A N3A Ni1A 127.9(2) 6 .
N1A C4A C3A 126.6(4) . .
N1A C4A C16A 111.2(4) . .
C3A C4A C16A 122.2(4) . .
N2A C6A C13A 125.5(4) . .
N2A C6A C7A 112.1(4) . .
C13A C6A C7A 122.4(4) . .
C1A C5A C15A 112.6(5) . .
C8A C7A C6A 105.9(4) . .
C8A C7A C12A 129.2(4) . .
C6A C7A C12A 124.8(4) . .
C7A C8A C2A 106.2(4) . .
C7A C8A C9A 128.9(4) . .
C2A C8A C9A 124.9(4) . .
C8A C9A C10A 113.0(5) . .
C7A C12A C11A 112.9(5) . .
C14A C13A C6A 123.3(4) . .
C13A C14A N3A 125.3(4) . .
C13A C14A C1A 123.5(4) . .
N3A C14A C1A 111.3(4) . .
C16A C16A C4A 106.1(3) 6 .
C16A C16A C17A 128.5(3) 6 .
C4A C16A C17A 125.3(4) . .
C16A C17A C18A 112.7(5) . .
C2C C1C C4C 120.0 . .
C1C C2C C3C 120.0 . .
C6C C3C C2C 120.0 . .
C5C C6C C3C 120.0 . .
C6C C5C C4C 120.0 . .
C5C C4C C1C 120.0 . .
C108 C107 C112 120.0 . .
C109 C108 C107 120.0 . .
C108 C109 C110 120.0 . .
C111 C110 C109 120.0 . .
C110 C111 C112 120.0 . .
C111 C112 C107 120.0 . .
C102 C101 C106 120.0 . .
C103 C102 C101 120.0 . .
C104 C103 C102 120.0 . .
C103 C104 C105 120.0 . .
C106 C105 C104 120.0 . .
C105 C106 C101 120.0 . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
N1 Er22 1.78(4) 6
N1 Er22 1.78(4) .
N1 Er12 1.983(16) 6
N1 Er12 1.983(16) .
N1 Er21 2.00(4) .
N1 Er21 2.00(4) 6
N1 Er1 2.007(6) .
N1 Er1 2.007(6) 6
N1 Er6 2.020(10) .
N1 Er9 2.023(13) .
N1 Er9 2.023(13) 6
N1 Er14 2.03(2) .
Er1 Er8 0.852(14) .
Er1 Er5 0.876(11) .
Er1 Er7 1.103(18) .
Er1 Er9 1.26(2) .
Er1 Er3 1.476(6) .
Er1 Er11 1.60(2) .
Er1 Er18 1.68(3) .
Er1 Er20 2.09(4) .
Er1 Er15 2.12(3) .
Er1 Er9 2.144(16) 6
Er1 Er16 2.20(3) .
Er2 Er4 0.728(4) .
Er2 Er2 0.779(5) 6
Er2 Er6 0.953(14) .
Er2 Er22 1.05(4) .
Er2 Er4 1.065(4) 6
Er2 Er21 1.30(4) .
Er2 Er22 1.69(4) 6
Er2 Er10 1.82(3) .
Er2 Er21 1.92(4) 6
Er2 Er12 2.08(2) .
Er2 Er20 2.16(4) .
Er3 Er7 0.652(7) .
Er3 Er5 0.803(9) .
Er3 Er15 0.87(3) .
Er3 Er16 1.05(3) .
Er3 Er11 1.23(2) .
Er3 Er8 1.735(15) .
Er3 Er20 1.77(4) .
Er3 Er13 1.85(2) .
Er3 Er14 1.92(3) .
Er3 Er21 2.17(4) .
Er4 Er4 0.774(10) 6
Er4 Er22 1.01(4) .
Er4 Er12 1.50(2) .
Er4 Er6 1.617(15) .
Er4 Er22 1.66(4) 6
Er4 Er21 1.76(4) .
Er4 Er12 1.90(2) 6
Er4 Er20 2.04(4) .
Er4 Er21 2.25(5) 6
Er5 Er7 0.874(15) .
Er5 Er11 0.888(18) .
Er5 Er15 1.38(3) .
Er5 Er8 1.493(15) .
Er5 Er16 1.76(3) .
Er5 Er19 1.80(2) .
Er5 Er13 1.87(2) .
Er5 Er9 2.08(2) .
Er5 Er20 2.17(4) .
Er6 Er10 0.95(3) .
Er6 Er21 1.36(4) .
Er6 Er21 1.36(4) 6
Er6 Er22 1.70(5) 6
Er6 Er22 1.70(5) .
Er6 Er14 1.82(3) 6
Er6 Er14 1.82(3) .
Er7 Er8 1.125(19) .
Er7 Er16 1.21(3) .
Er7 Er20 1.37(4) .
Er7 Er15 1.45(3) .
Er7 Er11 1.61(2) .
Er7 Er18 2.06(4) .
Er7 Er9 2.16(2) .
Er7 Er22 2.20(4) .
Er8 Er18 1.01(3) .
Er8 Er9 1.25(2) .
Er8 Er20 1.53(4) .
Er8 Er12 1.86(3) .
Er8 Er17 1.94(2) .
Er8 Er16 2.11(3) .
Er8 Er9 2.27(2) 6
Er9 Er9 1.11(4) 6
Er9 Er18 1.13(3) .
Er9 Er17 1.19(3) .
Er9 Er18 1.94(3) 6
Er9 Er12 2.16(3) .
Er10 Er14 1.14(3) 6
Er10 Er14 1.14(3) .
Er10 Er21 1.56(4) .
Er10 Er21 1.56(4) 6
Er10 Er13 2.17(3) 6
Er10 Er13 2.17(3) .
Er10 Er15 2.22(3) .
Er10 Er15 2.22(3) 6
Er11 Er19 1.05(2) .
Er11 Er13 1.08(3) .
Er11 Er15 1.18(3) .
Er11 Er13 1.75(3) 6
Er11 Er11 2.00(3) 6
Er11 Er16 2.03(3) .
Er11 Er14 2.05(3) .
Er12 Er18 1.28(3) .
Er12 Er22 1.41(5) .
Er12 Er20 1.54(4) .
Er12 Er17 1.59(4) .
Er12 Er12 1.76(4) 6
Er12 Er18 2.37(3) 6
Er13 Er13 0.94(4) 6
Er13 Er19 1.13(5) .
Er13 Er15 1.20(3) .
Er13 Er14 1.43(3) .
Er13 Er14 1.91(3) 6
Er13 Er15 2.06(3) 6
Er14 Er15 1.16(3) .
Er14 Er21 1.42(5) .
Er14 Er16 1.49(4) .
Er14 Er14 1.71(6) 6
Er14 Er22 2.27(5) .
Er15 Er16 1.09(3) .
Er15 Er21 1.91(5) .
Er15 Er19 1.98(4) .
Er16 Er21 1.22(4) .
Er16 Er20 1.26(4) .
Er16 Er22 1.67(5) .
Er17 Er18 1.15(3) 6
Er17 Er18 1.15(3) .
Er17 Er20 2.69(4) .
Er18 Er20 1.86(5) .
Er18 Er18 2.26(6) 6
Er18 Er22 2.32(5) .
Er20 Er22 1.11(5) .
Er20 Er21 1.57(6) .
Er21 Er22 1.04(4) .
C1 C2 1.42(2) .
C1 C9 1.44(2) .
C1 C5 1.45(2) .
C2 C12 1.45(2) .
C2 C3 1.56(4) .
C3 C15 1.37(6) .
C3 C4 1.43(5) .
C3 C14 1.99(6) .
C4 C18 1.56(5) .
C4 C5 1.66(5) .
C5 C6 1.43(2) .
C6 C7 1.47(2) .
C6 C20 1.63(5) .
C7 C22 1.20(4) .
C7 C8 1.46(2) .
C8 C25 1.17(4) .
C8 C9 1.45(2) .
C9 C10 1.44(2) .
C10 C11 1.47(2) .
C10 C27 1.50(5) .
C11 C29 1.42(4) .
C11 C12 1.44(2) .
C12 C13 1.33(5) .
C13 C31 1.49(2) .
C13 C14 1.49(2) .
C14 C15 0.91(6) .
C14 C34 1.49(2) .
C15 C16 1.52(6) .
C15 C34 1.95(6) .
C16 C17 1.48(4) .
C16 C35 1.58(4) .
C17 C38 1.40(2) .
C17 C18 1.40(2) .
C18 C19 1.39(3) .
C19 C20 1.40(4) .
C19 C40 1.44(2) .
C20 C21 1.65(4) .
C21 C42 1.44(2) .
C21 C22 1.45(2) .
C22 C23 1.45(2) .
C23 C24 1.43(2) .
C23 C44 1.44(2) .
C24 C47 1.405(17) .
C24 C25 1.41(2) .
C25 C26 1.40(2) .
C26 C27 1.27(5) .
C26 C48 1.41(2) .
C27 C28 1.36(5) .
C28 C50 1.43(2) .
C28 C29 1.46(2) .
C29 C30 1.45(2) .
C30 C52 1.460(15) .
C30 C31 1.465(18) .
C31 C32 1.461(14) .
C32 C53 1.461(14) .
C32 C33 1.501(19) .
C33 C34 1.476(19) .
C33 C56 1.479(19) .
C34 C35 1.47(2) .
C35 C36 1.466(19) .
C36 C57 1.44(2) .
C36 C37 1.44(2) .
C37 C60 1.45(2) .
C37 C38 1.83(5) .
C38 C39 1.41(2) .
C39 C61 1.36(5) .
C39 C40 1.39(2) .
C40 C41 1.47(4) .
C41 C42 1.18(4) .
C41 C63 1.78(5) .
C42 C43 1.46(2) .
C43 C64 1.37(4) .
C43 C44 1.42(2) .
C44 C45 1.43(2) .
C45 C46 1.43(2) .
C45 C66 1.46(4) .
C46 C68 1.20(3) .
C46 C47 1.41(2) .
C47 C48 1.41(2) .
C48 C49 1.58(5) .
C49 C50 1.46(6) .
C49 C69 1.58(5) .
C50 C51 1.45(2) .
C51 C52 1.45(2) .
C51 C71 1.50(5) .
C52 C53 1.457(18) .
C53 C54 1.45(2) .
C54 C72 1.36(3) .
C54 C55 1.541(19) .
C55 C74 1.39(4) .
C55 C56 1.424(18) .
C56 C57 1.48(2) .
C57 C58 1.48(2) .
C58 C59 1.433(19) .
C58 C74 1.49(2) .
C59 C77 1.413(19) .
C59 C60 1.47(2) .
C60 C61 1.82(6) .
C61 C62 1.34(5) .
C62 C63 1.36(2) .
C62 C78 1.41(2) .
C63 C64 1.38(2) .
C64 C65 1.38(2) .
C65 C79 1.35(2) .
C65 C66 1.36(5) .
C66 C67 1.35(5) .
C67 C68 1.48(4) .
C67 C81 1.48(4) .
C68 C69 1.42(3) .
C69 C70 1.34(9) .
C70 C82 1.5(3) .
C70 C71 1.55(19) .
C71 C72 1.64(5) .
C72 C73 1.55(6) .
C73 C75 1.32(4) .
C73 C82 1.62(4) .
C74 C75 1.48(2) .
C75 C76 1.503(19) .
C76 C80 1.406(17) .
C76 C77 1.455(14) .
C77 C78 1.423(18) .
C78 C79 1.423(14) .
C79 C80 1.407(17) .
C80 C81 1.39(4) .
C81 C82 1.30(4) .
Ni1A N3A 1.958(5) .
Ni1A N2A 1.958(4) 6
Ni1A N2A 1.958(4) .
Ni1A N1A 1.959(5) .
C1A C1A 1.355(10) 6
C1A C14A 1.443(6) .
C1A C5A 1.497(7) .
N1A C4A 1.365(5) .
N1A C4A 1.365(5) 6
C2A N2A 1.368(6) .
C2A C3A 1.381(6) .
C2A C8A 1.448(6) .
N2A C6A 1.365(6) .
C3A C4A 1.376(6) .
N3A C14A 1.383(5) .
N3A C14A 1.383(5) 6
C4A C16A 1.456(7) .
C6A C13A 1.389(6) .
C6A C7A 1.447(6) .
C5A C15A 1.527(8) .
C7A C8A 1.350(7) .
C7A C12A 1.510(7) .
C8A C9A 1.503(7) .
C9A C10A 1.528(11) .
C11A C12A 1.532(9) .
C13A C14A 1.375(7) .
C16A C16A 1.365(10) 6
C16A C17A 1.495(7) .
C17A C18A 1.517(10) .
C1C C2C 1.3900 .
C1C C4C 1.3900 .
C2C C3C 1.3900 .
C3C C6C 1.3900 .
C6C C5C 1.3900 .
C5C C4C 1.3900 .
C107 C108 1.3900 .
C107 C112 1.3900 .
C108 C109 1.3900 .
C109 C110 1.3900 .
C110 C111 1.3900 .
C111 C112 1.3900 .
C101 C102 1.3900 .
C101 C106 1.3900 .
C102 C103 1.3900 .
C103 C104 1.3900 .
C104 C105 1.3900 .
C105 C106 1.3900 .
