# Electronic Supplementary Material (ESI) for New Journal of Chemistry.
# This journal is © The Royal Society of Chemistry and the Centre National de la Recherche Scientifique 2020

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_cb44ck
_database_code_depnum_ccdc_archive 'CCDC 2008213'
loop_
_audit_author_name
_audit_author_address
'Christian Kleeberg'
;Technische Universitaet Braunschweig, Institut fuer Anorganische und Analytische Chemie
Germany
;
_audit_update_record             
;
2020-06-05 deposited with the CCDC.	2020-07-28 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2014/7
_shelx_SHELXL_version_number     2014/7
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C32 H46 B Cu N2 O2, C7 H8'
_chemical_formula_sum            'C39 H54 B Cu N2 O2'
_chemical_formula_weight         657.19

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu -1.9646 0.5888 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   12.4025(14)
_cell_length_b                   14.8764(19)
_cell_length_c                   20.461(2)
_cell_angle_alpha                93.490(9)
_cell_angle_beta                 96.621(11)
_cell_angle_gamma                93.591(9)
_cell_volume                     3733.7(7)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    4976
_cell_measurement_theta_min      3.59
_cell_measurement_theta_max      75.28

_exptl_crystal_description       'fragment of plate'
_exptl_crystal_colour            'clear colourless'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.169
_exptl_crystal_F_000             1408
_exptl_crystal_size_max          0.18
_exptl_crystal_size_mid          0.09
_exptl_crystal_size_min          0.03
_exptl_absorpt_coefficient_mu    1.072
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.85337
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
;
 CrysAlisPro, Agilent Technologies,
 Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
 (compiled Aug 13 2014,18:06:01)
 Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;


_exptl_crystal_recrystallization_method 
;
 From a solution in PhMe layered with n-pentane at -40 deg C.
;

_exptl_special_details           
;
 The crystal was mounted on top of a human hair with perfluorether oil
 and placed in a cold nitrogen gas stream on the diffractometer.

 The collected data cover more than a hemisphere of the reciprocal space.
 A combination of 44 sets of ω scans were used; each set at different \j,
 2θ or κ angles and each scan 1.3 deg in ω.
 Each frame was exposed for 15 s (low 2θ angles) or 45 s (high 2θ angles).
 Nominal crystal to detector distance 53 mm.
;



_diffrn_ambient_temperature      100(2)
_diffrn_radiation_wavelength     1.54184
_diffrn_radiation_type           CuK\a
_diffrn_source                   'Nova (Cu) X-ray Source'
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device_type  'Oxford Diffraction, Xcalibur, Atlas, Nova'
_diffrn_measurement_method       ω-scan
_diffrn_detector_area_resol_mean 10.3543
_diffrn_reflns_number            24616
_diffrn_reflns_av_unetI/netI     0.1151
_diffrn_reflns_av_R_equivalents  ?
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_l_min       -24
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_theta_min         3.572
_diffrn_reflns_theta_max         67.000
_diffrn_reflns_theta_full        67.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 1.000
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 1.000
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             24616
_reflns_number_gt                14196
_reflns_threshold_expression     'I > 2σ(I)'



_computing_data_collection       
;
 CrysAlisPro, Agilent Technologies,
 Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
 (compiled Aug 13 2014,18:06:01)
;
_computing_cell_refinement       
;
 CrysAlisPro, Agilent Technologies,
 Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
 (compiled Aug 13 2014,18:06:01)
;
_computing_data_reduction        
;
 CrysAlisPro, Agilent Technologies,
 Version 1.171.37.35 (release 13-08-2014 CrysAlis171 .NET)
 (compiled Aug 13 2014,18:06:01)
;
_computing_structure_solution    
;
 SHELXT (Ver. 2014/4) (G. M. Sheldrick, Acta Cryst., 2015, A71, 3--8)
;
_computing_structure_refinement  
;
 SHELXL-2014/7 (G. M. Sheldrick, Acta Cryst. (2008), A64, 112-122)'
;
_computing_molecular_graphics    
;
 Diamond, Crystal Impact, H. Putz and K. Brandenburg GbR, Bonn, Germany, 2020.
;
_computing_publication_material  
;
 WinGX v2014.1 (L. J. Farrugia, J. Appl. Cryst., 2012, 45, 849-854.)
;



_refine_special_details          
;
The crystal is non-merohedrally twinned and was refined 2-component twin.
 For refinement a dataset containing reflection data of two domains were
 employed, whilst for solution only data of the main domain were used
 (Rint = 0.1594).
 The twin factor refined to 0.4380(8).
 
 Twin law: 
 180 deg rotation around the reciprocal 0.00 1.00 0.00 axis 
 or the  0.08 1.00 0.05 real space axis)

 -1.00   0.00   0.00
  0.16   1.00   0.10
 -0.00   0.00  -1.00



 A disordered iso-propyl group was refined using a split atom model (0.65(1) SOF
 of main component), applying geometrical restraints (SAME) and
 refining a common ADP for each disordered atom pair.

 All H atoms were placed in idealised positions and refined using a riding
 model, with a common U restrained to be 1.2 (1.5 for methyl groups) times
 the equivalent isotropic displacement parameter of the parent atom.
 Methyl groups were treated as rigid bodies and allowed to rotate about
 the E-CH3 bond.


 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;


_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0769P)²] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         24616
_refine_ls_number_parameters     843
_refine_ls_number_restraints     3
_refine_ls_R_factor_all          0.1097
_refine_ls_R_factor_gt           0.0605
_refine_ls_wR_factor_ref         0.1582
_refine_ls_wR_factor_gt          0.1415
_refine_ls_goodness_of_fit_ref   0.912
_refine_ls_restrained_S_all      0.913
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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
C1 C 0.3225(3) 0.4761(3) 0.1960(2) 0.0248(9) Uani 1 1 d . . . . .
C2 C 0.3051(4) 0.6286(3) 0.2070(2) 0.0267(10) Uani 1 1 d . . . . .
H2 H 0.3128 0.6910 0.1995 0.032 Uiso 1 1 calc R U . . .
C3 C 0.2502(4) 0.5909(3) 0.2525(2) 0.0282(10) Uani 1 1 d . . . . .
H3 H 0.2117 0.6213 0.2837 0.034 Uiso 1 1 calc R U . . .
C4 C 0.4098(4) 0.5735(3) 0.1184(2) 0.0271(10) Uani 1 1 d . . . . .
C5 C 0.3523(4) 0.5928(3) 0.0592(2) 0.0276(10) Uani 1 1 d . . . . .
C6 C 0.4126(4) 0.6154(3) 0.0083(2) 0.0307(10) Uani 1 1 d . . . . .
H6 H 0.3761 0.6282 -0.0332 0.037 Uiso 1 1 calc R U . . .
C7 C 0.5256(4) 0.6195(3) 0.0178(2) 0.0325(11) Uani 1 1 d . . . . .
H7 H 0.5658 0.6368 -0.0168 0.039 Uiso 1 1 calc R U . . .
C8 C 0.5793(4) 0.5986(3) 0.0764(2) 0.0328(11) Uani 1 1 d . . . . .
H8 H 0.6565 0.6010 0.0815 0.039 Uiso 1 1 calc R U . . .
C9 C 0.5242(4) 0.5738(3) 0.1291(2) 0.0296(10) Uani 1 1 d . . . . .
C10 C 0.2285(4) 0.5848(3) 0.0487(2) 0.0332(11) Uani 1 1 d . . . . .
H10 H 0.2021 0.5912 0.0930 0.040 Uiso 1 1 calc R U . . .
C11 C 0.1879(4) 0.4916(4) 0.0176(3) 0.0451(13) Uani 1 1 d . . . . .
H11A H 0.1083 0.4851 0.0146 0.068 Uiso 1 1 calc R U . . .
H11B H 0.2189 0.4454 0.0448 0.068 Uiso 1 1 calc R U . . .
H11C H 0.2103 0.4843 -0.0267 0.068 Uiso 1 1 calc R U . . .
C12 C 0.1799(4) 0.6576(4) 0.0076(3) 0.0415(12) Uani 1 1 d . . . . .
H12A H 0.2054 0.7173 0.0287 0.062 Uiso 1 1 calc R U . . .
H12B H 0.1004 0.6505 0.0042 0.062 Uiso 1 1 calc R U . . .
H12C H 0.2028 0.6520 -0.0367 0.062 Uiso 1 1 calc R U . . .
C13 C 0.5830(4) 0.5493(3) 0.1940(2) 0.0335(11) Uani 1 1 d . . . . .
H13 H 0.5378 0.4993 0.2103 0.040 Uiso 1 1 calc R U . . .
C14 C 0.6957(4) 0.5147(4) 0.1873(3) 0.0402(12) Uani 1 1 d . . . . .
H14A H 0.6887 0.4644 0.1534 0.060 Uiso 1 1 calc R U . . .
H14B H 0.7264 0.4939 0.2296 0.060 Uiso 1 1 calc R U . . .
H14C H 0.7440 0.5636 0.1745 0.060 Uiso 1 1 calc R U . . .
C15 C 0.5934(4) 0.6287(4) 0.2462(3) 0.0426(13) Uani 1 1 d . . . . .
H15A H 0.6363 0.6794 0.2314 0.064 Uiso 1 1 calc R U . . .
H15B H 0.6297 0.6102 0.2879 0.064 Uiso 1 1 calc R U . . .
H15C H 0.5207 0.6472 0.2529 0.064 Uiso 1 1 calc R U . . .
C16 C 0.2082(4) 0.4365(3) 0.2851(2) 0.0291(10) Uani 1 1 d . . . . .
C17 C 0.2546(4) 0.4300(3) 0.3495(2) 0.0309(10) Uani 1 1 d . . . . .
C18 C 0.1956(4) 0.3775(3) 0.3896(3) 0.0389(12) Uani 1 1 d . . . . .
H18 H 0.2246 0.3716 0.4341 0.047 Uiso 1 1 calc R U . . .
C19 C 0.0959(5) 0.3343(3) 0.3655(3) 0.0400(13) Uani 1 1 d . . . . .
H19 H 0.0564 0.2999 0.3936 0.048 Uiso 1 1 calc R U . . .
C20 C 0.0535(4) 0.3409(3) 0.3010(3) 0.0357(11) Uani 1 1 d . . . . .
H20 H -0.0146 0.3100 0.2848 0.043 Uiso 1 1 calc R U . . .
C21 C 0.1084(3) 0.3922(3) 0.2588(2) 0.0278(10) Uani 1 1 d . . . . .
C22 C 0.0609(4) 0.3970(3) 0.1873(3) 0.0349(11) Uani 1 1 d . . . . .
H22 H 0.1030 0.4469 0.1687 0.042 Uiso 1 1 calc R U . . .
C23 C 0.0756(5) 0.3101(4) 0.1472(3) 0.0501(14) Uani 1 1 d . . . . .
H23A H 0.1531 0.2993 0.1504 0.075 Uiso 1 1 calc R U . . .
H23B H 0.0474 0.3153 0.1010 0.075 Uiso 1 1 calc R U . . .
H23C H 0.0358 0.2595 0.1645 0.075 Uiso 1 1 calc R U . . .
C24 C -0.0588(4) 0.4192(4) 0.1804(3) 0.0493(14) Uani 1 1 d . . . . .
H24A H -0.1031 0.3692 0.1952 0.074 Uiso 1 1 calc R U . . .
H24B H -0.0834 0.4280 0.1342 0.074 Uiso 1 1 calc R U . . .
H24C H -0.0663 0.4745 0.2076 0.074 Uiso 1 1 calc R U . . .
C25 C 0.3637(4) 0.4779(4) 0.3767(3) 0.0409(12) Uani 1 1 d . . . . .
H25 H 0.3936 0.5075 0.3394 0.049 Uiso 1 1 calc R U . . .
C26 C 0.4439(6) 0.4118(5) 0.4013(5) 0.089(3) Uani 1 1 d . . . . .
H26A H 0.4227 0.3879 0.4420 0.133 Uiso 1 1 calc R U . . .
H26B H 0.5169 0.4425 0.4103 0.133 Uiso 1 1 calc R U . . .
H26C H 0.4443 0.3620 0.3678 0.133 Uiso 1 1 calc R U . . .
C27 C 0.3519(6) 0.5516(6) 0.4292(4) 0.087(3) Uani 1 1 d . . . . .
H27A H 0.2975 0.5920 0.4120 0.131 Uiso 1 1 calc R U . . .
H27B H 0.4220 0.5861 0.4414 0.131 Uiso 1 1 calc R U . . .
H27C H 0.3284 0.5245 0.4681 0.131 Uiso 1 1 calc R U . . .
C28 C 0.5409(4) 0.1153(3) 0.1750(2) 0.0355(11) Uani 1 1 d . . . . .
H28A H 0.4901 0.0608 0.1724 0.043 Uiso 1 1 calc R U . . .
H28B H 0.6002 0.1090 0.2108 0.043 Uiso 1 1 calc R U . . .
C29 C 0.5886(4) 0.1205(3) 0.1105(3) 0.0330(11) Uani 1 1 d . . . . .
C30 C 0.4946(5) 0.1361(4) 0.0591(3) 0.0429(13) Uani 1 1 d . . . . .
H30A H 0.5223 0.1440 0.0162 0.052 Uiso 1 1 calc R U . . .
H30B H 0.4422 0.0824 0.0537 0.052 Uiso 1 1 calc R U . . .
C31 C 0.6766(4) 0.1975(4) 0.1146(3) 0.0473(14) Uani 1 1 d . . . . .
H31A H 0.7050 0.2004 0.0720 0.071 Uiso 1 1 calc R U . . .
H31B H 0.7358 0.1871 0.1488 0.071 Uiso 1 1 calc R U . . .
H31C H 0.6456 0.2547 0.1258 0.071 Uiso 1 1 calc R U . . .
C32 C 0.6359(5) 0.0309(4) 0.0937(3) 0.0474(14) Uani 1 1 d . . . . .
H32A H 0.5792 -0.0183 0.0921 0.071 Uiso 1 1 calc R U . . .
H32B H 0.6958 0.0210 0.1275 0.071 Uiso 1 1 calc R U . . .
H32C H 0.6632 0.0325 0.0506 0.071 Uiso 1 1 calc R U . . .
N1 N 0.3489(3) 0.5577(2) 0.17306(18) 0.0258(8) Uani 1 1 d . . . . .
N2 N 0.2607(3) 0.4991(2) 0.24493(18) 0.0242(8) Uani 1 1 d . . . . .
O1 O 0.4837(3) 0.1935(2) 0.19109(16) 0.0349(8) Uani 1 1 d . . . . .
O2 O 0.4393(3) 0.2152(2) 0.07770(18) 0.0426(9) Uani 1 1 d . . . . .
Cu1 Cu 0.37237(6) 0.36077(5) 0.16897(4) 0.03050(18) Uani 1 1 d . . . . .
B1 B 0.4379(5) 0.2455(4) 0.1438(3) 0.0333(12) Uani 1 1 d . . . . .
C1A C 0.1932(4) 0.9928(3) 0.3073(2) 0.0293(10) Uani 1 1 d . . . . .
C2A C 0.2823(4) 1.1086(3) 0.2628(2) 0.0296(10) Uani 1 1 d . . . . .
H2A H 0.3277 1.1396 0.2358 0.035 Uiso 1 1 calc R U . . .
C3A C 0.2259(4) 1.1464(3) 0.3085(2) 0.0288(10) Uani 1 1 d . . . . .
H3A H 0.2235 1.2090 0.3202 0.035 Uiso 1 1 calc R U . . .
C4A C 0.3021(4) 0.9535(3) 0.2158(2) 0.0280(10) Uani 1 1 d . . . . .
C5A C 0.2546(4) 0.9484(3) 0.1507(2) 0.0319(11) Uani 1 1 d . . . . .
C6A C 0.2994(4) 0.8915(3) 0.1054(3) 0.0367(11) Uani 1 1 d . . . . .
H6A H 0.2687 0.8863 0.0605 0.044 Uiso 1 1 calc R U . . .
C7A C 0.3876(4) 0.8427(3) 0.1251(3) 0.0362(11) Uani 1 1 d . . . . .
H7A H 0.4176 0.8050 0.0937 0.043 Uiso 1 1 calc R U . . .
C8A C 0.4317(4) 0.8487(3) 0.1902(3) 0.0350(11) Uani 1 1 d . . . . .
H8A H 0.4914 0.8142 0.2032 0.042 Uiso 1 1 calc R U . . .
C9A C 0.3906(4) 0.9046(3) 0.2376(2) 0.0296(10) Uani 1 1 d . . . . .
C10A C 0.1556(4) 0.9992(3) 0.1285(3) 0.0368(11) Uani 1 1 d . . . . .
H10A H 0.1404 1.0389 0.1671 0.044 Uiso 1 1 calc R U . . .
C11A C 0.0566(5) 0.9344(5) 0.1091(4) 0.081(3) Uani 1 1 d . . . . .
H11D H -0.0068 0.9685 0.0967 0.122 Uiso 1 1 calc R U . . .
H11E H 0.0432 0.8988 0.1465 0.122 Uiso 1 1 calc R U . . .
H11F H 0.0693 0.8938 0.0717 0.122 Uiso 1 1 calc R U . . .
C12A C 0.1760(6) 1.0601(5) 0.0735(4) 0.069(2) Uani 1 1 d . . . . .
H12D H 0.2406 1.1011 0.0876 0.103 Uiso 1 1 calc R U . . .
H12E H 0.1128 1.0953 0.0634 0.103 Uiso 1 1 calc R U . . .
H12F H 0.1879 1.0230 0.0340 0.103 Uiso 1 1 calc R U . . .
C13A C 0.4412(4) 0.9087(3) 0.3091(3) 0.0363(11) Uani 1 1 d . . . . .
H13A H 0.4086 0.9585 0.3334 0.044 Uiso 1 1 calc R U . . .
C14A C 0.4128(5) 0.8211(4) 0.3405(3) 0.0448(13) Uani 1 1 d . . . . .
H14D H 0.4422 0.7706 0.3170 0.067 Uiso 1 1 calc R U . . .
H14E H 0.3335 0.8109 0.3379 0.067 Uiso 1 1 calc R U . . .
H14F H 0.4444 0.8257 0.3869 0.067 Uiso 1 1 calc R U . . .
C15A C 0.5639(4) 0.9310(4) 0.3159(3) 0.0504(15) Uani 1 1 d . . . . .
H15D H 0.5991 0.8804 0.2965 0.076 Uiso 1 1 calc R U . . .
H15E H 0.5919 0.9415 0.3627 0.076 Uiso 1 1 calc R U . . .
H15F H 0.5795 0.9854 0.2930 0.076 Uiso 1 1 calc R U . . .
C16A C 0.1020(4) 1.0873(3) 0.3867(2) 0.0292(10) Uani 1 1 d . . . . .
C17A C 0.1496(4) 1.1142(3) 0.4505(2) 0.0305(10) Uani 1 1 d . . . . .
C18A C 0.0809(4) 1.1263(3) 0.4990(3) 0.0363(11) Uani 1 1 d . . . . .
H18A H 0.1111 1.1434 0.5432 0.044 Uiso 1 1 calc R U . . .
C19A C -0.0310(4) 1.1139(3) 0.4835(3) 0.0404(12) Uani 1 1 d . . . . .
H19A H -0.0769 1.1235 0.5171 0.048 Uiso 1 1 calc R U . . .
C20A C -0.0761(4) 1.0879(3) 0.4206(3) 0.0402(12) Uani 1 1 d . . . . .
H20A H -0.1530 1.0800 0.4111 0.048 Uiso 1 1 calc R U . . .
C21A C -0.0117(4) 1.0727(3) 0.3697(3) 0.0344(11) Uani 1 1 d . . . . .
C22A C 0.2733(4) 1.1248(3) 0.4672(2) 0.0319(10) Uani 1 1 d . . . . .
H22A H 0.3049 1.1442 0.4271 0.038 Uiso 1 1 calc R U . . .
C23A C 0.3160(4) 1.0334(3) 0.4830(3) 0.0400(12) Uani 1 1 d . . . . .
H23D H 0.2850 1.0120 0.5217 0.060 Uiso 1 1 calc R U . . .
H23E H 0.3955 1.0398 0.4923 0.060 Uiso 1 1 calc R U . . .
H23F H 0.2949 0.9897 0.4452 0.060 Uiso 1 1 calc R U . . .
C24A C 0.3114(4) 1.1957(3) 0.5234(3) 0.0411(12) Uani 1 1 d . . . . .
H24D H 0.2808 1.2532 0.5132 0.062 Uiso 1 1 calc R U . . .
H24E H 0.3910 1.2038 0.5287 0.062 Uiso 1 1 calc R U . . .
H24F H 0.2868 1.1759 0.5644 0.062 Uiso 1 1 calc R U . . .
C25A C -0.0631(4) 1.0426(4) 0.3002(3) 0.0460(14) Uani 0.650(10) 1 d D . P A 1
H25A H -0.0119 0.9996 0.2837 0.055 Uiso 0.650(10) 1 calc R U P A 1
C26A C -0.1691(7) 0.9862(7) 0.2977(7) 0.053(3) Uani 0.650(10) 1 d D . P A 1
H26D H -0.2267 1.0251 0.3079 0.079 Uiso 0.650(10) 1 calc R U P A 1
H26E H -0.1614 0.9404 0.3301 0.079 Uiso 0.650(10) 1 calc R U P A 1
H26F H -0.1881 0.9565 0.2534 0.079 Uiso 0.650(10) 1 calc R U P A 1
C27A C -0.0659(8) 1.1144(6) 0.2521(5) 0.054(2) Uani 0.650(10) 1 d D . P A 1
H27D H -0.0829 1.0864 0.2072 0.082 Uiso 0.650(10) 1 calc R U P A 1
H27E H 0.0052 1.1482 0.2564 0.082 Uiso 0.650(10) 1 calc R U P A 1
H27F H -0.1219 1.1555 0.2613 0.082 Uiso 0.650(10) 1 calc R U P A 1
C25B C -0.0631(4) 1.0426(4) 0.3002(3) 0.0460(14) Uani 0.350(10) 1 d D . P A 2
H25B H -0.0061 1.0343 0.2700 0.055 Uiso 0.350(10) 1 calc R U P A 2
C26B C -0.1369(15) 0.9583(10) 0.2988(16) 0.053(3) Uani 0.350(10) 1 d D . P A 2
H26G H -0.1902 0.9672 0.3299 0.079 Uiso 0.350(10) 1 calc R U P A 2
H26H H -0.0937 0.9078 0.3112 0.079 Uiso 0.350(10) 1 calc R U P A 2
H26I H -0.1749 0.9450 0.2542 0.079 Uiso 0.350(10) 1 calc R U P A 2
C27B C -0.1368(14) 1.1213(9) 0.2786(10) 0.054(2) Uani 0.350(10) 1 d D . P A 2
H27G H -0.1672 1.1093 0.2323 0.082 Uiso 0.350(10) 1 calc R U P A 2
H27H H -0.0927 1.1788 0.2840 0.082 Uiso 0.350(10) 1 calc R U P A 2
H27I H -0.1962 1.1243 0.3062 0.082 Uiso 0.350(10) 1 calc R U P A 2
C28A C -0.1220(4) 0.6777(3) 0.3540(3) 0.0384(12) Uani 1 1 d . . . . .
H28C H -0.1501 0.6509 0.3093 0.046 Uiso 1 1 calc R U . . .
H28D H -0.1853 0.6922 0.3771 0.046 Uiso 1 1 calc R U . . .
C29A C -0.0596(4) 0.6088(3) 0.3911(2) 0.0313(10) Uani 1 1 d . . . . .
C30A C 0.0418(4) 0.5965(3) 0.3570(3) 0.0378(12) Uani 1 1 d . . . . .
H30C H 0.0883 0.5550 0.3815 0.045 Uiso 1 1 calc R U . . .
H30D H 0.0201 0.5683 0.3119 0.045 Uiso 1 1 calc R U . . .
C31A C -0.0275(5) 0.6400(4) 0.4627(3) 0.0451(13) Uani 1 1 d . . . . .
H31D H 0.0200 0.6957 0.4657 0.068 Uiso 1 1 calc R U . . .
H31E H 0.0114 0.5932 0.4853 0.068 Uiso 1 1 calc R U . . .
H31F H -0.0929 0.6514 0.4837 0.068 Uiso 1 1 calc R U . . .
C32A C -0.1284(4) 0.5193(3) 0.3858(3) 0.0442(13) Uani 1 1 d . . . . .
H32D H -0.1944 0.5274 0.4070 0.066 Uiso 1 1 calc R U . . .
H32E H -0.0864 0.4737 0.4077 0.066 Uiso 1 1 calc R U . . .
H32F H -0.1486 0.4994 0.3392 0.066 Uiso 1 1 calc R U . . .
N1A N 0.2611(3) 1.0159(2) 0.26246(18) 0.0266(8) Uani 1 1 d . . . . .
N2A N 0.1720(3) 1.0748(2) 0.33519(19) 0.0271(8) Uani 1 1 d . . . . .
O1A O -0.0582(3) 0.7596(2) 0.34786(17) 0.0344(8) Uani 1 1 d . . . . .
O2A O 0.1036(3) 0.6804(2) 0.35302(18) 0.0367(8) Uani 1 1 d . . . . .
Cu1A Cu 0.13169(5) 0.87710(4) 0.32773(3) 0.02900(17) Uani 1 1 d . . . . .
B1A B 0.0542(4) 0.7607(4) 0.3454(3) 0.0294(11) Uani 1 1 d . . . . .
C40 C 0.2686(5) 0.7160(4) 0.5790(3) 0.0482(14) Uani 1 1 d . . . . .
H40 H 0.2072 0.6737 0.5746 0.058 Uiso 1 1 calc R U . . .
C41 C 0.2916(5) 0.7608(4) 0.5252(3) 0.0515(15) Uani 1 1 d . . . . .
H41 H 0.2478 0.7484 0.4840 0.062 Uiso 1 1 calc R U . . .
C42 C 0.3795(5) 0.8242(4) 0.5314(3) 0.0527(15) Uani 1 1 d . . . . .
H42 H 0.3955 0.8564 0.4947 0.063 Uiso 1 1 calc R U . . .
C43 C 0.4438(5) 0.8404(4) 0.5915(3) 0.0485(14) Uani 1 1 d . . . . .
H43 H 0.5044 0.8835 0.5957 0.058 Uiso 1 1 calc R U . . .
C44 C 0.4204(4) 0.7947(4) 0.6447(3) 0.0414(12) Uani 1 1 d . . . . .
H44 H 0.4647 0.8068 0.6857 0.050 Uiso 1 1 calc R U . . .
C45 C 0.3317(5) 0.7302(4) 0.6395(3) 0.0431(13) Uani 1 1 d . . . . .
C46 C 0.3091(6) 0.6787(5) 0.6968(3) 0.072(2) Uani 1 1 d . . . . .
H46A H 0.2312 0.6771 0.7011 0.107 Uiso 1 1 calc R U . . .
H46B H 0.3505 0.7080 0.7370 0.107 Uiso 1 1 calc R U . . .
H46C H 0.3309 0.6169 0.6901 0.107 Uiso 1 1 calc R U . . .
C33 C 0.1207(4) 0.2804(3) 0.9345(3) 0.0371(11) Uani 1 1 d . . . . .
H33 H 0.0768 0.3123 0.9617 0.045 Uiso 1 1 calc R U . . .
C34 C 0.2121(4) 0.2417(3) 0.9636(3) 0.0394(12) Uani 1 1 d . . . . .
H34 H 0.2299 0.2469 1.0102 0.047 Uiso 1 1 calc R U . . .
C35 C 0.2765(4) 0.1956(3) 0.9241(3) 0.0425(13) Uani 1 1 d . . . . .
H35 H 0.3397 0.1699 0.9434 0.051 Uiso 1 1 calc R U . . .
C36 C 0.2485(4) 0.1871(3) 0.8559(3) 0.0403(12) Uani 1 1 d . . . . .
H36 H 0.2919 0.1544 0.8288 0.048 Uiso 1 1 calc R U . . .
C37 C 0.1569(4) 0.2263(3) 0.8275(3) 0.0355(11) Uani 1 1 d . . . . .
H37 H 0.1384 0.2207 0.7810 0.043 Uiso 1 1 calc R U . . .
C38 C 0.0924(4) 0.2736(3) 0.8669(3) 0.0354(11) Uani 1 1 d . . . . .
C39 C -0.0083(5) 0.3142(4) 0.8359(3) 0.0508(15) Uani 1 1 d . . . . .
H39A H -0.0720 0.2723 0.8375 0.076 Uiso 1 1 calc R U . . .
H39B H -0.0003 0.3251 0.7898 0.076 Uiso 1 1 calc R U . . .
H39C H -0.0178 0.3714 0.8602 0.076 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 N1 1.362(6) . ?
C1 N2 1.369(6) . ?
C1 Cu1 1.932(4) . ?
C2 C3 1.344(6) . ?
C2 N1 1.401(5) . ?
C3 N2 1.381(6) . ?
C4 C5 1.387(7) . ?
C4 C9 1.411(6) . ?
C4 N1 1.443(6) . ?
C5 C6 1.396(7) . ?
C5 C10 1.522(6) . ?
C6 C7 1.390(7) . ?
C7 C8 1.366(7) . ?
C8 C9 1.398(7) . ?
C9 C13 1.514(7) . ?
C10 C11 1.521(7) . ?
C10 C12 1.523(7) . ?
C13 C15 1.533(7) . ?
C13 C14 1.538(6) . ?
C16 C17 1.389(7) . ?
C16 C21 1.398(7) . ?
C16 N2 1.452(6) . ?
C17 C18 1.401(7) . ?
C17 C25 1.519(7) . ?
C18 C19 1.381(8) . ?
C19 C20 1.375(8) . ?
C20 C21 1.393(7) . ?
C21 C22 1.520(7) . ?
C22 C23 1.521(7) . ?
C22 C24 1.533(7) . ?
C25 C26 1.510(8) . ?
C25 C27 1.514(8) . ?
C28 O1 1.441(5) . ?
C28 C29 1.512(7) . ?
C29 C30 1.516(7) . ?
C29 C31 1.524(7) . ?
C29 C32 1.525(7) . ?
C30 O2 1.451(6) . ?
O1 B1 1.369(7) . ?
O2 B1 1.403(7) . ?
Cu1 B1 2.007(6) . ?
C1A N1A 1.359(6) . ?
C1A N2A 1.370(6) . ?
C1A Cu1A 1.928(5) . ?
C2A C3A 1.348(6) . ?
C2A N1A 1.388(6) . ?
C3A N2A 1.395(6) . ?
C4A C5A 1.388(7) . ?
C4A C9A 1.400(7) . ?
C4A N1A 1.447(6) . ?
C5A C6A 1.403(7) . ?
C5A C10A 1.521(7) . ?
C6A C7A 1.386(7) . ?
C7A C8A 1.375(7) . ?
C8A C9A 1.401(7) . ?
C9A C13A 1.519(7) . ?
C10A C11A 1.513(7) . ?
C10A C12A 1.520(7) . ?
C13A C15A 1.525(7) . ?
C13A C14A 1.527(7) . ?
C16A C17A 1.393(7) . ?
C16A C21A 1.413(7) . ?
C16A N2A 1.452(6) . ?
C17A C18A 1.391(7) . ?
C17A C22A 1.529(6) . ?
C18A C19A 1.387(7) . ?
C19A C20A 1.367(8) . ?
C20A C21A 1.400(7) . ?
C21A C25B 1.518(8) . ?
C21A C25A 1.518(8) . ?
C22A C24A 1.524(7) . ?
C22A C23A 1.530(6) . ?
C25A C27A 1.495(9) . ?
C25A C26A 1.508(9) . ?
C25B C26B 1.502(12) . ?
C25B C27B 1.583(12) . ?
C28A O1A 1.430(6) . ?
C28A C29A 1.512(7) . ?
C29A C31A 1.511(7) . ?
C29A C30A 1.523(6) . ?
C29A C32A 1.526(7) . ?
C30A O2A 1.434(6) . ?
O1A B1A 1.399(6) . ?
O2A B1A 1.386(6) . ?
Cu1A B1A 2.000(5) . ?
C40 C41 1.369(8) . ?
C40 C45 1.383(8) . ?
C41 C42 1.384(9) . ?
C42 C43 1.385(9) . ?
C43 C44 1.367(8) . ?
C44 C45 1.404(7) . ?
C45 C46 1.482(8) . ?
C33 C38 1.383(7) . ?
C33 C34 1.392(7) . ?
C34 C35 1.382(8) . ?
C35 C36 1.395(8) . ?
C36 C37 1.393(7) . ?
C37 C38 1.391(7) . ?
C38 C39 1.511(7) . ?

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
_geom_angle_publ_flag
N1 C1 N2 102.4(4) . . ?
N1 C1 Cu1 127.1(3) . . ?
N2 C1 Cu1 130.4(3) . . ?
C3 C2 N1 106.2(4) . . ?
C2 C3 N2 106.5(4) . . ?
C5 C4 C9 123.9(4) . . ?
C5 C4 N1 117.7(4) . . ?
C9 C4 N1 118.3(4) . . ?
C4 C5 C6 117.3(4) . . ?
C4 C5 C10 121.6(4) . . ?
C6 C5 C10 121.0(4) . . ?
C7 C6 C5 120.6(5) . . ?
C8 C7 C6 120.4(4) . . ?
C7 C8 C9 122.2(4) . . ?
C8 C9 C4 115.7(5) . . ?
C8 C9 C13 122.5(4) . . ?
C4 C9 C13 121.8(4) . . ?
C11 C10 C5 110.0(4) . . ?
C11 C10 C12 110.3(4) . . ?
C5 C10 C12 113.4(4) . . ?
C9 C13 C15 111.5(4) . . ?
C9 C13 C14 113.1(4) . . ?
C15 C13 C14 109.9(4) . . ?
C17 C16 C21 123.4(4) . . ?
C17 C16 N2 118.2(4) . . ?
C21 C16 N2 118.2(4) . . ?
C16 C17 C18 117.0(5) . . ?
C16 C17 C25 122.4(4) . . ?
C18 C17 C25 120.6(5) . . ?
C19 C18 C17 120.9(5) . . ?
C20 C19 C18 120.3(5) . . ?
C19 C20 C21 121.3(5) . . ?
C20 C21 C16 117.0(5) . . ?
C20 C21 C22 120.3(4) . . ?
C16 C21 C22 122.7(4) . . ?
C21 C22 C23 110.6(4) . . ?
C21 C22 C24 112.5(4) . . ?
C23 C22 C24 111.1(5) . . ?
C26 C25 C27 111.7(6) . . ?
C26 C25 C17 111.3(5) . . ?
C27 C25 C17 111.8(5) . . ?
O1 C28 C29 112.8(4) . . ?
C28 C29 C30 106.0(4) . . ?
C28 C29 C31 111.0(4) . . ?
C30 C29 C31 110.6(4) . . ?
C28 C29 C32 109.0(4) . . ?
C30 C29 C32 110.1(4) . . ?
C31 C29 C32 110.1(4) . . ?
O2 C30 C29 111.5(4) . . ?
C1 N1 C2 112.1(4) . . ?
C1 N1 C4 126.5(4) . . ?
C2 N1 C4 121.3(4) . . ?
C1 N2 C3 112.8(4) . . ?
C1 N2 C16 125.7(4) . . ?
C3 N2 C16 121.5(4) . . ?
B1 O1 C28 122.3(4) . . ?
B1 O2 C30 122.0(4) . . ?
C1 Cu1 B1 174.8(2) . . ?
O1 B1 O2 117.4(4) . . ?
O1 B1 Cu1 120.9(4) . . ?
O2 B1 Cu1 121.7(4) . . ?
N1A C1A N2A 102.8(4) . . ?
N1A C1A Cu1A 131.5(3) . . ?
N2A C1A Cu1A 125.6(3) . . ?
C3A C2A N1A 106.9(4) . . ?
C2A C3A N2A 105.9(4) . . ?
C5A C4A C9A 123.3(4) . . ?
C5A C4A N1A 118.0(4) . . ?
C9A C4A N1A 118.6(4) . . ?
C4A C5A C6A 117.2(5) . . ?
C4A C5A C10A 122.5(4) . . ?
C6A C5A C10A 120.2(5) . . ?
C7A C6A C5A 121.1(5) . . ?
C8A C7A C6A 120.0(5) . . ?
C7A C8A C9A 121.5(5) . . ?
C4A C9A C8A 116.9(5) . . ?
C4A C9A C13A 123.3(4) . . ?
C8A C9A C13A 119.8(4) . . ?
C11A C10A C12A 111.6(6) . . ?
C11A C10A C5A 110.7(5) . . ?
C12A C10A C5A 112.2(4) . . ?
C9A C13A C15A 111.9(4) . . ?
C9A C13A C14A 110.7(4) . . ?
C15A C13A C14A 111.6(4) . . ?
C17A C16A C21A 123.0(4) . . ?
C17A C16A N2A 118.7(4) . . ?
C21A C16A N2A 118.4(4) . . ?
C18A C17A C16A 117.7(4) . . ?
C18A C17A C22A 121.2(4) . . ?
C16A C17A C22A 121.0(4) . . ?
C19A C18A C17A 120.7(5) . . ?
C20A C19A C18A 120.6(5) . . ?
C19A C20A C21A 121.7(5) . . ?
C20A C21A C16A 116.4(5) . . ?
C20A C21A C25B 120.9(5) . . ?
C16A C21A C25B 122.7(4) . . ?
C20A C21A C25A 120.9(5) . . ?
C16A C21A C25A 122.7(4) . . ?
C24A C22A C17A 113.4(4) . . ?
C24A C22A C23A 110.6(4) . . ?
C17A C22A C23A 109.5(4) . . ?
C27A C25A C26A 113.8(7) . . ?
C27A C25A C21A 115.4(6) . . ?
C26A C25A C21A 113.8(7) . . ?
C26B C25B C21A 111.9(13) . . ?
C26B C25B C27B 107.2(10) . . ?
C21A C25B C27B 104.8(8) . . ?
O1A C28A C29A 113.5(4) . . ?
C31A C29A C28A 111.9(4) . . ?
C31A C29A C30A 109.9(4) . . ?
C28A C29A C30A 106.1(4) . . ?
C31A C29A C32A 110.0(4) . . ?
C28A C29A C32A 109.5(4) . . ?
C30A C29A C32A 109.3(4) . . ?
O2A C30A C29A 112.2(4) . . ?
C1A N1A C2A 112.2(4) . . ?
C1A N1A C4A 125.4(4) . . ?
C2A N1A C4A 122.3(4) . . ?
C1A N2A C3A 112.2(4) . . ?
C1A N2A C16A 124.7(4) . . ?
C3A N2A C16A 123.1(4) . . ?
B1A O1A C28A 121.7(4) . . ?
B1A O2A C30A 122.0(4) . . ?
C1A Cu1A B1A 174.6(2) . . ?
O2A B1A O1A 117.8(4) . . ?
O2A B1A Cu1A 124.4(4) . . ?
O1A B1A Cu1A 117.8(3) . . ?
C41 C40 C45 122.3(6) . . ?
C40 C41 C42 119.3(6) . . ?
C41 C42 C43 119.7(6) . . ?
C44 C43 C42 120.3(6) . . ?
C43 C44 C45 120.9(6) . . ?
C40 C45 C44 117.3(5) . . ?
C40 C45 C46 122.1(5) . . ?
C44 C45 C46 120.6(5) . . ?
C38 C33 C34 121.6(5) . . ?
C35 C34 C33 119.3(5) . . ?
C34 C35 C36 119.9(5) . . ?
C37 C36 C35 120.1(5) . . ?
C38 C37 C36 120.3(5) . . ?
C33 C38 C37 118.8(5) . . ?
C33 C38 C39 121.2(5) . . ?
C37 C38 C39 120.0(5) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 C2 C3 N2 -0.5(5) . . . . ?
C9 C4 C5 C6 -1.3(7) . . . . ?
N1 C4 C5 C6 174.8(4) . . . . ?
C9 C4 C5 C10 175.4(4) . . . . ?
N1 C4 C5 C10 -8.5(6) . . . . ?
C4 C5 C6 C7 -1.0(7) . . . . ?
C10 C5 C6 C7 -177.7(4) . . . . ?
C5 C6 C7 C8 2.1(7) . . . . ?
C6 C7 C8 C9 -0.9(7) . . . . ?
C7 C8 C9 C4 -1.3(7) . . . . ?
C7 C8 C9 C13 179.2(5) . . . . ?
C5 C4 C9 C8 2.4(7) . . . . ?
N1 C4 C9 C8 -173.7(4) . . . . ?
C5 C4 C9 C13 -178.0(4) . . . . ?
N1 C4 C9 C13 5.9(7) . . . . ?
C4 C5 C10 C11 -93.0(5) . . . . ?
C6 C5 C10 C11 83.6(6) . . . . ?
C4 C5 C10 C12 143.1(5) . . . . ?
C6 C5 C10 C12 -40.4(6) . . . . ?
C8 C9 C13 C15 99.4(5) . . . . ?
C4 C9 C13 C15 -80.1(6) . . . . ?
C8 C9 C13 C14 -25.0(7) . . . . ?
C4 C9 C13 C14 155.5(4) . . . . ?
C21 C16 C17 C18 -1.4(7) . . . . ?
N2 C16 C17 C18 172.5(4) . . . . ?
C21 C16 C17 C25 179.3(5) . . . . ?
N2 C16 C17 C25 -6.8(7) . . . . ?
C16 C17 C18 C19 0.2(7) . . . . ?
C25 C17 C18 C19 179.4(5) . . . . ?
C17 C18 C19 C20 1.1(7) . . . . ?
C18 C19 C20 C21 -1.2(7) . . . . ?
C19 C20 C21 C16 0.0(7) . . . . ?
C19 C20 C21 C22 178.8(4) . . . . ?
C17 C16 C21 C20 1.4(7) . . . . ?
N2 C16 C21 C20 -172.5(4) . . . . ?
C17 C16 C21 C22 -177.4(4) . . . . ?
N2 C16 C21 C22 8.7(6) . . . . ?
C20 C21 C22 C23 -75.4(5) . . . . ?
C16 C21 C22 C23 103.4(5) . . . . ?
C20 C21 C22 C24 49.5(6) . . . . ?
C16 C21 C22 C24 -131.7(5) . . . . ?
C16 C17 C25 C26 -121.6(6) . . . . ?
C18 C17 C25 C26 59.2(7) . . . . ?
C16 C17 C25 C27 112.7(6) . . . . ?
C18 C17 C25 C27 -66.5(7) . . . . ?
O1 C28 C29 C30 -55.1(5) . . . . ?
O1 C28 C29 C31 65.0(6) . . . . ?
O1 C28 C29 C32 -173.6(4) . . . . ?
C28 C29 C30 O2 55.3(6) . . . . ?
C31 C29 C30 O2 -65.1(6) . . . . ?
C32 C29 C30 O2 173.1(4) . . . . ?
N2 C1 N1 C2 0.3(5) . . . . ?
Cu1 C1 N1 C2 -175.3(3) . . . . ?
N2 C1 N1 C4 -176.8(4) . . . . ?
Cu1 C1 N1 C4 7.7(6) . . . . ?
C3 C2 N1 C1 0.2(5) . . . . ?
C3 C2 N1 C4 177.4(4) . . . . ?
C5 C4 N1 C1 103.5(5) . . . . ?
C9 C4 N1 C1 -80.2(6) . . . . ?
C5 C4 N1 C2 -73.3(6) . . . . ?
C9 C4 N1 C2 103.0(5) . . . . ?
N1 C1 N2 C3 -0.6(5) . . . . ?
Cu1 C1 N2 C3 174.7(3) . . . . ?
N1 C1 N2 C16 178.1(4) . . . . ?
Cu1 C1 N2 C16 -6.5(7) . . . . ?
C2 C3 N2 C1 0.7(5) . . . . ?
C2 C3 N2 C16 -178.1(4) . . . . ?
C17 C16 N2 C1 104.2(5) . . . . ?
C21 C16 N2 C1 -81.6(6) . . . . ?
C17 C16 N2 C3 -77.1(5) . . . . ?
C21 C16 N2 C3 97.1(5) . . . . ?
C29 C28 O1 B1 26.0(7) . . . . ?
C29 C30 O2 B1 -27.5(7) . . . . ?
C28 O1 B1 O2 6.0(7) . . . . ?
C28 O1 B1 Cu1 -173.7(4) . . . . ?
C30 O2 B1 O1 -5.1(7) . . . . ?
C30 O2 B1 Cu1 174.7(4) . . . . ?
N1A C2A C3A N2A 0.2(5) . . . . ?
C9A C4A C5A C6A -0.5(7) . . . . ?
N1A C4A C5A C6A 176.4(4) . . . . ?
C9A C4A C5A C10A 177.5(4) . . . . ?
N1A C4A C5A C10A -5.6(7) . . . . ?
C4A C5A C6A C7A -0.1(7) . . . . ?
C10A C5A C6A C7A -178.2(5) . . . . ?
C5A C6A C7A C8A 0.8(7) . . . . ?
C6A C7A C8A C9A -1.0(7) . . . . ?
C5A C4A C9A C8A 0.3(7) . . . . ?
N1A C4A C9A C8A -176.6(4) . . . . ?
C5A C4A C9A C13A -178.7(5) . . . . ?
N1A C4A C9A C13A 4.4(7) . . . . ?
C7A C8A C9A C4A 0.4(7) . . . . ?
C7A C8A C9A C13A 179.5(5) . . . . ?
C4A C5A C10A C11A -110.8(6) . . . . ?
C6A C5A C10A C11A 67.1(7) . . . . ?
C4A C5A C10A C12A 123.8(6) . . . . ?
C6A C5A C10A C12A -58.3(7) . . . . ?
C4A C9A C13A C15A -127.2(5) . . . . ?
C8A C9A C13A C15A 53.8(6) . . . . ?
C4A C9A C13A C14A 107.7(5) . . . . ?
C8A C9A C13A C14A -71.3(6) . . . . ?
C21A C16A C17A C18A 0.4(7) . . . . ?
N2A C16A C17A C18A 179.5(4) . . . . ?
C21A C16A C17A C22A 177.1(5) . . . . ?
N2A C16A C17A C22A -3.8(7) . . . . ?
C16A C17A C18A C19A -1.4(7) . . . . ?
C22A C17A C18A C19A -178.1(5) . . . . ?
C17A C18A C19A C20A 1.1(8) . . . . ?
C18A C19A C20A C21A 0.3(8) . . . . ?
C19A C20A C21A C16A -1.2(8) . . . . ?
C19A C20A C21A C25B 179.1(5) . . . . ?
C19A C20A C21A C25A 179.1(5) . . . . ?
C17A C16A C21A C20A 0.9(7) . . . . ?
N2A C16A C21A C20A -178.3(4) . . . . ?
C17A C16A C21A C25B -179.4(5) . . . . ?
N2A C16A C21A C25B 1.4(7) . . . . ?
C17A C16A C21A C25A -179.4(5) . . . . ?
N2A C16A C21A C25A 1.4(7) . . . . ?
C18A C17A C22A C24A -32.8(7) . . . . ?
C16A C17A C22A C24A 150.6(5) . . . . ?
C18A C17A C22A C23A 91.2(6) . . . . ?
C16A C17A C22A C23A -85.4(5) . . . . ?
C20A C21A C25A C27A 103.6(7) . . . . ?
C16A C21A C25A C27A -76.1(8) . . . . ?
C20A C21A C25A C26A -30.6(9) . . . . ?
C16A C21A C25A C26A 149.8(6) . . . . ?
C20A C21A C25B C26B -55.2(11) . . . . ?
C16A C21A C25B C26B 125.2(10) . . . . ?
C20A C21A C25B C27B 60.7(9) . . . . ?
C16A C21A C25B C27B -119.0(9) . . . . ?
O1A C28A C29A C31A 66.5(6) . . . . ?
O1A C28A C29A C30A -53.3(6) . . . . ?
O1A C28A C29A C32A -171.2(4) . . . . ?
C31A C29A C30A O2A -66.3(5) . . . . ?
C28A C29A C30A O2A 54.8(6) . . . . ?
C32A C29A C30A O2A 172.8(4) . . . . ?
N2A C1A N1A C2A 0.5(5) . . . . ?
Cu1A C1A N1A C2A 177.9(3) . . . . ?
N2A C1A N1A C4A -175.3(4) . . . . ?
Cu1A C1A N1A C4A 2.1(7) . . . . ?
C3A C2A N1A C1A -0.4(5) . . . . ?
C3A C2A N1A C4A 175.5(4) . . . . ?
C5A C4A N1A C1A 102.4(5) . . . . ?
C9A C4A N1A C1A -80.5(6) . . . . ?
C5A C4A N1A C2A -73.0(6) . . . . ?
C9A C4A N1A C2A 104.1(5) . . . . ?
N1A C1A N2A C3A -0.3(5) . . . . ?
Cu1A C1A N2A C3A -177.9(3) . . . . ?
N1A C1A N2A C16A 179.9(4) . . . . ?
Cu1A C1A N2A C16A 2.2(6) . . . . ?
C2A C3A N2A C1A 0.1(5) . . . . ?
C2A C3A N2A C16A 179.9(4) . . . . ?
C17A C16A N2A C1A 107.3(5) . . . . ?
C21A C16A N2A C1A -73.5(6) . . . . ?
C17A C16A N2A C3A -72.5(6) . . . . ?
C21A C16A N2A C3A 106.7(5) . . . . ?
C29A C28A O1A B1A 29.8(7) . . . . ?
C29A C30A O2A B1A -33.5(7) . . . . ?
C30A O2A B1A O1A 6.0(7) . . . . ?
C30A O2A B1A Cu1A -171.7(4) . . . . ?
C28A O1A B1A O2A -3.8(7) . . . . ?
C28A O1A B1A Cu1A 174.0(4) . . . . ?
C45 C40 C41 C42 -1.6(9) . . . . ?
C40 C41 C42 C43 1.1(9) . . . . ?
C41 C42 C43 C44 -0.6(9) . . . . ?
C42 C43 C44 C45 0.5(9) . . . . ?
C41 C40 C45 C44 1.5(9) . . . . ?
C41 C40 C45 C46 -177.3(6) . . . . ?
C43 C44 C45 C40 -0.9(9) . . . . ?
C43 C44 C45 C46 177.9(6) . . . . ?
C38 C33 C34 C35 0.3(8) . . . . ?
C33 C34 C35 C36 -1.1(8) . . . . ?
C34 C35 C36 C37 1.2(8) . . . . ?
C35 C36 C37 C38 -0.5(8) . . . . ?
C34 C33 C38 C37 0.4(8) . . . . ?
C34 C33 C38 C39 178.7(5) . . . . ?
C36 C37 C38 C33 -0.3(7) . . . . ?
C36 C37 C38 C39 -178.6(5) . . . . ?

_refine_diff_density_max         0.667
_refine_diff_density_min         -0.713
_refine_diff_density_rms         0.068

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_wo74wo
_database_code_depnum_ccdc_archive 'CCDC 2008217'
loop_
_audit_author_name
_audit_author_address
'Christian Kleeberg'
;Technische Universitaet Braunschweig, Institut fuer Anorganische und Analytische Chemie
Germany
;
_audit_update_record             
;
2020-06-05 deposited with the CCDC.	2020-07-28 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C32 H46 B Cu N2 O2, C4 H8 O'
_chemical_formula_sum            'C36 H54 B Cu N2 O3'
_chemical_formula_weight         637.16

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu -1.9646 0.5888 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/n'
_space_group_name_Hall           '-P 2yn'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   10.6114(2)
_cell_length_b                   15.0816(4)
_cell_length_c                   22.6645(5)
_cell_angle_alpha                90
_cell_angle_beta                 93.438(2)
_cell_angle_gamma                90
_cell_volume                     3620.63(14)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    17684
_cell_measurement_theta_min      4.5100
_cell_measurement_theta_max      77.2130

_exptl_crystal_description       needle
_exptl_crystal_colour            'clear colourless'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.169
_exptl_crystal_F_000             1368
_exptl_crystal_size_max          0.226
_exptl_crystal_size_mid          0.100
_exptl_crystal_size_min          0.066
_exptl_absorpt_coefficient_mu    1.109
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.74122
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2019)
 Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;


_exptl_crystal_recrystallization_method 
;
 From THF/n-pentane -40°C.
;

_exptl_special_details           
;
 The crystal was mounted at rt with perfluoroether oil on top of a MITEGEN
 mount and placed in a cold nitrogen gas stream on the diffractometer.

 The collected data cover more than a hemisphere of the reciprocal space.
 A combination of 25 sets of ω scans were used; each set at different \j,
 2θ or κ angles and each scan 0.5 deg in ω.
 Each frame was exposured for 3 s (low 2θ angles) or 12 s (high 2θ angles).
 Nominal crystal to detector distance 32 mm.
;


_diffrn_radiation_wavelength     1.54184
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_type           CuK\a
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'PhotonJet (Cu) X-ray Source'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  
'XtaLAB Synergy, Single source at home/near, HyPix'
_diffrn_detector                 'CCD plate'
_diffrn_detector_type            HyPix
_diffrn_measurement_method       ω-scan
_diffrn_reflns_number            48009
_diffrn_reflns_av_unetI/netI     0.0277
_diffrn_reflns_av_R_equivalents  0.0415
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_l_min       -28
_diffrn_reflns_limit_l_max       27
_diffrn_reflns_theta_min         3.522
_diffrn_reflns_theta_max         77.957
_diffrn_reflns_theta_full        67.684
_diffrn_measured_fraction_theta_max 0.984
_diffrn_measured_fraction_theta_full 0.997
_diffrn_reflns_Laue_measured_fraction_max 0.984
_diffrn_reflns_Laue_measured_fraction_full 0.997
_diffrn_reflns_point_group_measured_fraction_max 0.984
_diffrn_reflns_point_group_measured_fraction_full 0.997
_reflns_number_total             7627
_reflns_number_gt                6564
_reflns_threshold_expression     'I > 2σ(I)'


_computing_data_collection       
;
 CrysAlisPro 1.171.40.21a (Rigaku Oxford Diffraction, 2018)
;

_computing_cell_refinement       
;
 CrysAlisPro 1.171.40.21a (Rigaku Oxford Diffraction, 2018)
;
_computing_data_reduction        
;
 CrysAlisPro 1.171.40.21a (Rigaku Oxford Diffraction, 2018)
;

_computing_structure_solution    
;
 SHELXT (Ver. 2018/2) (G. M. Sheldrick, Acta Cryst., 2015, A71, 3--8)
;

_computing_structure_refinement  
;
 SHELXL-2018/3 (G. M. Sheldrick, Acta Cryst., 2015, C71, 3--8)
;

_computing_molecular_graphics    
;
 Diamond, Crystal Impact, H. Putz and K. Brandenburg GbR, Bonn, Germany, 2020.
;

_computing_publication_material  
;
 WinGX v2014.1 (L. J. Farrugia, J. Appl. Cryst., 2012, 45, 849-854.)
;

_refine_special_details          
;
 No appropriate model could be found for one co-crystallised disordered 
 THF molecule, the program SQUEEZE was used
 (A. L. Spek, Acta Cryst. C 2009, 71, 9--18).
 
 Restraints (ISOR) were employed for an isopropyl methyl group,
 no Q-peaks could be found to refine a second group using split atom model.

 All H atoms were placed in idealised positions and refined using a riding
 model, with a common U restrained to be 1.2 (1.5 for methyl groups) times
 the equivalent isotropic displacement parameter of the parent atom. Non 
 disordered methyl groups were treated as a rigid bodies and allowed to
 rotate about the E-CH3 bond but not tip, disordered methyl groups were
 placed in idealised positions.

 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;


_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1035P)²+1.2649P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         7627
_refine_ls_number_parameters     353
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0606
_refine_ls_R_factor_gt           0.0543
_refine_ls_wR_factor_ref         0.1598
_refine_ls_wR_factor_gt          0.1527
_refine_ls_goodness_of_fit_ref   1.051
_refine_ls_restrained_S_all      1.051
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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
C1 C 0.67312(16) 0.53561(13) 0.70303(8) 0.0343(4) Uani 1 1 d . . . . .
C2 C 0.69052(19) 0.38729(14) 0.71943(9) 0.0388(4) Uani 1 1 d . . . . .
H2 H 0.687919 0.325207 0.712375 0.047 Uiso 1 1 calc R U . . .
C3 C 0.72662(19) 0.42790(14) 0.77042(9) 0.0387(4) Uani 1 1 d . . . . .
H3 H 0.754869 0.400335 0.806518 0.046 Uiso 1 1 calc R U . . .
C4 C 0.61870(17) 0.43597(14) 0.61815(8) 0.0353(4) Uani 1 1 d . . . . .
C5 C 0.49411(18) 0.40934(13) 0.60444(9) 0.0368(4) Uani 1 1 d . . . . .
C6 C 0.4607(2) 0.38740(14) 0.54607(9) 0.0410(4) Uani 1 1 d . . . . .
H6 H 0.376369 0.370091 0.535225 0.049 Uiso 1 1 calc R U . . .
C7 C 0.5492(2) 0.39049(15) 0.50338(10) 0.0443(5) Uani 1 1 d . . . . .
H7 H 0.525791 0.373716 0.463828 0.053 Uiso 1 1 calc R U . . .
C8 C 0.6712(2) 0.41790(15) 0.51829(9) 0.0435(5) Uani 1 1 d . . . . .
H8 H 0.730484 0.420246 0.488554 0.052 Uiso 1 1 calc R U . . .
C9 C 0.70924(19) 0.44217(15) 0.57593(9) 0.0402(4) Uani 1 1 d . . . . .
C10 C 0.39715(18) 0.40976(16) 0.65130(10) 0.0437(5) Uani 1 1 d . . . . .
H10 H 0.442599 0.396344 0.690204 0.052 Uiso 1 1 calc R U . . .
C11 C 0.2931(2) 0.34005(17) 0.64072(14) 0.0569(6) Uani 1 1 d . . . . .
H11A H 0.240544 0.355593 0.605181 0.085 Uiso 1 1 calc R U . . .
H11B H 0.240600 0.338270 0.674845 0.085 Uiso 1 1 calc R U . . .
H11C H 0.331498 0.281742 0.635371 0.085 Uiso 1 1 calc R U . . .
C12 C 0.3398(3) 0.50189(19) 0.65544(13) 0.0593(6) Uani 1 1 d . . . . .
H12A H 0.407389 0.545886 0.660994 0.089 Uiso 1 1 calc R U . . .
H12B H 0.285930 0.504121 0.689066 0.089 Uiso 1 1 calc R U . . .
H12C H 0.288999 0.514966 0.618927 0.089 Uiso 1 1 calc R U . . .
C13 C 0.8429(2) 0.47381(18) 0.59124(10) 0.0479(5) Uani 1 1 d . . . . .
H13 H 0.845989 0.497945 0.632403 0.057 Uiso 1 1 calc R U . . .
C14 C 0.9373(2) 0.3971(2) 0.59006(17) 0.0735(9) Uani 1 1 d . . . . .
H14A H 0.918988 0.353769 0.620633 0.110 Uiso 1 1 calc R U . . .
H14B H 1.023194 0.419940 0.597575 0.110 Uiso 1 1 calc R U . . .
H14C H 0.930082 0.368382 0.551200 0.110 Uiso 1 1 calc R U . . .
C15 C 0.8806(2) 0.54789(17) 0.55033(12) 0.0524(5) Uani 1 1 d . . . . .
H15A H 0.879538 0.525642 0.509681 0.079 Uiso 1 1 calc R U . . .
H15B H 0.965665 0.568618 0.562574 0.079 Uiso 1 1 calc R U . . .
H15C H 0.820734 0.597143 0.552377 0.079 Uiso 1 1 calc R U . . .
C16 C 0.75220(17) 0.58429(13) 0.80335(8) 0.0350(4) Uani 1 1 d . . . . .
C17 C 0.6615(2) 0.62149(15) 0.83819(10) 0.0420(4) Uani 1 1 d . . . . .
C18 C 0.7040(3) 0.67793(17) 0.88362(11) 0.0542(6) Uani 1 1 d . . . . .
H18 H 0.644725 0.703233 0.908533 0.065 Uiso 1 1 calc R U . . .
C19 C 0.8300(3) 0.69791(17) 0.89328(11) 0.0556(6) Uani 1 1 d . . . . .
H19 H 0.857037 0.736088 0.924898 0.067 Uiso 1 1 calc R U . . .
C20 C 0.9171(2) 0.66259(17) 0.85713(11) 0.0522(6) Uani 1 1 d . . . . .
H20 H 1.003688 0.677813 0.863713 0.063 Uiso 1 1 calc R U . . .
C21 C 0.88071(19) 0.60492(15) 0.81104(10) 0.0422(4) Uani 1 1 d . . . . .
C22 C 0.5210(2) 0.60443(18) 0.82546(12) 0.0525(5) Uani 1 1 d . . . . .
H22 H 0.510501 0.545407 0.805680 0.063 Uiso 1 1 calc R U . . .
C23 C 0.4468(3) 0.6038(3) 0.88143(15) 0.0757(9) Uani 1 1 d . . . . .
H23A H 0.488123 0.563808 0.910693 0.114 Uiso 1 1 calc R U . . .
H23B H 0.360502 0.583232 0.871596 0.114 Uiso 1 1 calc R U . . .
H23C H 0.444450 0.663861 0.897784 0.114 Uiso 1 1 calc R U . . .
C24 C 0.4653(2) 0.6754(2) 0.78354(12) 0.0597(6) Uani 1 1 d . . . . .
H24A H 0.472460 0.733534 0.802778 0.090 Uiso 1 1 calc R U . . .
H24B H 0.376119 0.662168 0.773554 0.090 Uiso 1 1 calc R U . . .
H24C H 0.511468 0.676083 0.747376 0.090 Uiso 1 1 calc R U . . .
C25 C 0.9767(2) 0.5691(2) 0.77041(12) 0.0561(6) Uani 1 1 d . . . . .
H25 H 0.935690 0.519348 0.747295 0.067 Uiso 1 1 calc R U . . .
C26 C 1.0913(4) 0.5321(5) 0.80375(19) 0.146(3) Uani 1 1 d . . . . .
H26A H 1.136817 0.580036 0.824974 0.219 Uiso 1 1 calc R U . . .
H26B H 1.146587 0.504387 0.775945 0.219 Uiso 1 1 calc R U . . .
H26C H 1.065229 0.487606 0.832101 0.219 Uiso 1 1 calc R U . . .
C27 C 1.0111(4) 0.6393(3) 0.72684(16) 0.0866(11) Uani 1 1 d . . . . .
H27A H 1.051922 0.689157 0.748122 0.130 Uiso 1 1 calc R U . . .
H27B H 0.934461 0.660187 0.704817 0.130 Uiso 1 1 calc R U . . .
H27C H 1.069184 0.614266 0.699240 0.130 Uiso 1 1 calc R U . . .
C28 C 0.6959(2) 0.80784(16) 0.50483(10) 0.0492(5) Uani 1 1 d . . . . .
H28A H 0.616417 0.803834 0.479773 0.059 Uiso 1 1 calc R U . . .
H28B H 0.767018 0.799160 0.479077 0.059 Uiso 1 1 calc R U . . .
C29 C 0.7057(2) 0.89883(15) 0.53242(10) 0.0453(5) Uani 1 1 d . . . . .
C30 C 0.6038(2) 0.90421(17) 0.57702(10) 0.0502(5) Uani 1 1 d . . . . .
H30A H 0.610768 0.961880 0.597827 0.060 Uiso 1 1 calc R U . . .
H30B H 0.519776 0.901668 0.555637 0.060 Uiso 1 1 calc R U . . .
C31 C 0.6813(3) 0.97010(18) 0.48525(12) 0.0648(7) Uani 1 1 d . . . . .
H31A H 0.749617 0.969410 0.457985 0.097 Uiso 1 1 calc R U . . .
H31B H 0.678035 1.028383 0.504210 0.097 Uiso 1 1 calc R U . . .
H31C H 0.600743 0.958248 0.463274 0.097 Uiso 1 1 calc R U . . .
C32 C 0.8351(3) 0.9128(2) 0.56426(13) 0.0626(7) Uani 1 1 d . . . . .
H32A H 0.850480 0.866242 0.593947 0.094 Uiso 1 1 calc R U . . .
H32B H 0.837328 0.970906 0.583712 0.094 Uiso 1 1 calc R U . . .
H32C H 0.900477 0.910400 0.535549 0.094 Uiso 1 1 calc R U . . .
B1 B 0.6567(2) 0.75082(16) 0.60500(10) 0.0382(4) Uani 1 1 d . . . . .
N1 N 0.65790(14) 0.45357(11) 0.67923(7) 0.0341(3) Uani 1 1 d . . . . .
N2 N 0.71432(15) 0.51844(11) 0.75977(7) 0.0351(3) Uani 1 1 d . . . . .
O1 O 0.69806(16) 0.73901(11) 0.54824(7) 0.0483(4) Uani 1 1 d . . . . .
O2 O 0.61338(14) 0.83421(10) 0.61959(6) 0.0425(3) Uani 1 1 d . . . . .
Cu1 Cu 0.66082(3) 0.64593(2) 0.65917(2) 0.03677(12) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 N1 1.356(3) . ?
C1 N2 1.358(2) . ?
C1 Cu1 1.9386(19) . ?
C2 C3 1.343(3) . ?
C2 N1 1.383(3) . ?
C3 N2 1.391(3) . ?
C4 C5 1.399(3) . ?
C4 C9 1.399(3) . ?
C4 N1 1.446(2) . ?
C5 C6 1.389(3) . ?
C5 C10 1.522(3) . ?
C6 C7 1.389(3) . ?
C7 C8 1.381(3) . ?
C8 C9 1.393(3) . ?
C9 C13 1.517(3) . ?
C10 C12 1.522(4) . ?
C10 C11 1.533(3) . ?
C13 C15 1.521(3) . ?
C13 C14 1.532(4) . ?
C16 C17 1.399(3) . ?
C16 C21 1.399(3) . ?
C16 N2 1.441(3) . ?
C17 C18 1.390(3) . ?
C17 C22 1.523(3) . ?
C18 C19 1.375(4) . ?
C19 C20 1.379(4) . ?
C20 C21 1.396(3) . ?
C21 C25 1.513(3) . ?
C22 C24 1.527(4) . ?
C22 C23 1.532(4) . ?
C25 C26 1.500(4) . ?
C25 C27 1.508(4) . ?
C28 O1 1.429(3) . ?
C28 C29 1.509(3) . ?
C29 C30 1.526(3) . ?
C29 C32 1.527(4) . ?
C29 C31 1.527(3) . ?
C30 O2 1.430(3) . ?
B1 O2 1.386(3) . ?
B1 O1 1.395(3) . ?
B1 Cu1 2.001(2) . ?

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
_geom_angle_publ_flag
N1 C1 N2 103.10(16) . . ?
N1 C1 Cu1 125.21(14) . . ?
N2 C1 Cu1 131.09(15) . . ?
C3 C2 N1 106.53(18) . . ?
C2 C3 N2 106.21(18) . . ?
C5 C4 C9 123.09(18) . . ?
C5 C4 N1 118.64(16) . . ?
C9 C4 N1 118.20(17) . . ?
C6 C5 C4 117.65(18) . . ?
C6 C5 C10 121.38(18) . . ?
C4 C5 C10 120.87(18) . . ?
C5 C6 C7 120.70(19) . . ?
C8 C7 C6 120.2(2) . . ?
C7 C8 C9 121.53(19) . . ?
C8 C9 C4 116.83(19) . . ?
C8 C9 C13 120.79(18) . . ?
C4 C9 C13 122.37(18) . . ?
C12 C10 C5 109.66(18) . . ?
C12 C10 C11 110.39(19) . . ?
C5 C10 C11 113.5(2) . . ?
C9 C13 C15 111.60(19) . . ?
C9 C13 C14 111.2(2) . . ?
C15 C13 C14 110.38(19) . . ?
C17 C16 C21 122.62(19) . . ?
C17 C16 N2 119.36(17) . . ?
C21 C16 N2 117.93(17) . . ?
C18 C17 C16 117.4(2) . . ?
C18 C17 C22 120.9(2) . . ?
C16 C17 C22 121.6(2) . . ?
C19 C18 C17 121.4(2) . . ?
C18 C19 C20 120.1(2) . . ?
C19 C20 C21 121.4(2) . . ?
C20 C21 C16 117.1(2) . . ?
C20 C21 C25 120.8(2) . . ?
C16 C21 C25 122.1(2) . . ?
C17 C22 C24 109.7(2) . . ?
C17 C22 C23 112.9(2) . . ?
C24 C22 C23 108.7(2) . . ?
C26 C25 C27 111.8(3) . . ?
C26 C25 C21 112.4(2) . . ?
C27 C25 C21 110.2(3) . . ?
O1 C28 C29 112.17(18) . . ?
C28 C29 C30 106.8(2) . . ?
C28 C29 C32 111.1(2) . . ?
C30 C29 C32 109.4(2) . . ?
C28 C29 C31 110.2(2) . . ?
C30 C29 C31 109.2(2) . . ?
C32 C29 C31 110.1(2) . . ?
O2 C30 C29 112.55(18) . . ?
O2 B1 O1 117.58(19) . . ?
O2 B1 Cu1 124.49(16) . . ?
O1 B1 Cu1 117.92(16) . . ?
C1 N1 C2 112.24(16) . . ?
C1 N1 C4 124.69(16) . . ?
C2 N1 C4 122.99(17) . . ?
C1 N2 C3 111.90(17) . . ?
C1 N2 C16 125.33(17) . . ?
C3 N2 C16 122.56(16) . . ?
B1 O1 C28 123.29(18) . . ?
B1 O2 C30 121.35(17) . . ?
C1 Cu1 B1 172.45(9) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 C2 C3 N2 0.2(2) . . . . ?
C9 C4 C5 C6 0.7(3) . . . . ?
N1 C4 C5 C6 -176.03(18) . . . . ?
C9 C4 C5 C10 -175.8(2) . . . . ?
N1 C4 C5 C10 7.5(3) . . . . ?
C4 C5 C6 C7 1.1(3) . . . . ?
C10 C5 C6 C7 177.6(2) . . . . ?
C5 C6 C7 C8 -1.8(3) . . . . ?
C6 C7 C8 C9 0.6(3) . . . . ?
C7 C8 C9 C4 1.1(3) . . . . ?
C7 C8 C9 C13 -178.8(2) . . . . ?
C5 C4 C9 C8 -1.8(3) . . . . ?
N1 C4 C9 C8 174.96(19) . . . . ?
C5 C4 C9 C13 178.1(2) . . . . ?
N1 C4 C9 C13 -5.2(3) . . . . ?
C6 C5 C10 C12 -91.5(3) . . . . ?
C4 C5 C10 C12 84.9(2) . . . . ?
C6 C5 C10 C11 32.5(3) . . . . ?
C4 C5 C10 C11 -151.1(2) . . . . ?
C8 C9 C13 C15 51.7(3) . . . . ?
C4 C9 C13 C15 -128.2(2) . . . . ?
C8 C9 C13 C14 -72.0(3) . . . . ?
C4 C9 C13 C14 108.1(3) . . . . ?
C21 C16 C17 C18 -2.9(3) . . . . ?
N2 C16 C17 C18 173.6(2) . . . . ?
C21 C16 C17 C22 174.4(2) . . . . ?
N2 C16 C17 C22 -9.0(3) . . . . ?
C16 C17 C18 C19 1.3(4) . . . . ?
C22 C17 C18 C19 -176.1(2) . . . . ?
C17 C18 C19 C20 0.8(4) . . . . ?
C18 C19 C20 C21 -1.3(4) . . . . ?
C19 C20 C21 C16 -0.3(3) . . . . ?
C19 C20 C21 C25 177.9(2) . . . . ?
C17 C16 C21 C20 2.4(3) . . . . ?
N2 C16 C21 C20 -174.16(19) . . . . ?
C17 C16 C21 C25 -175.7(2) . . . . ?
N2 C16 C21 C25 7.7(3) . . . . ?
C18 C17 C22 C24 86.8(3) . . . . ?
C16 C17 C22 C24 -90.5(3) . . . . ?
C18 C17 C22 C23 -34.7(3) . . . . ?
C16 C17 C22 C23 148.1(2) . . . . ?
C20 C21 C25 C26 49.2(4) . . . . ?
C16 C21 C25 C26 -132.7(4) . . . . ?
C20 C21 C25 C27 -76.3(3) . . . . ?
C16 C21 C25 C27 101.8(3) . . . . ?
O1 C28 C29 C30 -52.2(3) . . . . ?
O1 C28 C29 C32 67.0(3) . . . . ?
O1 C28 C29 C31 -170.7(2) . . . . ?
C28 C29 C30 O2 55.4(3) . . . . ?
C32 C29 C30 O2 -64.9(3) . . . . ?
C31 C29 C30 O2 174.6(2) . . . . ?
N2 C1 N1 C2 -0.99(19) . . . . ?
Cu1 C1 N1 C2 170.91(13) . . . . ?
N2 C1 N1 C4 -177.88(16) . . . . ?
Cu1 C1 N1 C4 -6.0(2) . . . . ?
C3 C2 N1 C1 0.5(2) . . . . ?
C3 C2 N1 C4 177.43(16) . . . . ?
C5 C4 N1 C1 -103.3(2) . . . . ?
C9 C4 N1 C1 79.8(2) . . . . ?
C5 C4 N1 C2 80.1(2) . . . . ?
C9 C4 N1 C2 -96.7(2) . . . . ?
N1 C1 N2 C3 1.2(2) . . . . ?
Cu1 C1 N2 C3 -170.07(14) . . . . ?
N1 C1 N2 C16 175.97(16) . . . . ?
Cu1 C1 N2 C16 4.7(3) . . . . ?
C2 C3 N2 C1 -0.9(2) . . . . ?
C2 C3 N2 C16 -175.89(16) . . . . ?
C17 C16 N2 C1 88.5(2) . . . . ?
C21 C16 N2 C1 -94.8(2) . . . . ?
C17 C16 N2 C3 -97.2(2) . . . . ?
C21 C16 N2 C3 79.5(2) . . . . ?
O2 B1 O1 C28 -0.9(3) . . . . ?
Cu1 B1 O1 C28 177.87(17) . . . . ?
C29 C28 O1 B1 27.3(3) . . . . ?
O1 B1 O2 C30 3.8(3) . . . . ?
Cu1 B1 O2 C30 -174.92(17) . . . . ?
C29 C30 O2 B1 -32.6(3) . . . . ?

_refine_diff_density_max         0.815
_refine_diff_density_min         -0.316
_refine_diff_density_rms         0.075



####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_wo18ck
_database_code_depnum_ccdc_archive 'CCDC 2008215'
loop_
_audit_author_name
_audit_author_address
'Christian Kleeberg'
;Technische Universitaet Braunschweig, Institut fuer Anorganische und Analytische Chemie
Germany
;
_audit_update_record             
;
2020-06-05 deposited with the CCDC.	2020-07-28 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C162 H216 Cu55 N12'
_chemical_formula_sum            'C162 H216 Cu55 N12'
_chemical_formula_weight         5826.16

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
Cu Cu -1.9646 0.5888 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      triclinic
_space_group_IT_number           2
_space_group_name_H-M_alt        'P -1'
_space_group_name_Hall           '-P 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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, -y, -z'

_cell_length_a                   18.5018(11)
_cell_length_b                   18.5259(12)
_cell_length_c                   19.1587(12)
_cell_angle_alpha                72.233(6)
_cell_angle_beta                 61.343(6)
_cell_angle_gamma                82.045(6)
_cell_volume                     5487.4(7)
_cell_formula_units_Z            1
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    15150
_cell_measurement_theta_min      2.73
_cell_measurement_theta_max      75.62

_exptl_crystal_description       prism
_exptl_crystal_colour            'dark black'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.763
_exptl_crystal_F_000             2867
_exptl_crystal_size_max          0.08
_exptl_crystal_size_mid          0.04
_exptl_crystal_size_min          0.03
_exptl_absorpt_coefficient_mu    5.788
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.70836
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_process_details   
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2019)
 Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
 
 Empirical correction (ABSPACK) includes:
     - Absorption correction using spherical harmonics
     - Frame scaling
;


_exptl_special_details           
;
 The crystal was mounted at rt with perfluoroether oil on top of a HAMPTON
 mount and placed in a cold nitrogen gas stream on the diffractometer.

 The collected data cover more than a hemisphere of the reciprocal space.
 A combination of 32 sets of ω scans were used; each set at different \j,
 2θ or κ angles and each scan 0.5 deg in ω.
 Each frame was exposured for 20 s (low 2θ angles) or 80 s (high 2θ angles).
 Nominal crystal to detector distance 32 mm.
;



_diffrn_radiation_wavelength     1.54184
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_type           CuK\a
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'PhotonJet (Cu) X-ray Source'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  
'XtaLAB Synergy, Single source at home/near, HyPix'
_diffrn_detector                 'CCD plate'
_diffrn_detector_type            HyPix
_diffrn_measurement_method       ω-scan
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            62742
_diffrn_reflns_av_unetI/netI     0.0535
_diffrn_reflns_av_R_equivalents  0.0532
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_k_min       -22
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_limit_l_max       22
_diffrn_reflns_theta_min         2.505
_diffrn_reflns_theta_max         66.998
_diffrn_reflns_theta_full        66.998
_diffrn_measured_fraction_theta_max 0.981
_diffrn_measured_fraction_theta_full 0.981
_diffrn_reflns_Laue_measured_fraction_max 0.981
_diffrn_reflns_Laue_measured_fraction_full 0.981
_diffrn_reflns_point_group_measured_fraction_max 0.981
_diffrn_reflns_point_group_measured_fraction_full 0.981
_reflns_number_total             19165
_reflns_number_gt                13158
_reflns_threshold_expression     'I > 2σ(I)'




_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
;


_computing_data_collection       
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2018)
;
_computing_cell_refinement       
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2018)
;
_computing_data_reduction        
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2018)
;
_computing_structure_solution    
;
 SHELXT (Ver. 2018/2) (G. M. Sheldrick, Acta Cryst., 2015, A71, 3--8)
;
_computing_structure_refinement  
;
 SHELXL-2018/3 (G. M. Sheldrick, Acta Cryst., 2015, A71, 3--8)
;
_computing_molecular_graphics    
;
 K. Brandenburg, 2017, Diamond 4.4.1, Crystal Impact GbR, Bonn, Germany.
;
_computing_publication_material  
;
 Olex2 (Dolomanov et al., J. Appl. Cryst., 2009, 42, 339-341)
;



_refine_special_details          
;
 A solvent mask was calculated and 336 electrons were
 found in a volume of 1580Å^3 in 1 void per unit cell.
 This is consistent with the presence of
 7[C7H8] per Unit Cell which account for 350 electrons per unit cell.

 All H atoms were placed in idealised positions and refined using a riding
 model, with a common U restrained to be 1.2 (1.5 for methyl groups) times
 the equivalent isotropic displacement parameter of the parent atom.


 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;





_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.1156P)²+7.3920P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         19165
_refine_ls_number_parameters     1033
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0847
_refine_ls_R_factor_gt           0.0619
_refine_ls_wR_factor_ref         0.2022
_refine_ls_wR_factor_gt          0.1796
_refine_ls_goodness_of_fit_ref   1.061
_refine_ls_restrained_S_all      1.061
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000

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
Cu1 Cu 0.51045(8) 0.73986(7) 0.54697(8) 0.0521(3) Uani 1 1 d . . . . .
Cu2 Cu 0.61499(7) 0.70806(6) 0.41217(7) 0.0437(3) Uani 1 1 d . . . . .
Cu3 Cu 0.62366(7) 0.64515(6) 0.55598(7) 0.0427(3) Uani 1 1 d . . . . .
Cu4 Cu 0.46843(7) 0.61613(6) 0.66812(7) 0.0427(3) Uani 1 1 d . . . . .
Cu5 Cu 0.37471(7) 0.67628(6) 0.60157(7) 0.0419(3) Uani 1 1 d . . . . .
Cu6 Cu 0.46207(7) 0.73217(6) 0.44768(7) 0.0424(3) Uani 1 1 d . . . . .
Cu7 Cu 0.50860(6) 0.61985(5) 0.52566(6) 0.0342(2) Uani 1 1 d . . . . .
Cu8 Cu 0.71588(8) 0.67638(7) 0.27985(8) 0.0552(3) Uani 1 1 d . . . . .
Cu9 Cu 0.72075(7) 0.60748(6) 0.41276(7) 0.0430(3) Uani 1 1 d . . . . .
Cu10 Cu 0.72537(8) 0.53463(7) 0.54882(8) 0.0517(3) Uani 1 1 d . . . . .
Cu11 Cu 0.57568(7) 0.51330(6) 0.66861(7) 0.0420(3) Uani 1 1 d . . . . .
Cu12 Cu 0.42888(8) 0.49301(7) 0.78006(7) 0.0506(3) Uani 1 1 d . . . . .
Cu13 Cu 0.33084(7) 0.55164(6) 0.71815(6) 0.0414(3) Uani 1 1 d . . . . .
Cu14 Cu 0.23797(7) 0.60883(7) 0.65337(7) 0.0493(3) Uani 1 1 d . . . . .
Cu15 Cu 0.31477(7) 0.67580(6) 0.49984(7) 0.0404(3) Uani 1 1 d . . . . .
Cu16 Cu 0.41435(8) 0.72196(7) 0.34501(8) 0.0514(3) Uani 1 1 d . . . . .
Cu17 Cu 0.56345(7) 0.70163(6) 0.31130(7) 0.0425(3) Uani 1 1 d . . . . .
Cu18 Cu 0.60895(6) 0.58826(5) 0.38549(6) 0.0340(2) Uani 1 1 d . . . . .
Cu19 Cu 0.61221(6) 0.52142(6) 0.52585(6) 0.0338(2) Uani 1 1 d . . . . .
Cu20 Cu 0.46137(6) 0.49375(6) 0.64333(6) 0.0334(2) Uani 1 1 d . . . . .
Cu21 Cu 0.36809(6) 0.55779(6) 0.57419(6) 0.0332(2) Uani 1 1 d . . . . .
Cu22 Cu 0.45352(6) 0.61243(5) 0.42496(6) 0.0330(2) Uani 1 1 d . . . . .
Cu23 Cu 0.500000 0.500000 0.500000 0.0275(3) Uani 1 2 d S . P . .
Cu24 Cu 0.65208(7) 0.59799(6) 0.23423(6) 0.0408(3) Uani 1 1 d . . . . .
Cu25 Cu 0.74102(7) 0.53176(7) 0.31251(7) 0.0431(3) Uani 1 1 d . . . . .
Cu26 Cu 0.74461(6) 0.46334(6) 0.44899(7) 0.0408(3) Uani 1 1 d . . . . .
Cu27 Cu 0.65705(7) 0.40758(6) 0.60251(7) 0.0431(3) Uani 1 1 d . . . . .
Cu28 Cu 0.50751(7) 0.38295(6) 0.71950(6) 0.0419(3) Uani 1 1 d . . . . .
N1 N 0.7397(4) 0.6884(4) 0.6084(4) 0.0424(14) Uani 1 1 d . . . . .
N2 N 0.6514(4) 0.7748(3) 0.6073(4) 0.0422(14) Uani 1 1 d . . . . .
C1 C 0.6735(5) 0.7052(4) 0.5915(4) 0.0362(15) Uani 1 1 d . . . . .
C2 C 0.6990(6) 0.7980(5) 0.6339(6) 0.055(2) Uani 1 1 d . . . . .
H2 H 0.694317 0.843603 0.648566 0.066 Uiso 1 1 calc R U . . .
C3 C 0.7536(7) 0.7424(5) 0.6347(6) 0.059(2) Uani 1 1 d . . . . .
H3 H 0.794967 0.741186 0.650919 0.071 Uiso 1 1 calc R U . . .
C4 C 0.5838(5) 0.8179(4) 0.5998(5) 0.0433(17) Uani 1 1 d . . . . .
C5 C 0.5931(5) 0.8589(5) 0.5216(5) 0.0502(19) Uani 1 1 d . . . . .
C6 C 0.5255(6) 0.8999(6) 0.5191(6) 0.065(3) Uani 1 1 d . . . . .
H6 H 0.528645 0.925525 0.466564 0.078 Uiso 1 1 calc R U . . .
C7 C 0.4551(7) 0.9055(6) 0.5877(6) 0.068(3) Uani 1 1 d . . . . .
H7 H 0.410513 0.934646 0.582624 0.081 Uiso 1 1 calc R U . . .
C8 C 0.4486(6) 0.8680(5) 0.6657(6) 0.060(2) Uani 1 1 d . . . . .
H8 H 0.400442 0.873673 0.713955 0.072 Uiso 1 1 calc R U . . .
C9 C 0.5111(6) 0.8230(5) 0.6730(5) 0.051(2) Uani 1 1 d . . . . .
C10 C 0.6746(5) 0.8611(5) 0.4436(5) 0.052(2) Uani 1 1 d . . . . .
H10 H 0.697738 0.808761 0.448097 0.063 Uiso 1 1 calc R U . . .
C11 C 0.6685(8) 0.8880(6) 0.3636(6) 0.073(3) Uani 1 1 d . . . . .
H11A H 0.723236 0.887726 0.316826 0.109 Uiso 1 1 calc R U . . .
H11B H 0.631497 0.854110 0.364635 0.109 Uiso 1 1 calc R U . . .
H11C H 0.646644 0.939609 0.357556 0.109 Uiso 1 1 calc R U . . .
C12 C 0.7358(7) 0.9133(6) 0.4373(7) 0.073(3) Uani 1 1 d . . . . .
H12A H 0.741161 0.897350 0.488338 0.109 Uiso 1 1 calc R U . . .
H12B H 0.789598 0.910621 0.390207 0.109 Uiso 1 1 calc R U . . .
H12C H 0.715894 0.965581 0.429452 0.109 Uiso 1 1 calc R U . . .
C13 C 0.5023(7) 0.7797(6) 0.7583(6) 0.069(3) Uani 1 1 d . . . . .
H13 H 0.551243 0.746451 0.752032 0.083 Uiso 1 1 calc R U . . .
C14 C 0.4236(10) 0.7309(7) 0.8098(7) 0.096(5) Uani 1 1 d . . . . .
H14A H 0.425552 0.694176 0.781381 0.144 Uiso 1 1 calc R U . . .
H14B H 0.419547 0.703753 0.864239 0.144 Uiso 1 1 calc R U . . .
H14C H 0.375550 0.763428 0.816721 0.144 Uiso 1 1 calc R U . . .
C15 C 0.4979(10) 0.8356(10) 0.8033(8) 0.112(6) Uani 1 1 d . . . . .
H15A H 0.492246 0.808125 0.858237 0.168 Uiso 1 1 calc R U . . .
H15B H 0.548379 0.866528 0.771754 0.168 Uiso 1 1 calc R U . . .
H15C H 0.450254 0.868551 0.809089 0.168 Uiso 1 1 calc R U . . .
C16 C 0.7884(4) 0.6208(4) 0.6022(5) 0.0390(16) Uani 1 1 d . . . . .
C17 C 0.7773(5) 0.5672(5) 0.6751(5) 0.0458(18) Uani 1 1 d . . . . .
C18 C 0.8278(5) 0.5046(5) 0.6694(6) 0.054(2) Uani 1 1 d . . . . .
H18 H 0.823819 0.467668 0.718050 0.064 Uiso 1 1 calc R U . . .
C19 C 0.8844(6) 0.4960(6) 0.5918(7) 0.061(2) Uani 1 1 d . . . . .
H19 H 0.917670 0.452013 0.587911 0.073 Uiso 1 1 calc R U . . .
C20 C 0.8927(6) 0.5494(6) 0.5218(6) 0.063(2) Uani 1 1 d . . . . .
H20 H 0.931138 0.541399 0.469795 0.076 Uiso 1 1 calc R U . . .
C21 C 0.8467(5) 0.6153(5) 0.5237(5) 0.0456(18) Uani 1 1 d . . . . .
C22 C 0.7139(6) 0.5721(6) 0.7604(5) 0.062(3) Uani 1 1 d . . . . .
H22 H 0.679539 0.617808 0.753625 0.075 Uiso 1 1 calc R U . . .
C23 C 0.6560(7) 0.5026(7) 0.8097(6) 0.077(3) Uani 1 1 d . . . . .
H23A H 0.616083 0.508450 0.864397 0.115 Uiso 1 1 calc R U . . .
H23B H 0.626657 0.498236 0.780010 0.115 Uiso 1 1 calc R U . . .
H23C H 0.688339 0.456742 0.816101 0.115 Uiso 1 1 calc R U . . .
C24 C 0.7528(8) 0.5815(7) 0.8118(6) 0.081(4) Uani 1 1 d . . . . .
H24A H 0.709268 0.584442 0.866424 0.121 Uiso 1 1 calc R U . . .
H24B H 0.787929 0.537934 0.818311 0.121 Uiso 1 1 calc R U . . .
H24C H 0.786093 0.628104 0.783724 0.121 Uiso 1 1 calc R U . . .
C25 C 0.8640(6) 0.6790(6) 0.4465(5) 0.058(2) Uani 1 1 d . . . . .
H25 H 0.809876 0.699420 0.449749 0.070 Uiso 1 1 calc R U . . .
C26 C 0.9118(7) 0.6561(7) 0.3668(6) 0.075(3) Uani 1 1 d . . . . .
H26A H 0.920453 0.700479 0.319734 0.113 Uiso 1 1 calc R U . . .
H26B H 0.965263 0.635674 0.362047 0.113 Uiso 1 1 calc R U . . .
H26C H 0.880690 0.617257 0.366945 0.113 Uiso 1 1 calc R U . . .
C27 C 0.9124(8) 0.7444(7) 0.4400(7) 0.085(4) Uani 1 1 d . . . . .
H27A H 0.922645 0.784798 0.389223 0.128 Uiso 1 1 calc R U . . .
H27B H 0.880200 0.764466 0.487995 0.128 Uiso 1 1 calc R U . . .
H27C H 0.965083 0.725457 0.438660 0.128 Uiso 1 1 calc R U . . .
N1A N 0.2336(4) 0.8127(4) 0.4359(4) 0.0478(16) Uani 1 1 d . . . . .
N2A N 0.1594(4) 0.7642(4) 0.5668(4) 0.0445(15) Uani 1 1 d . . . . .
C1A C 0.2311(5) 0.7523(5) 0.5021(5) 0.0465(18) Uani 1 1 d . . . . .
C2A C 0.1640(7) 0.8549(6) 0.4612(6) 0.075(3) Uani 1 1 d . . . . .
H2A H 0.151276 0.897950 0.426813 0.090 Uiso 1 1 calc R U . . .
C3A C 0.1175(6) 0.8261(6) 0.5408(7) 0.069(3) Uani 1 1 d . . . . .
H3A H 0.065341 0.844156 0.574237 0.082 Uiso 1 1 calc R U . . .
C4A C 0.2962(5) 0.8281(5) 0.3519(5) 0.050(2) Uani 1 1 d . . . . .
C5A C 0.2907(6) 0.7981(6) 0.2963(5) 0.055(2) Uani 1 1 d . . . . .
C6A C 0.3487(9) 0.8184(6) 0.2157(7) 0.080(3) Uani 1 1 d . . . . .
H6A H 0.349175 0.794920 0.177761 0.096 Uiso 1 1 calc R U . . .
C7A C 0.4063(8) 0.8724(7) 0.1892(7) 0.082(3) Uani 1 1 d . . . . .
H7A H 0.444759 0.888085 0.132177 0.098 Uiso 1 1 calc R U . . .
C8A C 0.4099(7) 0.9045(7) 0.2433(8) 0.084(4) Uani 1 1 d . . . . .
H8A H 0.450836 0.941927 0.222836 0.101 Uiso 1 1 calc R U . . .
C9A C 0.3563(6) 0.8842(6) 0.3252(5) 0.058(2) Uani 1 1 d . . . . .
C10A C 0.2266(9) 0.7338(9) 0.3274(8) 0.091(4) Uani 1 1 d . . . . .
H10A H 0.211917 0.705665 0.386127 0.109 Uiso 1 1 calc R U . . .
C11A C 0.2510(13) 0.6812(7) 0.2793(10) 0.136(8) Uani 1 1 d . . . . .
H11D H 0.298315 0.652320 0.282755 0.203 Uiso 1 1 calc R U . . .
H11E H 0.205199 0.646446 0.300601 0.203 Uiso 1 1 calc R U . . .
H11F H 0.266461 0.708783 0.221529 0.203 Uiso 1 1 calc R U . . .
C12A C 0.1515(12) 0.7813(14) 0.3240(16) 0.164(9) Uani 1 1 d . . . . .
H12D H 0.136223 0.816771 0.357650 0.246 Uiso 1 1 calc R U . . .
H12E H 0.166105 0.809629 0.266611 0.246 Uiso 1 1 calc R U . . .
H12F H 0.104843 0.747292 0.345683 0.246 Uiso 1 1 calc R U . . .
C13A C 0.3577(9) 0.9198(6) 0.3858(8) 0.082(4) Uani 1 1 d . . . . .
H13A H 0.327822 0.884808 0.442545 0.099 Uiso 1 1 calc R U . . .
C14A C 0.4417(11) 0.9298(7) 0.3703(11) 0.108(5) Uani 1 1 d . . . . .
H14D H 0.440033 0.952948 0.410673 0.162 Uiso 1 1 calc R U . . .
H14E H 0.468478 0.880328 0.375411 0.162 Uiso 1 1 calc R U . . .
H14F H 0.472915 0.962758 0.314293 0.162 Uiso 1 1 calc R U . . .
C15A C 0.3096(11) 0.9963(8) 0.3834(11) 0.110(5) Uani 1 1 d . . . . .
H15D H 0.253884 0.987075 0.394048 0.165 Uiso 1 1 calc R U . . .
H15E H 0.306453 1.017478 0.425790 0.165 Uiso 1 1 calc R U . . .
H15F H 0.338526 1.032181 0.328737 0.165 Uiso 1 1 calc R U . . .
C16A C 0.1237(5) 0.7189(5) 0.6508(5) 0.0422(17) Uani 1 1 d . . . . .
C17A C 0.1389(4) 0.7421(5) 0.7071(5) 0.0477(19) Uani 1 1 d . . . . .
C18A C 0.0954(6) 0.7049(6) 0.7899(6) 0.061(2) Uani 1 1 d . . . . .
H18A H 0.103976 0.718783 0.829158 0.073 Uiso 1 1 calc R U . . .
C19A C 0.0394(6) 0.6479(6) 0.8168(6) 0.060(2) Uani 1 1 d . . . . .
H19A H 0.010234 0.623167 0.874246 0.072 Uiso 1 1 calc R U . . .
C20A C 0.0253(6) 0.6266(5) 0.7617(5) 0.055(2) Uani 1 1 d . . . . .
H20A H -0.013317 0.587385 0.780868 0.067 Uiso 1 1 calc R U . . .
C21A C 0.0682(5) 0.6628(5) 0.6771(5) 0.0458(18) Uani 1 1 d . . . . .
C22A C 0.1993(7) 0.8049(6) 0.6755(7) 0.081(4) Uani 1 1 d . . . . .
H22A H 0.237995 0.809279 0.615837 0.097 Uiso 1 1 calc R U . . .
C23A C 0.2506(8) 0.7876(10) 0.7236(9) 0.115(6) Uani 1 1 d . . . . .
H23D H 0.289516 0.829366 0.701875 0.173 Uiso 1 1 calc R U . . .
H23E H 0.213461 0.782198 0.782481 0.173 Uiso 1 1 calc R U . . .
H23F H 0.280987 0.740454 0.716799 0.173 Uiso 1 1 calc R U . . .
C24A C 0.1508(13) 0.8825(9) 0.6823(13) 0.139(7) Uani 1 1 d . . . . .
H24D H 0.189911 0.923808 0.661731 0.209 Uiso 1 1 calc R U . . .
H24E H 0.121548 0.893033 0.649093 0.209 Uiso 1 1 calc R U . . .
H24F H 0.111025 0.878459 0.740242 0.209 Uiso 1 1 calc R U . . .
C25A C 0.0513(6) 0.6366(7) 0.6166(7) 0.066(3) Uani 1 1 d . . . . .
H25A H 0.099032 0.652816 0.560074 0.080 Uiso 1 1 calc R U . . .
C26A C 0.0405(8) 0.5523(8) 0.6391(9) 0.088(4) Uani 1 1 d . . . . .
H26D H 0.030065 0.539644 0.598634 0.132 Uiso 1 1 calc R U . . .
H26E H 0.090602 0.526927 0.639135 0.132 Uiso 1 1 calc R U . . .
H26F H -0.006297 0.535311 0.694304 0.132 Uiso 1 1 calc R U . . .
C27A C -0.0267(9) 0.6779(8) 0.6139(9) 0.092(4) Uani 1 1 d . . . . .
H27D H -0.018900 0.732814 0.599193 0.139 Uiso 1 1 calc R U . . .
H27E H -0.035843 0.665547 0.572564 0.139 Uiso 1 1 calc R U . . .
H27F H -0.074565 0.661533 0.668423 0.139 Uiso 1 1 calc R U . . .
N1B N 0.7761(4) 0.7048(4) 0.0796(4) 0.0460(15) Uani 1 1 d . . . . .
N2B N 0.7197(5) 0.6342(4) 0.0498(4) 0.0483(16) Uani 1 1 d . . . . .
C1B C 0.7184(5) 0.6473(4) 0.1164(4) 0.0392(16) Uani 1 1 d . . . . .
C2B C 0.8071(6) 0.7267(5) -0.0047(5) 0.061(2) Uani 1 1 d . . . . .
H2B H 0.846164 0.766153 -0.042502 0.073 Uiso 1 1 calc R U . . .
C3B C 0.7730(7) 0.6834(6) -0.0237(5) 0.066(3) Uani 1 1 d . . . . .
H3B H 0.782873 0.685378 -0.077729 0.079 Uiso 1 1 calc R U . . .
C4B C 0.8031(5) 0.7398(5) 0.1209(5) 0.0476(19) Uani 1 1 d . . . . .
C5B C 0.8673(6) 0.7062(6) 0.1383(5) 0.056(2) Uani 1 1 d . . . . .
C6B C 0.9014(7) 0.7462(9) 0.1663(6) 0.081(4) Uani 1 1 d . . . . .
H6B H 0.946270 0.725239 0.176723 0.098 Uiso 1 1 calc R U . . .
C7B C 0.8715(8) 0.8149(10) 0.1791(8) 0.095(4) Uani 1 1 d . . . . .
H7B H 0.894880 0.841105 0.199233 0.114 Uiso 1 1 calc R U . . .
C8B C 0.8062(9) 0.8469(7) 0.1626(7) 0.084(4) Uani 1 1 d . . . . .
H8B H 0.785390 0.894576 0.172595 0.101 Uiso 1 1 calc R U . . .
C9B C 0.7702(7) 0.8100(5) 0.1314(6) 0.060(2) Uani 1 1 d . . . . .
C10B C 0.9051(9) 0.6312(8) 0.1183(8) 0.090(4) Uani 1 1 d . . . . .
H10B H 0.861923 0.600697 0.122516 0.108 Uiso 1 1 calc R U . . .
C11B C 0.9395(8) 0.5844(8) 0.1767(7) 0.085(4) Uani 1 1 d . . . . .
H11G H 0.895158 0.572610 0.233788 0.127 Uiso 1 1 calc R U . . .
H11H H 0.962450 0.537203 0.161816 0.127 Uiso 1 1 calc R U . . .
H11I H 0.982861 0.613537 0.171794 0.127 Uiso 1 1 calc R U . . .
C12B C 0.9748(12) 0.6485(13) 0.0309(8) 0.187(13) Uani 1 1 d . . . . .
H12G H 0.953938 0.678528 -0.007459 0.280 Uiso 1 1 calc R U . . .
H12H H 1.017954 0.677328 0.026746 0.280 Uiso 1 1 calc R U . . .
H12I H 0.997543 0.600994 0.016768 0.280 Uiso 1 1 calc R U . . .
C13B C 0.7053(9) 0.8482(7) 0.1100(8) 0.086(4) Uani 1 1 d . . . . .
H13B H 0.677885 0.808797 0.104726 0.103 Uiso 1 1 calc R U . . .
C14B C 0.6386(8) 0.8834(7) 0.1762(8) 0.087(4) Uani 1 1 d . . . . .
H14G H 0.597542 0.907766 0.158274 0.130 Uiso 1 1 calc R U . . .
H14H H 0.611874 0.843642 0.228258 0.130 Uiso 1 1 calc R U . . .
H14I H 0.663619 0.921227 0.184539 0.130 Uiso 1 1 calc R U . . .
C15B C 0.7407(14) 0.9086(12) 0.0264(10) 0.202(14) Uani 1 1 d . . . . .
H15G H 0.695729 0.932636 0.014555 0.303 Uiso 1 1 calc R U . . .
H15H H 0.770629 0.947109 0.028392 0.303 Uiso 1 1 calc R U . . .
H15I H 0.778522 0.884803 -0.017158 0.303 Uiso 1 1 calc R U . . .
C16B C 0.6709(5) 0.5760(5) 0.0526(5) 0.0428(17) Uani 1 1 d . . . . .
C17B C 0.5988(6) 0.5977(6) 0.0472(6) 0.056(2) Uani 1 1 d . . . . .
C18B C 0.5573(6) 0.5429(8) 0.0447(6) 0.071(3) Uani 1 1 d . . . . .
H18B H 0.507714 0.555360 0.040600 0.085 Uiso 1 1 calc R U . . .
C19B C 0.5874(8) 0.4695(7) 0.0483(6) 0.075(3) Uani 1 1 d . . . . .
H19B H 0.557673 0.431896 0.047843 0.090 Uiso 1 1 calc R U . . .
C20B C 0.6597(6) 0.4513(6) 0.0524(6) 0.062(2) Uani 1 1 d . . . . .
H20B H 0.680366 0.401327 0.053608 0.074 Uiso 1 1 calc R U . . .
C21B C 0.7020(5) 0.5037(5) 0.0546(5) 0.051(2) Uani 1 1 d . . . . .
C22B C 0.5666(8) 0.6775(7) 0.0405(10) 0.093(4) Uani 1 1 d . . . . .
H22B H 0.594722 0.704030 0.059302 0.112 Uiso 1 1 calc R U . . .
C23B C 0.4771(10) 0.6837(10) 0.0919(10) 0.114(5) Uani 1 1 d . . . . .
H23G H 0.461685 0.737326 0.083728 0.171 Uiso 1 1 calc R U . . .
H23H H 0.447351 0.657573 0.075778 0.171 Uiso 1 1 calc R U . . .
H23I H 0.462671 0.660475 0.150303 0.171 Uiso 1 1 calc R U . . .
C24B C 0.5919(12) 0.7189(9) -0.0507(12) 0.144(8) Uani 1 1 d . . . . .
H24G H 0.651416 0.714218 -0.083823 0.216 Uiso 1 1 calc R U . . .
H24H H 0.562689 0.696384 -0.070296 0.216 Uiso 1 1 calc R U . . .
H24I H 0.577699 0.772649 -0.056157 0.216 Uiso 1 1 calc R U . . .
C25B C 0.7846(6) 0.4836(6) 0.0562(6) 0.062(2) Uani 1 1 d . . . . .
H25B H 0.791258 0.516185 0.085897 0.075 Uiso 1 1 calc R U . . .
C26B C 0.7899(7) 0.4021(6) 0.1011(6) 0.072(3) Uani 1 1 d . . . . .
H26G H 0.843994 0.393291 0.099748 0.108 Uiso 1 1 calc R U . . .
H26H H 0.746699 0.391561 0.158714 0.108 Uiso 1 1 calc R U . . .
H26I H 0.782538 0.368622 0.074075 0.108 Uiso 1 1 calc R U . . .
C27B C 0.8548(7) 0.5042(7) -0.0331(7) 0.080(3) Uani 1 1 d . . . . .
H27G H 0.849716 0.557324 -0.060623 0.120 Uiso 1 1 calc R U . . .
H27H H 0.907894 0.496920 -0.032318 0.120 Uiso 1 1 calc R U . . .
H27I H 0.851374 0.471532 -0.063135 0.120 Uiso 1 1 calc R U . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Cu1 Cu7 2.3874(15) . ?
Cu1 Cu6 2.5049(17) . ?
Cu1 Cu5 2.5171(17) . ?
Cu1 Cu2 2.5651(17) . ?
Cu1 Cu3 2.5770(17) . ?
Cu1 Cu4 2.6002(17) . ?
Cu2 Cu7 2.4269(14) . ?
Cu2 Cu18 2.4525(15) . ?
Cu2 Cu9 2.5100(16) . ?
Cu2 Cu8 2.5143(18) . ?
Cu2 Cu17 2.5687(16) . ?
Cu2 Cu6 2.5801(16) . ?
Cu2 Cu3 2.7180(16) . ?
Cu3 C1 1.975(7) . ?
Cu3 Cu10 2.5709(17) . ?
Cu3 Cu19 2.5868(15) . ?
Cu3 Cu7 2.5920(14) . ?
Cu3 Cu11 2.6377(16) . ?
Cu3 Cu4 2.6379(16) . ?
Cu3 Cu9 2.7086(17) . ?
Cu4 Cu7 2.4414(14) . ?
Cu4 Cu20 2.4862(15) . ?
Cu4 Cu12 2.5117(17) . ?
Cu4 Cu11 2.5549(16) . ?
Cu4 Cu5 2.5675(16) . ?
Cu4 Cu13 2.5745(16) . ?
Cu5 Cu21 2.4388(15) . ?
Cu5 Cu7 2.4699(15) . ?
Cu5 Cu6 2.5312(15) . ?
Cu5 Cu13 2.5713(15) . ?
Cu5 Cu14 2.5801(17) . ?
Cu5 Cu15 2.6674(16) . ?
Cu6 Cu22 2.4264(15) . ?
Cu6 Cu7 2.4786(14) . ?
Cu6 Cu17 2.5639(16) . ?
Cu6 Cu16 2.5735(17) . ?
Cu6 Cu15 2.6561(16) . ?
Cu7 Cu19 2.4567(14) . ?
Cu7 Cu23 2.4567(10) . ?
Cu7 Cu20 2.6009(13) . ?
Cu7 Cu21 2.6078(14) . ?
Cu7 Cu22 2.6200(14) . ?
Cu7 Cu18 2.6224(14) . ?
Cu8 Cu18 2.3901(15) . ?
Cu8 Cu9 2.5152(17) . ?
Cu8 Cu24 2.5505(18) . ?
Cu8 Cu25 2.5880(17) . ?
Cu8 Cu17 2.5909(18) . ?
Cu9 Cu19 2.4237(14) . ?
Cu9 Cu18 2.4561(15) . ?
Cu9 Cu25 2.5702(17) . ?
Cu9 Cu26 2.5777(16) . ?
Cu9 Cu10 2.5804(16) . ?
Cu10 Cu19 2.3934(15) . ?
Cu10 Cu26 2.5075(17) . ?
Cu10 Cu27 2.5090(17) . ?
Cu10 Cu11 2.5975(17) . ?
Cu11 Cu19 2.4421(14) . ?
Cu11 Cu20 2.4778(14) . ?
Cu11 Cu12 2.5115(17) . ?
Cu11 Cu27 2.5642(17) . ?
Cu11 Cu28 2.5689(16) . ?
Cu12 Cu20 2.3860(14) . ?
Cu12 Cu24 2.5564(17) 2_666 ?
Cu12 Cu13 2.5706(17) . ?
Cu12 Cu28 2.5737(18) . ?
Cu13 Cu20 2.4369(15) . ?
Cu13 Cu21 2.4702(14) . ?
Cu13 Cu14 2.5209(17) . ?
Cu13 Cu25 2.5243(16) 2_666 ?
Cu13 Cu24 2.6660(16) 2_666 ?
Cu14 Cu21 2.3944(15) . ?
Cu14 Cu25 2.5072(17) 2_666 ?
Cu14 Cu15 2.5420(16) . ?
Cu14 Cu26 2.5714(17) 2_666 ?
Cu15 C1A 1.943(8) . ?
Cu15 Cu16 2.5635(16) . ?
Cu15 Cu21 2.5753(14) . ?
Cu15 Cu22 2.5862(14) . ?
Cu15 Cu26 2.6497(16) 2_666 ?
Cu15 Cu27 2.6737(17) 2_666 ?
Cu16 Cu22 2.3979(14) . ?
Cu16 Cu17 2.5141(17) . ?
Cu16 Cu28 2.5237(18) 2_666 ?
Cu16 Cu27 2.5781(17) 2_666 ?
Cu17 Cu18 2.4446(14) . ?
Cu17 Cu22 2.4689(14) . ?
Cu17 Cu28 2.5304(16) 2_666 ?
Cu17 Cu24 2.6630(16) . ?
Cu18 Cu25 2.4352(15) . ?
Cu18 Cu23 2.4559(10) . ?
Cu18 Cu20 2.4607(14) 2_666 ?
Cu18 Cu24 2.5633(14) . ?
Cu18 Cu22 2.6088(14) . ?
Cu18 Cu21 2.6115(14) 2_666 ?
Cu18 Cu19 2.6213(13) . ?
Cu19 Cu23 2.4591(10) . ?
Cu19 Cu27 2.4673(14) . ?
Cu19 Cu26 2.4707(15) . ?
Cu19 Cu20 2.6047(14) . ?
Cu19 Cu22 2.6125(14) 2_666 ?
Cu19 Cu21 2.6189(14) 2_666 ?
Cu20 Cu28 2.4399(14) . ?
Cu20 Cu23 2.4519(9) . ?
Cu20 Cu24 2.5746(14) 2_666 ?
Cu20 Cu22 2.6072(14) 2_666 ?
Cu20 Cu21 2.6092(14) . ?
Cu21 Cu26 2.4330(14) 2_666 ?
Cu21 Cu23 2.4498(10) . ?
Cu21 Cu22 2.4575(13) . ?
Cu21 Cu25 2.4629(14) 2_666 ?
Cu22 Cu27 2.4418(15) 2_666 ?
Cu22 Cu23 2.4509(9) . ?
Cu22 Cu28 2.4791(14) 2_666 ?
Cu24 C1B 1.958(7) . ?
Cu24 Cu28 2.6496(16) 2_666 ?
Cu24 Cu25 2.6735(16) . ?
Cu25 Cu26 2.5631(15) . ?
Cu26 Cu27 2.5261(15) . ?
Cu27 Cu28 2.5816(16) . ?
N1 C3 1.350(11) . ?
N1 C1 1.384(10) . ?
N1 C16 1.439(10) . ?
N2 C2 1.375(11) . ?
N2 C1 1.376(10) . ?
N2 C4 1.431(10) . ?
C2 C3 1.341(14) . ?
C2 H2 0.9500 . ?
C3 H3 0.9500 . ?
C4 C5 1.395(12) . ?
C4 C9 1.422(12) . ?
C5 C6 1.384(13) . ?
C5 C10 1.526(12) . ?
C6 C7 1.355(15) . ?
C6 H6 0.9500 . ?
C7 C8 1.396(14) . ?
C7 H7 0.9500 . ?
C8 C9 1.367(13) . ?
C8 H8 0.9500 . ?
C9 C13 1.524(13) . ?
C10 C11 1.516(14) . ?
C10 C12 1.528(14) . ?
C10 H10 1.0000 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 H12A 0.9800 . ?
C12 H12B 0.9800 . ?
C12 H12C 0.9800 . ?
C13 C15 1.509(19) . ?
C13 C14 1.534(17) . ?
C13 H13 1.0000 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C16 C17 1.383(11) . ?
C16 C21 1.394(11) . ?
C17 C18 1.381(13) . ?
C17 C22 1.509(12) . ?
C18 C19 1.391(14) . ?
C18 H18 0.9500 . ?
C19 C20 1.355(15) . ?
C19 H19 0.9500 . ?
C20 C21 1.388(13) . ?
C20 H20 0.9500 . ?
C21 C25 1.506(13) . ?
C22 C24 1.529(15) . ?
C22 C23 1.540(14) . ?
C22 H22 1.0000 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
C25 C26 1.513(14) . ?
C25 C27 1.546(14) . ?
C25 H25 1.0000 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
N1A C2A 1.363(11) . ?
N1A C1A 1.398(10) . ?
N1A C4A 1.426(10) . ?
N2A C1A 1.362(10) . ?
N2A C3A 1.392(11) . ?
N2A C16A 1.429(10) . ?
C2A C3A 1.312(14) . ?
C2A H2A 0.9500 . ?
C3A H3A 0.9500 . ?
C4A C5A 1.392(13) . ?
C4A C9A 1.424(14) . ?
C5A C6A 1.358(14) . ?
C5A C10A 1.569(17) . ?
C6A C7A 1.364(17) . ?
C6A H6A 0.9500 . ?
C7A C8A 1.373(18) . ?
C7A H7A 0.9500 . ?
C8A C9A 1.355(15) . ?
C8A H8A 0.9500 . ?
C9A C13A 1.512(15) . ?
C10A C11A 1.42(2) . ?
C10A C12A 1.56(2) . ?
C10A H10A 1.0000 . ?
C11A H11D 0.9800 . ?
C11A H11E 0.9800 . ?
C11A H11F 0.9800 . ?
C12A H12D 0.9800 . ?
C12A H12E 0.9800 . ?
C12A H12F 0.9800 . ?
C13A C14A 1.463(19) . ?
C13A C15A 1.566(19) . ?
C13A H13A 1.0000 . ?
C14A H14D 0.9800 . ?
C14A H14E 0.9800 . ?
C14A H14F 0.9800 . ?
C15A H15D 0.9800 . ?
C15A H15E 0.9800 . ?
C15A H15F 0.9800 . ?
C16A C21A 1.366(12) . ?
C16A C17A 1.426(12) . ?
C17A C18A 1.378(13) . ?
C17A C22A 1.500(12) . ?
C18A C19A 1.383(14) . ?
C18A H18A 0.9500 . ?
C19A C20A 1.374(14) . ?
C19A H19A 0.9500 . ?
C20A C21A 1.399(12) . ?
C20A H20A 0.9500 . ?
C21A C25A 1.552(12) . ?
C22A C23A 1.557(19) . ?
C22A C24A 1.59(2) . ?
C22A H22A 1.0000 . ?
C23A H23D 0.9800 . ?
C23A H23E 0.9800 . ?
C23A H23F 0.9800 . ?
C24A H24D 0.9800 . ?
C24A H24E 0.9800 . ?
C24A H24F 0.9800 . ?
C25A C26A 1.503(17) . ?
C25A C27A 1.553(15) . ?
C25A H25A 1.0000 . ?
C26A H26D 0.9800 . ?
C26A H26E 0.9800 . ?
C26A H26F 0.9800 . ?
C27A H27D 0.9800 . ?
C27A H27E 0.9800 . ?
C27A H27F 0.9800 . ?
N1B C2B 1.371(11) . ?
N1B C1B 1.381(10) . ?
N1B C4B 1.439(10) . ?
N2B C1B 1.358(10) . ?
N2B C3B 1.386(11) . ?
N2B C16B 1.471(10) . ?
C2B C3B 1.309(13) . ?
C2B H2B 0.9500 . ?
C3B H3B 0.9500 . ?
C4B C9B 1.388(14) . ?
C4B C5B 1.401(13) . ?
C5B C6B 1.389(15) . ?
C5B C10B 1.537(17) . ?
C6B C7B 1.36(2) . ?
C6B H6B 0.9500 . ?
C7B C8B 1.40(2) . ?
C7B H7B 0.9500 . ?
C8B C9B 1.424(15) . ?
C8B H8B 0.9500 . ?
C9B C13B 1.472(16) . ?
C10B C12B 1.51(2) . ?
C10B C11B 1.531(15) . ?
C10B H10B 1.0000 . ?
C11B H11G 0.9800 . ?
C11B H11H 0.9800 . ?
C11B H11I 0.9800 . ?
C12B H12G 0.9800 . ?
C12B H12H 0.9800 . ?
C12B H12I 0.9800 . ?
C13B C14B 1.528(18) . ?
C13B C15B 1.53(2) . ?
C13B H13B 1.0000 . ?
C14B H14G 0.9800 . ?
C14B H14H 0.9800 . ?
C14B H14I 0.9800 . ?
C15B H15G 0.9800 . ?
C15B H15H 0.9800 . ?
C15B H15I 0.9800 . ?
C16B C21B 1.379(12) . ?
C16B C17B 1.383(12) . ?
C17B C18B 1.378(14) . ?
C17B C22B 1.507(15) . ?
C18B C19B 1.390(18) . ?
C18B H18B 0.9500 . ?
C19B C20B 1.366(15) . ?
C19B H19B 0.9500 . ?
C20B C21B 1.352(13) . ?
C20B H20B 0.9500 . ?
C21B C25B 1.534(13) . ?
C22B C23B 1.48(2) . ?
C22B C24B 1.54(2) . ?
C22B H22B 1.0000 . ?
C23B H23G 0.9800 . ?
C23B H23H 0.9800 . ?
C23B H23I 0.9800 . ?
C24B H24G 0.9800 . ?
C24B H24H 0.9800 . ?
C24B H24I 0.9800 . ?
C25B C26B 1.508(14) . ?
C25B C27B 1.539(15) . ?
C25B H25B 1.0000 . ?
C26B H26G 0.9800 . ?
C26B H26H 0.9800 . ?
C26B H26I 0.9800 . ?
C27B H27G 0.9800 . ?
C27B H27H 0.9800 . ?
C27B H27I 0.9800 . ?

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
_geom_angle_publ_flag
Cu7 Cu1 Cu6 60.82(4) . . ?
Cu7 Cu1 Cu5 60.41(5) . . ?
Cu6 Cu1 Cu5 60.53(5) . . ?
Cu7 Cu1 Cu2 58.55(4) . . ?
Cu6 Cu1 Cu2 61.17(5) . . ?
Cu5 Cu1 Cu2 109.50(6) . . ?
Cu7 Cu1 Cu3 62.81(5) . . ?
Cu6 Cu1 Cu3 115.23(6) . . ?
Cu5 Cu1 Cu3 112.90(6) . . ?
Cu2 Cu1 Cu3 63.82(5) . . ?
Cu7 Cu1 Cu4 58.43(4) . . ?
Cu6 Cu1 Cu4 109.28(6) . . ?
Cu5 Cu1 Cu4 60.20(5) . . ?
Cu2 Cu1 Cu4 109.19(6) . . ?
Cu3 Cu1 Cu4 61.26(5) . . ?
Cu7 Cu2 Cu18 65.02(4) . . ?
Cu7 Cu2 Cu9 89.34(5) . . ?
Cu18 Cu2 Cu9 59.32(4) . . ?
Cu7 Cu2 Cu8 122.46(6) . . ?
Cu18 Cu2 Cu8 57.51(4) . . ?
Cu9 Cu2 Cu8 60.08(5) . . ?
Cu7 Cu2 Cu1 57.06(4) . . ?
Cu18 Cu2 Cu1 121.98(5) . . ?
Cu9 Cu2 Cu1 120.30(6) . . ?
Cu8 Cu2 Cu1 179.22(7) . . ?
Cu7 Cu2 Cu17 91.54(5) . . ?
Cu18 Cu2 Cu17 58.21(4) . . ?
Cu9 Cu2 Cu17 109.69(6) . . ?
Cu8 Cu2 Cu17 61.28(5) . . ?
Cu1 Cu2 Cu17 117.99(6) . . ?
Cu7 Cu2 Cu6 59.25(4) . . ?
Cu18 Cu2 Cu6 90.31(5) . . ?
Cu9 Cu2 Cu6 144.50(6) . . ?
Cu8 Cu2 Cu6 121.00(6) . . ?
Cu1 Cu2 Cu6 58.26(5) . . ?
Cu17 Cu2 Cu6 59.73(4) . . ?
Cu7 Cu2 Cu3 60.19(4) . . ?
Cu18 Cu2 Cu3 96.39(5) . . ?
Cu9 Cu2 Cu3 62.26(4) . . ?
Cu8 Cu2 Cu3 122.14(6) . . ?
Cu1 Cu2 Cu3 58.30(5) . . ?
Cu17 Cu2 Cu3 149.40(5) . . ?
Cu6 Cu2 Cu3 108.17(5) . . ?
C1 Cu3 Cu10 95.9(2) . . ?
C1 Cu3 Cu1 97.3(2) . . ?
Cu10 Cu3 Cu1 166.56(6) . . ?
C1 Cu3 Cu19 150.8(2) . . ?
Cu10 Cu3 Cu19 55.30(4) . . ?
Cu1 Cu3 Cu19 111.62(5) . . ?
C1 Cu3 Cu7 151.9(2) . . ?
Cu10 Cu3 Cu7 111.92(5) . . ?
Cu1 Cu3 Cu7 55.02(4) . . ?
Cu19 Cu3 Cu7 56.64(4) . . ?
C1 Cu3 Cu11 108.2(2) . . ?
Cu10 Cu3 Cu11 59.81(5) . . ?
Cu1 Cu3 Cu11 117.29(6) . . ?
Cu19 Cu3 Cu11 55.73(4) . . ?
Cu7 Cu3 Cu11 83.89(4) . . ?
C1 Cu3 Cu4 108.6(2) . . ?
Cu10 Cu3 Cu4 117.36(6) . . ?
Cu1 Cu3 Cu4 59.80(5) . . ?
Cu19 Cu3 Cu4 84.14(5) . . ?
Cu7 Cu3 Cu4 55.65(4) . . ?
Cu11 Cu3 Cu4 57.93(4) . . ?
C1 Cu3 Cu9 117.9(2) . . ?
Cu10 Cu3 Cu9 58.45(4) . . ?
Cu1 Cu3 Cu9 112.76(6) . . ?
Cu19 Cu3 Cu9 54.42(4) . . ?
Cu7 Cu3 Cu9 81.79(4) . . ?
Cu11 Cu3 Cu9 103.93(5) . . ?
Cu4 Cu3 Cu9 133.44(5) . . ?
C1 Cu3 Cu2 118.6(2) . . ?
Cu10 Cu3 Cu2 113.31(6) . . ?
Cu1 Cu3 Cu2 57.88(4) . . ?
Cu19 Cu3 Cu2 81.69(4) . . ?
Cu7 Cu3 Cu2 54.33(4) . . ?
Cu11 Cu3 Cu2 133.23(5) . . ?
Cu4 Cu3 Cu2 103.64(5) . . ?
Cu9 Cu3 Cu2 55.10(4) . . ?
Cu7 Cu4 Cu20 63.71(4) . . ?
Cu7 Cu4 Cu12 120.68(6) . . ?
Cu20 Cu4 Cu12 57.03(4) . . ?
Cu7 Cu4 Cu11 88.77(5) . . ?
Cu20 Cu4 Cu11 58.86(4) . . ?
Cu12 Cu4 Cu11 59.42(5) . . ?
Cu7 Cu4 Cu5 59.03(4) . . ?
Cu20 Cu4 Cu5 89.78(5) . . ?
Cu12 Cu4 Cu5 120.70(6) . . ?
Cu11 Cu4 Cu5 143.74(6) . . ?
Cu7 Cu4 Cu13 90.45(5) . . ?
Cu20 Cu4 Cu13 57.54(4) . . ?
Cu12 Cu4 Cu13 60.70(5) . . ?
Cu11 Cu4 Cu13 108.46(5) . . ?
Cu5 Cu4 Cu13 60.01(4) . . ?
Cu7 Cu4 Cu1 56.42(4) . . ?
Cu20 Cu4 Cu1 120.08(5) . . ?
Cu12 Cu4 Cu1 177.11(6) . . ?
Cu11 Cu4 Cu1 119.49(6) . . ?
Cu5 Cu4 Cu1 58.29(5) . . ?
Cu13 Cu4 Cu1 118.28(6) . . ?
Cu7 Cu4 Cu3 61.22(4) . . ?
Cu20 Cu4 Cu3 95.21(5) . . ?
Cu12 Cu4 Cu3 120.29(6) . . ?
Cu11 Cu4 Cu3 61.03(4) . . ?
Cu5 Cu4 Cu3 109.29(5) . . ?
Cu13 Cu4 Cu3 148.55(6) . . ?
Cu1 Cu4 Cu3 58.93(5) . . ?
Cu21 Cu5 Cu7 64.18(4) . . ?
Cu21 Cu5 Cu1 121.26(6) . . ?
Cu7 Cu5 Cu1 57.19(4) . . ?
Cu21 Cu5 Cu6 88.67(5) . . ?
Cu7 Cu5 Cu6 59.41(4) . . ?
Cu1 Cu5 Cu6 59.49(5) . . ?
Cu21 Cu5 Cu4 91.18(5) . . ?
Cu7 Cu5 Cu4 57.94(4) . . ?
Cu1 Cu5 Cu4 61.50(5) . . ?
Cu6 Cu5 Cu4 109.50(5) . . ?
Cu21 Cu5 Cu13 59.01(4) . . ?
Cu7 Cu5 Cu13 89.88(5) . . ?
Cu1 Cu5 Cu13 121.61(6) . . ?
Cu6 Cu5 Cu13 143.90(6) . . ?
Cu4 Cu5 Cu13 60.13(4) . . ?
Cu21 Cu5 Cu14 56.91(4) . . ?
Cu7 Cu5 Cu14 121.02(6) . . ?
Cu1 Cu5 Cu14 177.98(6) . . ?
Cu6 Cu5 Cu14 119.00(6) . . ?
Cu4 Cu5 Cu14 118.73(6) . . ?
Cu13 Cu5 Cu14 58.60(4) . . ?
Cu21 Cu5 Cu15 60.38(4) . . ?
Cu7 Cu5 Cu15 95.76(5) . . ?
Cu1 Cu5 Cu15 120.72(6) . . ?
Cu6 Cu5 Cu15 61.39(4) . . ?
Cu4 Cu5 Cu15 148.97(6) . . ?
Cu13 Cu5 Cu15 108.18(5) . . ?
Cu14 Cu5 Cu15 57.92(4) . . ?
Cu22 Cu6 Cu7 64.56(4) . . ?
Cu22 Cu6 Cu1 121.78(5) . . ?
Cu7 Cu6 Cu1 57.25(4) . . ?
Cu22 Cu6 Cu5 89.59(5) . . ?
Cu7 Cu6 Cu5 59.07(4) . . ?
Cu1 Cu6 Cu5 59.97(5) . . ?
Cu22 Cu6 Cu17 59.23(4) . . ?
Cu7 Cu6 Cu17 90.47(5) . . ?
Cu1 Cu6 Cu17 120.48(6) . . ?
Cu5 Cu6 Cu17 144.72(5) . . ?
Cu22 Cu6 Cu16 57.23(4) . . ?
Cu7 Cu6 Cu16 121.73(6) . . ?
Cu1 Cu6 Cu16 178.82(6) . . ?
Cu5 Cu6 Cu16 120.24(6) . . ?
Cu17 Cu6 Cu16 58.60(5) . . ?
Cu22 Cu6 Cu2 90.35(5) . . ?
Cu7 Cu6 Cu2 57.29(4) . . ?
Cu1 Cu6 Cu2 60.57(5) . . ?
Cu5 Cu6 Cu2 108.58(5) . . ?
Cu17 Cu6 Cu2 59.91(4) . . ?
Cu16 Cu6 Cu2 118.50(6) . . ?
Cu22 Cu6 Cu15 60.97(4) . . ?
Cu7 Cu6 Cu15 95.84(5) . . ?
Cu1 Cu6 Cu15 121.64(6) . . ?
Cu5 Cu6 Cu15 61.83(4) . . ?
Cu17 Cu6 Cu15 108.99(6) . . ?
Cu16 Cu6 Cu15 58.68(4) . . ?
Cu2 Cu6 Cu15 148.43(5) . . ?
Cu1 Cu7 Cu2 64.39(5) . . ?
Cu1 Cu7 Cu4 65.15(5) . . ?
Cu2 Cu7 Cu4 119.73(6) . . ?
Cu1 Cu7 Cu19 123.71(6) . . ?
Cu2 Cu7 Cu19 90.59(5) . . ?
Cu4 Cu7 Cu19 91.25(5) . . ?
Cu1 Cu7 Cu23 176.08(6) . . ?
Cu2 Cu7 Cu23 115.68(5) . . ?
Cu4 Cu7 Cu23 116.89(5) . . ?
Cu19 Cu7 Cu23 60.07(3) . . ?
Cu1 Cu7 Cu5 62.40(5) . . ?
Cu2 Cu7 Cu5 115.89(5) . . ?
Cu4 Cu7 Cu5 63.03(4) . . ?
Cu19 Cu7 Cu5 149.40(5) . . ?
Cu23 Cu7 Cu5 115.09(5) . . ?
Cu1 Cu7 Cu6 61.93(5) . . ?
Cu2 Cu7 Cu6 63.46(4) . . ?
Cu4 Cu7 Cu6 115.62(5) . . ?
Cu19 Cu7 Cu6 149.05(6) . . ?
Cu23 Cu7 Cu6 114.38(5) . . ?
Cu5 Cu7 Cu6 61.53(4) . . ?
Cu1 Cu7 Cu3 62.17(5) . . ?
Cu2 Cu7 Cu3 65.48(5) . . ?
Cu4 Cu7 Cu3 63.13(4) . . ?
Cu19 Cu7 Cu3 61.58(4) . . ?
Cu23 Cu7 Cu3 121.63(5) . . ?
Cu5 Cu7 Cu3 113.99(5) . . ?
Cu6 Cu7 Cu3 115.62(5) . . ?
Cu1 Cu7 Cu20 124.07(6) . . ?
Cu2 Cu7 Cu20 151.74(6) . . ?
Cu4 Cu7 Cu20 58.98(4) . . ?
Cu19 Cu7 Cu20 61.92(4) . . ?
Cu23 Cu7 Cu20 57.91(3) . . ?
Cu5 Cu7 Cu20 89.37(5) . . ?
Cu6 Cu7 Cu20 144.66(5) . . ?
Cu3 Cu7 Cu20 93.60(5) . . ?
Cu1 Cu7 Cu21 119.62(6) . . ?
Cu2 Cu7 Cu21 143.75(5) . . ?
Cu4 Cu7 Cu21 90.17(5) . . ?
Cu19 Cu7 Cu21 110.10(5) . . ?
Cu23 Cu7 Cu21 57.76(3) . . ?
Cu5 Cu7 Cu21 57.33(4) . . ?
Cu6 Cu7 Cu21 86.11(5) . . ?
Cu3 Cu7 Cu21 150.56(5) . . ?
Cu20 Cu7 Cu21 60.12(4) . . ?
Cu1 Cu7 Cu22 118.66(5) . . ?
Cu2 Cu7 Cu22 89.40(5) . . ?
Cu4 Cu7 Cu22 144.30(6) . . ?
Cu19 Cu7 Cu22 109.91(5) . . ?
Cu23 Cu7 Cu22 57.63(3) . . ?
Cu5 Cu7 Cu22 86.64(5) . . ?
Cu6 Cu7 Cu22 56.75(4) . . ?
Cu3 Cu7 Cu22 152.34(5) . . ?
Cu20 Cu7 Cu22 105.36(5) . . ?
Cu21 Cu7 Cu22 56.08(4) . . ?
Cu1 Cu7 Cu18 122.25(5) . . ?
Cu2 Cu7 Cu18 57.96(4) . . ?
Cu4 Cu7 Cu18 152.33(6) . . ?
Cu19 Cu7 Cu18 62.04(4) . . ?
Cu23 Cu7 Cu18 57.72(3) . . ?
Cu5 Cu7 Cu18 144.59(5) . . ?
Cu6 Cu7 Cu18 88.76(5) . . ?
Cu3 Cu7 Cu18 95.45(5) . . ?
Cu20 Cu7 Cu18 108.77(5) . . ?
Cu21 Cu7 Cu18 105.12(5) . . ?
Cu22 Cu7 Cu18 59.69(4) . . ?
Cu18 Cu8 Cu2 59.95(5) . . ?
Cu18 Cu8 Cu9 60.03(4) . . ?
Cu2 Cu8 Cu9 59.88(5) . . ?
Cu18 Cu8 Cu24 62.41(4) . . ?
Cu2 Cu8 Cu24 113.12(6) . . ?
Cu9 Cu8 Cu24 113.47(6) . . ?
Cu18 Cu8 Cu25 58.41(4) . . ?
Cu2 Cu8 Cu25 108.64(6) . . ?
Cu9 Cu8 Cu25 60.46(5) . . ?
Cu24 Cu8 Cu25 62.70(5) . . ?
Cu18 Cu8 Cu17 58.62(4) . . ?
Cu2 Cu8 Cu17 60.40(5) . . ?
Cu9 Cu8 Cu17 108.82(6) . . ?
Cu24 Cu8 Cu17 62.39(5) . . ?
Cu25 Cu8 Cu17 109.40(6) . . ?
Cu19 Cu9 Cu18 64.98(4) . . ?
Cu19 Cu9 Cu2 89.40(5) . . ?
Cu18 Cu9 Cu2 59.18(4) . . ?
Cu19 Cu9 Cu8 122.38(6) . . ?
Cu18 Cu9 Cu8 57.46(4) . . ?
Cu2 Cu9 Cu8 60.04(5) . . ?
Cu19 Cu9 Cu25 91.14(5) . . ?
Cu18 Cu9 Cu25 57.91(4) . . ?
Cu2 Cu9 Cu25 109.34(6) . . ?
Cu8 Cu9 Cu25 61.17(5) . . ?
Cu19 Cu9 Cu26 59.11(4) . . ?
Cu18 Cu9 Cu26 90.28(5) . . ?
Cu2 Cu9 Cu26 144.39(6) . . ?
Cu8 Cu9 Cu26 120.89(6) . . ?
Cu25 Cu9 Cu26 59.72(4) . . ?
Cu19 Cu9 Cu10 57.04(4) . . ?
Cu18 Cu9 Cu10 121.92(5) . . ?
Cu2 Cu9 Cu10 120.46(6) . . ?
Cu8 Cu9 Cu10 179.02(7) . . ?
Cu25 Cu9 Cu10 117.89(6) . . ?
Cu26 Cu9 Cu10 58.17(5) . . ?
Cu19 Cu9 Cu3 60.23(4) . . ?
Cu18 Cu9 Cu3 96.55(5) . . ?
Cu2 Cu9 Cu3 62.64(5) . . ?
Cu8 Cu9 Cu3 122.48(6) . . ?
Cu25 Cu9 Cu3 149.10(5) . . ?
Cu26 Cu9 Cu3 107.94(5) . . ?
Cu10 Cu9 Cu3 58.11(5) . . ?
Cu19 Cu10 Cu26 60.49(4) . . ?
Cu19 Cu10 Cu27 60.38(4) . . ?
Cu26 Cu10 Cu27 60.47(5) . . ?
Cu19 Cu10 Cu3 62.69(5) . . ?
Cu26 Cu10 Cu3 114.69(6) . . ?
Cu27 Cu10 Cu3 112.92(6) . . ?
Cu19 Cu10 Cu9 58.18(4) . . ?
Cu26 Cu10 Cu9 60.86(5) . . ?
Cu27 Cu10 Cu9 109.16(6) . . ?
Cu3 Cu10 Cu9 63.45(5) . . ?
Cu19 Cu10 Cu11 58.42(4) . . ?
Cu26 Cu10 Cu11 109.08(6) . . ?
Cu27 Cu10 Cu11 60.25(5) . . ?
Cu3 Cu10 Cu11 61.37(5) . . ?
Cu9 Cu10 Cu11 108.84(6) . . ?
Cu19 Cu11 Cu20 63.93(4) . . ?
Cu19 Cu11 Cu12 120.99(6) . . ?
Cu20 Cu11 Cu12 57.13(4) . . ?
Cu19 Cu11 Cu4 88.92(5) . . ?
Cu20 Cu11 Cu4 59.18(4) . . ?
Cu12 Cu11 Cu4 59.43(5) . . ?
Cu19 Cu11 Cu27 58.99(4) . . ?
Cu20 Cu11 Cu27 90.00(5) . . ?
Cu12 Cu11 Cu27 121.23(6) . . ?
Cu4 Cu11 Cu27 144.06(6) . . ?
Cu19 Cu11 Cu28 90.95(5) . . ?
Cu20 Cu11 Cu28 57.79(4) . . ?
Cu12 Cu11 Cu28 60.86(5) . . ?
Cu4 Cu11 Cu28 108.89(5) . . ?
Cu27 Cu11 Cu28 60.39(4) . . ?
Cu19 Cu11 Cu10 56.61(4) . . ?
Cu20 Cu11 Cu10 120.47(5) . . ?
Cu12 Cu11 Cu10 177.59(6) . . ?
Cu4 Cu11 Cu10 119.46(6) . . ?
Cu27 Cu11 Cu10 58.16(5) . . ?
Cu28 Cu11 Cu10 118.54(6) . . ?
Cu19 Cu11 Cu3 61.08(4) . . ?
Cu20 Cu11 Cu3 95.42(5) . . ?
Cu12 Cu11 Cu3 120.30(6) . . ?
Cu4 Cu11 Cu3 61.04(4) . . ?
Cu27 Cu11 Cu3 108.96(5) . . ?
Cu28 Cu11 Cu3 149.00(6) . . ?
Cu10 Cu11 Cu3 58.82(5) . . ?
Cu20 Cu12 Cu11 60.72(4) . . ?
Cu20 Cu12 Cu4 60.95(4) . . ?
Cu11 Cu12 Cu4 61.14(5) . . ?
Cu20 Cu12 Cu24 62.68(4) . 2_666 ?
Cu11 Cu12 Cu24 113.74(6) . 2_666 ?
Cu4 Cu12 Cu24 114.28(5) . 2_666 ?
Cu20 Cu12 Cu13 58.76(4) . . ?
Cu11 Cu12 Cu13 109.95(5) . . ?
Cu4 Cu12 Cu13 60.86(5) . . ?
Cu24 Cu12 Cu13 62.66(4) 2_666 . ?
Cu20 Cu12 Cu28 58.79(4) . . ?
Cu11 Cu12 Cu28 60.67(5) . . ?
Cu4 Cu12 Cu28 110.10(5) . . ?
Cu24 Cu12 Cu28 62.19(5) 2_666 . ?
Cu13 Cu12 Cu28 109.53(5) . . ?
Cu20 Cu13 Cu21 64.24(4) . . ?
Cu20 Cu13 Cu14 121.51(5) . . ?
Cu21 Cu13 Cu14 57.32(4) . . ?
Cu20 Cu13 Cu25 89.34(5) . 2_666 ?
Cu21 Cu13 Cu25 59.08(4) . 2_666 ?
Cu14 Cu13 Cu25 59.60(5) . 2_666 ?
Cu20 Cu13 Cu12 56.84(4) . . ?
Cu21 Cu13 Cu12 121.01(5) . . ?
Cu14 Cu13 Cu12 178.32(6) . . ?
Cu25 Cu13 Cu12 120.05(6) 2_666 . ?
Cu20 Cu13 Cu5 90.80(5) . . ?
Cu21 Cu13 Cu5 57.82(4) . . ?
Cu14 Cu13 Cu5 60.88(5) . . ?
Cu25 Cu13 Cu5 108.86(5) 2_666 . ?
Cu12 Cu13 Cu5 118.29(6) . . ?
Cu20 Cu13 Cu4 59.41(4) . . ?
Cu21 Cu13 Cu4 90.31(5) . . ?
Cu14 Cu13 Cu4 120.74(6) . . ?
Cu25 Cu13 Cu4 144.63(6) 2_666 . ?
Cu12 Cu13 Cu4 58.44(4) . . ?
Cu5 Cu13 Cu4 59.86(4) . . ?
Cu20 Cu13 Cu24 60.40(4) . 2_666 ?
Cu21 Cu13 Cu24 95.44(5) . 2_666 ?
Cu14 Cu13 Cu24 121.40(6) . 2_666 ?
Cu25 Cu13 Cu24 61.94(4) 2_666 2_666 ?
Cu12 Cu13 Cu24 58.41(4) . 2_666 ?
Cu5 Cu13 Cu24 148.48(6) . 2_666 ?
Cu4 Cu13 Cu24 108.65(5) . 2_666 ?
Cu21 Cu14 Cu25 60.27(4) . 2_666 ?
Cu21 Cu14 Cu13 60.27(4) . . ?
Cu25 Cu14 Cu13 60.27(5) 2_666 . ?
Cu21 Cu14 Cu15 62.81(4) . . ?
Cu25 Cu14 Cu15 113.73(6) 2_666 . ?
Cu13 Cu14 Cu15 113.88(6) . . ?
Cu21 Cu14 Cu26 58.54(4) . 2_666 ?
Cu25 Cu14 Cu26 60.61(5) 2_666 2_666 ?
Cu13 Cu14 Cu26 109.15(6) . 2_666 ?
Cu15 Cu14 Cu26 62.42(5) . 2_666 ?
Cu21 Cu14 Cu5 58.57(4) . . ?
Cu25 Cu14 Cu5 109.12(6) 2_666 . ?
Cu13 Cu14 Cu5 60.53(4) . . ?
Cu15 Cu14 Cu5 62.76(5) . . ?
Cu26 Cu14 Cu5 109.34(5) 2_666 . ?
C1A Cu15 Cu14 94.7(2) . . ?
C1A Cu15 Cu16 97.2(2) . . ?
Cu14 Cu15 Cu16 168.16(6) . . ?
C1A Cu15 Cu21 150.5(2) . . ?
Cu14 Cu15 Cu21 55.79(4) . . ?
Cu16 Cu15 Cu21 112.37(5) . . ?
C1A Cu15 Cu22 152.7(2) . . ?
Cu14 Cu15 Cu22 112.66(5) . . ?
Cu16 Cu15 Cu22 55.50(4) . . ?
Cu21 Cu15 Cu22 56.87(4) . . ?
C1A Cu15 Cu26 112.1(3) . 2_666 ?
Cu14 Cu15 Cu26 59.33(4) . 2_666 ?
Cu16 Cu15 Cu26 115.33(6) . 2_666 ?
Cu21 Cu15 Cu26 55.48(4) . 2_666 ?
Cu22 Cu15 Cu26 83.28(4) . 2_666 ?
C1A Cu15 Cu6 113.9(3) . . ?
Cu14 Cu15 Cu6 115.81(6) . . ?
Cu16 Cu15 Cu6 59.05(5) . . ?
Cu21 Cu15 Cu6 83.20(4) . . ?
Cu22 Cu15 Cu6 55.12(4) . . ?
Cu26 Cu15 Cu6 134.02(5) 2_666 . ?
C1A Cu15 Cu5 112.5(3) . . ?
Cu14 Cu15 Cu5 59.32(4) . . ?
Cu16 Cu15 Cu5 115.58(6) . . ?
Cu21 Cu15 Cu5 55.41(4) . . ?
Cu22 Cu15 Cu5 83.36(4) . . ?
Cu26 Cu15 Cu5 104.45(5) 2_666 . ?
Cu6 Cu15 Cu5 56.78(4) . . ?
C1A Cu15 Cu27 113.2(3) . 2_666 ?
Cu14 Cu15 Cu27 115.73(5) . 2_666 ?
Cu16 Cu15 Cu27 58.93(5) . 2_666 ?
Cu21 Cu15 Cu27 83.38(4) . 2_666 ?
Cu22 Cu15 Cu27 55.29(4) . 2_666 ?
Cu26 Cu15 Cu27 56.66(4) 2_666 2_666 ?
Cu6 Cu15 Cu27 103.90(5) . 2_666 ?
Cu5 Cu15 Cu27 134.22(5) . 2_666 ?
Cu22 Cu16 Cu17 60.29(4) . . ?
Cu22 Cu16 Cu28 60.43(4) . 2_666 ?
Cu17 Cu16 Cu28 60.30(5) . 2_666 ?
Cu22 Cu16 Cu15 62.73(4) . . ?
Cu17 Cu16 Cu15 113.64(5) . . ?
Cu28 Cu16 Cu15 114.00(5) 2_666 . ?
Cu22 Cu16 Cu6 58.30(4) . . ?
Cu17 Cu16 Cu6 60.51(5) . . ?
Cu28 Cu16 Cu6 109.04(5) 2_666 . ?
Cu15 Cu16 Cu6 62.27(5) . . ?
Cu22 Cu16 Cu27 58.64(4) . 2_666 ?
Cu17 Cu16 Cu27 109.28(6) . 2_666 ?
Cu28 Cu16 Cu27 60.79(5) 2_666 2_666 ?
Cu15 Cu16 Cu27 62.67(5) . 2_666 ?
Cu6 Cu16 Cu27 109.12(5) . 2_666 ?
Cu18 Cu17 Cu22 64.14(4) . . ?
Cu18 Cu17 Cu16 121.59(5) . . ?
Cu22 Cu17 Cu16 57.52(4) . . ?
Cu18 Cu17 Cu28 88.97(5) . 2_666 ?
Cu22 Cu17 Cu28 59.44(4) . 2_666 ?
Cu16 Cu17 Cu28 60.04(5) . 2_666 ?
Cu18 Cu17 Cu6 90.87(5) . . ?
Cu22 Cu17 Cu6 57.61(4) . . ?
Cu16 Cu17 Cu6 60.89(5) . . ?
Cu28 Cu17 Cu6 109.14(5) 2_666 . ?
Cu18 Cu17 Cu2 58.51(4) . . ?
Cu22 Cu17 Cu2 89.67(5) . . ?
Cu16 Cu17 Cu2 121.24(6) . . ?
Cu28 Cu17 Cu2 143.72(5) 2_666 . ?
Cu6 Cu17 Cu2 60.36(4) . . ?
Cu18 Cu17 Cu8 56.58(4) . . ?
Cu22 Cu17 Cu8 120.67(5) . . ?
Cu16 Cu17 Cu8 178.17(6) . . ?
Cu28 Cu17 Cu8 119.09(6) 2_666 . ?
Cu6 Cu17 Cu8 118.68(6) . . ?
Cu2 Cu17 Cu8 58.33(5) . . ?
Cu18 Cu17 Cu24 60.06(4) . . ?
Cu22 Cu17 Cu24 95.16(5) . . ?
Cu16 Cu17 Cu24 121.21(6) . . ?
Cu28 Cu17 Cu24 61.29(4) 2_666 . ?
Cu6 Cu17 Cu24 148.10(5) . . ?
Cu2 Cu17 Cu24 107.76(5) . . ?
Cu8 Cu17 Cu24 58.06(5) . . ?
Cu8 Cu18 Cu25 64.86(5) . . ?
Cu8 Cu18 Cu17 64.80(5) . . ?
Cu25 Cu18 Cu17 120.03(5) . . ?
Cu8 Cu18 Cu2 62.54(5) . . ?
Cu25 Cu18 Cu2 115.99(6) . . ?
Cu17 Cu18 Cu2 63.27(5) . . ?
Cu8 Cu18 Cu23 176.69(6) . . ?
Cu25 Cu18 Cu23 116.01(5) . . ?
Cu17 Cu18 Cu23 116.16(5) . . ?
Cu2 Cu18 Cu23 114.77(5) . . ?
Cu8 Cu18 Cu9 62.51(5) . . ?
Cu25 Cu18 Cu9 63.40(5) . . ?
Cu17 Cu18 Cu9 115.84(5) . . ?
Cu2 Cu18 Cu9 61.51(5) . . ?
Cu23 Cu18 Cu9 114.74(4) . . ?
Cu8 Cu18 Cu20 123.48(6) . 2_666 ?
Cu25 Cu18 Cu20 90.88(5) . 2_666 ?
Cu17 Cu18 Cu20 90.92(5) . 2_666 ?
Cu2 Cu18 Cu20 149.18(6) . 2_666 ?
Cu23 Cu18 Cu20 59.83(3) . 2_666 ?
Cu9 Cu18 Cu20 149.29(6) . 2_666 ?
Cu8 Cu18 Cu24 61.86(5) . . ?
Cu25 Cu18 Cu24 64.61(4) . . ?
Cu17 Cu18 Cu24 64.20(4) . . ?
Cu2 Cu18 Cu24 114.82(5) . . ?
Cu23 Cu18 Cu24 121.44(5) . . ?
Cu9 Cu18 Cu24 115.08(5) . . ?
Cu20 Cu18 Cu24 61.62(4) 2_666 . ?
Cu8 Cu18 Cu22 123.12(5) . . ?
Cu25 Cu18 Cu22 151.88(6) . . ?
Cu17 Cu18 Cu22 58.38(4) . . ?
Cu2 Cu18 Cu22 89.10(5) . . ?
Cu23 Cu18 Cu22 57.79(3) . . ?
Cu9 Cu18 Cu22 144.62(6) . . ?
Cu20 Cu18 Cu22 61.82(4) 2_666 . ?
Cu24 Cu18 Cu22 94.26(5) . . ?
Cu8 Cu18 Cu21 123.10(6) . 2_666 ?
Cu25 Cu18 Cu21 58.29(4) . 2_666 ?
Cu17 Cu18 Cu21 151.91(6) . 2_666 ?
Cu2 Cu18 Cu21 144.71(5) . 2_666 ?
Cu23 Cu18 Cu21 57.72(3) . 2_666 ?
Cu9 Cu18 Cu21 89.19(5) . 2_666 ?
Cu20 Cu18 Cu21 61.84(4) 2_666 2_666 ?
Cu24 Cu18 Cu21 94.58(5) . 2_666 ?
Cu22 Cu18 Cu21 108.63(5) . 2_666 ?
Cu8 Cu18 Cu19 119.37(6) . . ?
Cu25 Cu18 Cu19 89.67(5) . . ?
Cu17 Cu18 Cu19 143.91(6) . . ?
Cu2 Cu18 Cu19 86.26(5) . . ?
Cu23 Cu18 Cu19 57.83(3) . . ?
Cu9 Cu18 Cu19 56.91(4) . . ?
Cu20 Cu18 Cu19 109.98(5) 2_666 . ?
Cu24 Cu18 Cu19 151.68(5) . . ?
Cu22 Cu18 Cu19 105.29(4) . . ?
Cu21 Cu18 Cu19 60.06(4) 2_666 . ?
Cu8 Cu18 Cu7 119.50(6) . . ?
Cu25 Cu18 Cu7 143.80(5) . . ?
Cu17 Cu18 Cu7 89.86(5) . . ?
Cu2 Cu18 Cu7 57.02(4) . . ?
Cu23 Cu18 Cu7 57.75(3) . . ?
Cu9 Cu18 Cu7 86.17(5) . . ?
Cu20 Cu18 Cu7 109.92(5) 2_666 . ?
Cu24 Cu18 Cu7 151.40(5) . . ?
Cu22 Cu18 Cu7 60.11(4) . . ?
Cu21 Cu18 Cu7 105.14(4) 2_666 . ?
Cu19 Cu18 Cu7 55.88(4) . . ?
Cu10 Cu19 Cu9 64.78(5) . . ?
Cu10 Cu19 Cu11 64.97(5) . . ?
Cu9 Cu19 Cu11 119.87(6) . . ?
Cu10 Cu19 Cu7 123.78(6) . . ?
Cu9 Cu19 Cu7 90.67(5) . . ?
Cu11 Cu19 Cu7 91.06(5) . . ?
Cu10 Cu19 Cu23 176.22(6) . . ?
Cu9 Cu19 Cu23 115.82(5) . . ?
Cu11 Cu19 Cu23 116.53(5) . . ?
Cu7 Cu19 Cu23 59.97(3) . . ?
Cu10 Cu19 Cu27 62.13(5) . . ?
Cu9 Cu19 Cu27 115.99(5) . . ?
Cu11 Cu19 Cu27 62.97(4) . . ?
Cu7 Cu19 Cu27 149.17(6) . . ?
Cu23 Cu19 Cu27 115.07(5) . . ?
Cu10 Cu19 Cu26 62.04(5) . . ?
Cu9 Cu19 Cu26 63.55(4) . . ?
Cu11 Cu19 Cu26 115.65(5) . . ?
Cu7 Cu19 Cu26 149.28(5) . . ?
Cu23 Cu19 Cu26 114.61(5) . . ?
Cu27 Cu19 Cu26 61.54(4) . . ?
Cu10 Cu19 Cu3 62.01(5) . . ?
Cu9 Cu19 Cu3 65.35(5) . . ?
Cu11 Cu19 Cu3 63.19(4) . . ?
Cu7 Cu19 Cu3 61.79(4) . . ?
Cu23 Cu19 Cu3 121.74(5) . . ?
Cu27 Cu19 Cu3 113.79(5) . . ?
Cu26 Cu19 Cu3 115.41(5) . . ?
Cu10 Cu19 Cu20 123.61(5) . . ?
Cu9 Cu19 Cu20 151.64(6) . . ?
Cu11 Cu19 Cu20 58.70(4) . . ?
Cu7 Cu19 Cu20 61.76(4) . . ?
Cu23 Cu19 Cu20 57.83(3) . . ?
Cu27 Cu19 Cu20 89.30(5) . . ?
Cu26 Cu19 Cu20 144.68(5) . . ?
Cu3 Cu19 Cu20 93.64(5) . . ?
Cu10 Cu19 Cu22 119.42(5) . 2_666 ?
Cu9 Cu19 Cu22 144.06(6) . 2_666 ?
Cu11 Cu19 Cu22 89.85(5) . 2_666 ?
Cu7 Cu19 Cu22 109.85(5) . 2_666 ?
Cu23 Cu19 Cu22 57.70(3) . 2_666 ?
Cu27 Cu19 Cu22 57.38(4) . 2_666 ?
Cu26 Cu19 Cu22 86.34(5) . 2_666 ?
Cu3 Cu19 Cu22 150.38(5) . 2_666 ?
Cu20 Cu19 Cu22 59.96(4) . 2_666 ?
Cu10 Cu19 Cu21 119.01(6) . 2_666 ?
Cu9 Cu19 Cu21 89.72(5) . 2_666 ?
Cu11 Cu19 Cu21 144.02(5) . 2_666 ?
Cu7 Cu19 Cu21 109.90(5) . 2_666 ?
Cu23 Cu19 Cu21 57.59(3) . 2_666 ?
Cu27 Cu19 Cu21 86.65(5) . 2_666 ?
Cu26 Cu19 Cu21 57.02(4) . 2_666 ?
Cu3 Cu19 Cu21 152.58(5) . 2_666 ?
Cu20 Cu19 Cu21 105.19(5) . 2_666 ?
Cu22 Cu19 Cu21 56.04(4) 2_666 2_666 ?
Cu10 Cu19 Cu18 122.78(5) . . ?
Cu9 Cu19 Cu18 58.11(4) . . ?
Cu11 Cu19 Cu18 152.25(6) . . ?
Cu7 Cu19 Cu18 62.08(4) . . ?
Cu23 Cu19 Cu18 57.71(3) . . ?
Cu27 Cu19 Cu18 144.70(6) . . ?
Cu26 Cu19 Cu18 88.96(5) . . ?
Cu3 Cu19 Cu18 95.60(5) . . ?
Cu20 Cu19 Cu18 108.69(5) . . ?
Cu22 Cu19 Cu18 105.13(5) 2_666 . ?
Cu21 Cu19 Cu18 59.78(4) 2_666 . ?
Cu12 Cu20 Cu13 64.41(5) . . ?
Cu12 Cu20 Cu28 64.45(5) . . ?
Cu13 Cu20 Cu28 118.99(5) . . ?
Cu12 Cu20 Cu23 176.95(6) . . ?
Cu13 Cu20 Cu23 116.30(5) . . ?
Cu28 Cu20 Cu23 116.58(5) . . ?
Cu12 Cu20 Cu18 123.05(5) . 2_666 ?
Cu13 Cu20 Cu18 90.62(5) . 2_666 ?
Cu28 Cu20 Cu18 90.71(5) . 2_666 ?
Cu23 Cu20 Cu18 59.99(3) . 2_666 ?
Cu12 Cu20 Cu11 62.14(5) . . ?
Cu13 Cu20 Cu11 115.74(5) . . ?
Cu28 Cu20 Cu11 62.98(4) . . ?
Cu23 Cu20 Cu11 115.47(5) . . ?
Cu18 Cu20 Cu11 149.01(6) 2_666 . ?
Cu12 Cu20 Cu4 62.02(5) . . ?
Cu13 Cu20 Cu4 63.05(4) . . ?
Cu28 Cu20 Cu4 115.60(5) . . ?
Cu23 Cu20 Cu4 115.39(4) . . ?
Cu18 Cu20 Cu4 149.03(6) 2_666 . ?
Cu11 Cu20 Cu4 61.95(4) . . ?
Cu12 Cu20 Cu24 61.90(5) . 2_666 ?
Cu13 Cu20 Cu24 64.21(4) . 2_666 ?
Cu28 Cu20 Cu24 63.73(4) . 2_666 ?
Cu23 Cu20 Cu24 121.14(5) . 2_666 ?
Cu18 Cu20 Cu24 61.15(4) 2_666 2_666 ?
Cu11 Cu20 Cu24 114.27(5) . 2_666 ?
Cu4 Cu20 Cu24 114.53(5) . 2_666 ?
Cu12 Cu20 Cu7 119.27(6) . . ?
Cu13 Cu20 Cu7 89.92(5) . . ?
Cu28 Cu20 Cu7 144.56(5) . . ?
Cu23 Cu20 Cu7 58.09(3) . . ?
Cu18 Cu20 Cu7 110.28(5) 2_666 . ?
Cu11 Cu20 Cu7 86.96(5) . . ?
Cu4 Cu20 Cu7 57.31(4) . . ?
Cu24 Cu20 Cu7 151.47(5) 2_666 . ?
Cu12 Cu20 Cu19 119.44(5) . . ?
Cu13 Cu20 Cu19 144.39(5) . . ?
Cu28 Cu20 Cu19 90.15(5) . . ?
Cu23 Cu20 Cu19 58.10(3) . . ?
Cu18 Cu20 Cu19 110.30(5) 2_666 . ?
Cu11 Cu20 Cu19 57.37(4) . . ?
Cu4 Cu20 Cu19 86.86(5) . . ?
Cu24 Cu20 Cu19 151.17(5) 2_666 . ?
Cu7 Cu20 Cu19 56.32(4) . . ?
Cu12 Cu20 Cu22 123.11(5) . 2_666 ?
Cu13 Cu20 Cu22 151.58(6) . 2_666 ?
Cu28 Cu20 Cu22 58.73(4) . 2_666 ?
Cu23 Cu20 Cu22 57.85(3) . 2_666 ?
Cu18 Cu20 Cu22 61.88(4) 2_666 2_666 ?
Cu11 Cu20 Cu22 89.20(5) . 2_666 ?
Cu4 Cu20 Cu22 145.32(5) . 2_666 ?
Cu24 Cu20 Cu22 94.02(5) 2_666 2_666 ?
Cu7 Cu20 Cu22 105.64(4) . 2_666 ?
Cu19 Cu20 Cu22 60.16(4) . 2_666 ?
Cu12 Cu20 Cu21 122.84(6) . . ?
Cu13 Cu20 Cu21 58.50(4) . . ?
Cu28 Cu20 Cu21 151.66(6) . . ?
Cu23 Cu20 Cu21 57.80(3) . . ?
Cu18 Cu20 Cu21 61.93(4) 2_666 . ?
Cu11 Cu20 Cu21 145.32(5) . . ?
Cu4 Cu20 Cu21 89.16(5) . . ?
Cu24 Cu20 Cu21 94.37(5) 2_666 . ?
Cu7 Cu20 Cu21 60.07(4) . . ?
Cu19 Cu20 Cu21 105.56(4) . . ?
Cu22 Cu20 Cu21 108.74(5) 2_666 . ?
Cu14 Cu21 Cu26 64.37(5) . 2_666 ?
Cu14 Cu21 Cu5 64.52(5) . . ?
Cu26 Cu21 Cu5 119.24(5) 2_666 . ?
Cu14 Cu21 Cu23 176.88(5) . . ?
Cu26 Cu21 Cu23 116.35(5) 2_666 . ?
Cu5 Cu21 Cu23 116.51(5) . . ?
Cu14 Cu21 Cu22 123.19(5) . . ?
Cu26 Cu21 Cu22 90.70(5) 2_666 . ?
Cu5 Cu21 Cu22 91.05(5) . . ?
Cu23 Cu21 Cu22 59.92(3) . . ?
Cu14 Cu21 Cu25 62.13(5) . 2_666 ?
Cu26 Cu21 Cu25 63.14(4) 2_666 2_666 ?
Cu5 Cu21 Cu25 115.48(5) . 2_666 ?
Cu23 Cu21 Cu25 115.22(5) . 2_666 ?
Cu22 Cu21 Cu25 149.05(6) . 2_666 ?
Cu14 Cu21 Cu13 62.40(5) . . ?
Cu26 Cu21 Cu13 115.62(5) 2_666 . ?
Cu5 Cu21 Cu13 63.17(4) . . ?
Cu23 Cu21 Cu13 115.14(5) . . ?
Cu22 Cu21 Cu13 149.39(6) . . ?
Cu25 Cu21 Cu13 61.56(4) 2_666 . ?
Cu14 Cu21 Cu15 61.40(4) . . ?
Cu26 Cu21 Cu15 63.81(4) 2_666 . ?
Cu5 Cu21 Cu15 64.21(4) . . ?
Cu23 Cu21 Cu15 121.71(4) . . ?
Cu22 Cu21 Cu15 61.79(4) . . ?
Cu25 Cu21 Cu15 114.11(5) 2_666 . ?
Cu13 Cu21 Cu15 114.48(5) . . ?
Cu14 Cu21 Cu7 122.95(6) . . ?
Cu26 Cu21 Cu7 151.94(5) 2_666 . ?
Cu5 Cu21 Cu7 58.49(4) . . ?
Cu23 Cu21 Cu7 58.02(3) . . ?
Cu22 Cu21 Cu7 62.21(4) . . ?
Cu25 Cu21 Cu7 144.87(5) 2_666 . ?
Cu13 Cu21 Cu7 89.04(5) . . ?
Cu15 Cu21 Cu7 94.72(5) . . ?
Cu14 Cu21 Cu20 119.61(5) . . ?
Cu26 Cu21 Cu20 144.43(5) 2_666 . ?
Cu5 Cu21 Cu20 89.86(5) . . ?
Cu23 Cu21 Cu20 57.88(3) . . ?
Cu22 Cu21 Cu20 110.02(5) . . ?
Cu25 Cu21 Cu20 86.86(4) 2_666 . ?
Cu13 Cu21 Cu20 57.26(4) . . ?
Cu15 Cu21 Cu20 151.50(5) . . ?
Cu7 Cu21 Cu20 59.81(4) . . ?
Cu14 Cu21 Cu18 119.35(5) . 2_666 ?
Cu26 Cu21 Cu18 90.01(5) 2_666 2_666 ?
Cu5 Cu21 Cu18 144.16(5) . 2_666 ?
Cu23 Cu21 Cu18 57.95(3) . 2_666 ?
Cu22 Cu21 Cu18 110.10(5) . 2_666 ?
Cu25 Cu21 Cu18 57.27(4) 2_666 2_666 ?
Cu13 Cu21 Cu18 86.45(4) . 2_666 ?
Cu15 Cu21 Cu18 151.34(5) . 2_666 ?
Cu7 Cu21 Cu18 105.48(5) . 2_666 ?
Cu20 Cu21 Cu18 56.24(4) . 2_666 ?
Cu14 Cu21 Cu19 122.72(6) . 2_666 ?
Cu26 Cu21 Cu19 58.42(4) 2_666 2_666 ?
Cu5 Cu21 Cu19 151.93(5) . 2_666 ?
Cu23 Cu21 Cu19 57.93(3) . 2_666 ?
Cu22 Cu21 Cu19 61.85(4) . 2_666 ?
Cu25 Cu21 Cu19 89.13(5) 2_666 2_666 ?
Cu13 Cu21 Cu19 144.85(5) . 2_666 ?
Cu15 Cu21 Cu19 94.33(5) . 2_666 ?
Cu7 Cu21 Cu19 109.10(5) . 2_666 ?
Cu20 Cu21 Cu19 105.56(5) . 2_666 ?
Cu18 Cu21 Cu19 60.15(4) 2_666 2_666 ?
Cu16 Cu22 Cu6 64.47(5) . . ?
Cu16 Cu22 Cu27 64.37(5) . 2_666 ?
Cu6 Cu22 Cu27 119.12(5) . 2_666 ?
Cu16 Cu22 Cu23 177.00(6) . . ?
Cu6 Cu22 Cu23 116.52(5) . . ?
Cu27 Cu22 Cu23 116.33(5) 2_666 . ?
Cu16 Cu22 Cu21 123.11(6) . . ?
Cu6 Cu22 Cu21 90.68(5) . . ?
Cu27 Cu22 Cu21 90.91(5) 2_666 . ?
Cu23 Cu22 Cu21 59.88(3) . . ?
Cu16 Cu22 Cu17 62.19(5) . . ?
Cu6 Cu22 Cu17 63.16(5) . . ?
Cu27 Cu22 Cu17 115.50(5) 2_666 . ?
Cu23 Cu22 Cu17 115.45(5) . . ?
Cu21 Cu22 Cu17 149.10(6) . . ?
Cu16 Cu22 Cu28 62.30(5) . 2_666 ?
Cu6 Cu22 Cu28 115.60(5) . 2_666 ?
Cu27 Cu22 Cu28 63.28(4) 2_666 2_666 ?
Cu23 Cu22 Cu28 115.15(5) . 2_666 ?
Cu21 Cu22 Cu28 149.38(6) . 2_666 ?
Cu17 Cu22 Cu28 61.51(4) . 2_666 ?
Cu16 Cu22 Cu15 61.77(4) . . ?
Cu6 Cu22 Cu15 63.90(4) . . ?
Cu27 Cu22 Cu15 64.17(4) 2_666 . ?
Cu23 Cu22 Cu15 121.23(4) . . ?
Cu21 Cu22 Cu15 61.34(4) . . ?
Cu17 Cu22 Cu15 114.41(5) . . ?
Cu28 Cu22 Cu15 114.75(5) 2_666 . ?
Cu16 Cu22 Cu20 119.53(5) . 2_666 ?
Cu6 Cu22 Cu20 144.67(5) . 2_666 ?
Cu27 Cu22 Cu20 89.79(5) 2_666 2_666 ?
Cu23 Cu22 Cu20 57.89(3) . 2_666 ?
Cu21 Cu22 Cu20 109.99(5) . 2_666 ?
Cu17 Cu22 Cu20 87.02(5) . 2_666 ?
Cu28 Cu22 Cu20 57.26(4) 2_666 2_666 ?
Cu15 Cu22 Cu20 151.21(5) . 2_666 ?
Cu16 Cu22 Cu18 119.60(5) . . ?
Cu6 Cu22 Cu18 90.21(5) . . ?
Cu27 Cu22 Cu18 144.20(6) 2_666 . ?
Cu23 Cu22 Cu18 57.97(3) . . ?
Cu21 Cu22 Cu18 110.07(5) . . ?
Cu17 Cu22 Cu18 57.48(4) . . ?
Cu28 Cu22 Cu18 86.48(5) 2_666 . ?
Cu15 Cu22 Cu18 151.41(6) . . ?
Cu20 Cu22 Cu18 56.30(4) 2_666 . ?
Cu16 Cu22 Cu19 122.63(6) . 2_666 ?
Cu6 Cu22 Cu19 151.75(5) . 2_666 ?
Cu27 Cu22 Cu19 58.32(4) 2_666 2_666 ?
Cu23 Cu22 Cu19 58.01(3) . 2_666 ?
Cu21 Cu22 Cu19 62.11(4) . 2_666 ?
Cu17 Cu22 Cu19 145.06(6) . 2_666 ?
Cu28 Cu22 Cu19 89.12(5) 2_666 2_666 ?
Cu15 Cu22 Cu19 94.23(5) . 2_666 ?
Cu20 Cu22 Cu19 59.87(4) 2_666 2_666 ?
Cu18 Cu22 Cu19 105.55(5) . 2_666 ?
Cu16 Cu22 Cu7 123.10(6) . . ?
Cu6 Cu22 Cu7 58.68(4) . . ?
Cu27 Cu22 Cu7 151.70(5) 2_666 . ?
Cu23 Cu22 Cu7 57.84(3) . . ?
Cu21 Cu22 Cu7 61.71(4) . . ?
Cu17 Cu22 Cu7 89.39(5) . . ?
Cu28 Cu22 Cu7 144.96(5) 2_666 . ?
Cu15 Cu22 Cu7 94.17(5) . . ?
Cu20 Cu22 Cu7 105.57(5) 2_666 . ?
Cu18 Cu22 Cu7 60.20(4) . . ?
Cu19 Cu22 Cu7 108.92(4) 2_666 . ?
Cu21 Cu23 Cu21 180.00(4) . 2_666 ?
Cu21 Cu23 Cu22 119.80(3) . 2_666 ?
Cu21 Cu23 Cu22 60.19(3) 2_666 2_666 ?
Cu21 Cu23 Cu22 60.19(3) . . ?
Cu21 Cu23 Cu22 119.81(3) 2_666 . ?
Cu22 Cu23 Cu22 180.0 2_666 . ?
Cu21 Cu23 Cu20 64.32(3) . . ?
Cu21 Cu23 Cu20 115.68(3) 2_666 . ?
Cu22 Cu23 Cu20 64.25(3) 2_666 . ?
Cu22 Cu23 Cu20 115.74(3) . . ?
Cu21 Cu23 Cu20 115.68(3) . 2_666 ?
Cu21 Cu23 Cu20 64.33(3) 2_666 2_666 ?
Cu22 Cu23 Cu20 115.75(3) 2_666 2_666 ?
Cu22 Cu23 Cu20 64.26(3) . 2_666 ?
Cu20 Cu23 Cu20 180.0 . 2_666 ?
Cu21 Cu23 Cu18 64.33(3) . 2_666 ?
Cu21 Cu23 Cu18 115.67(3) 2_666 2_666 ?
Cu22 Cu23 Cu18 64.24(3) 2_666 2_666 ?
Cu22 Cu23 Cu18 115.76(3) . 2_666 ?
Cu20 Cu23 Cu18 60.18(3) . 2_666 ?
Cu20 Cu23 Cu18 119.82(3) 2_666 2_666 ?
Cu21 Cu23 Cu18 115.67(3) . . ?
Cu21 Cu23 Cu18 64.33(3) 2_666 . ?
Cu22 Cu23 Cu18 115.76(3) 2_666 . ?
Cu22 Cu23 Cu18 64.24(3) . . ?
Cu20 Cu23 Cu18 119.82(3) . . ?
Cu20 Cu23 Cu18 60.18(3) 2_666 . ?
Cu18 Cu23 Cu18 180.0 2_666 . ?
Cu21 Cu23 Cu7 115.79(3) . 2_666 ?
Cu21 Cu23 Cu7 64.21(3) 2_666 2_666 ?
Cu22 Cu23 Cu7 64.54(3) 2_666 2_666 ?
Cu22 Cu23 Cu7 115.47(3) . 2_666 ?
Cu20 Cu23 Cu7 116.00(3) . 2_666 ?
Cu20 Cu23 Cu7 64.00(3) 2_666 2_666 ?
Cu18 Cu23 Cu7 64.53(3) 2_666 2_666 ?
Cu18 Cu23 Cu7 115.47(3) . 2_666 ?
Cu21 Cu23 Cu7 64.21(3) . . ?
Cu21 Cu23 Cu7 115.79(3) 2_666 . ?
Cu22 Cu23 Cu7 115.46(3) 2_666 . ?
Cu22 Cu23 Cu7 64.54(3) . . ?
Cu20 Cu23 Cu7 64.00(3) . . ?
Cu20 Cu23 Cu7 116.01(3) 2_666 . ?
Cu18 Cu23 Cu7 115.47(3) 2_666 . ?
Cu18 Cu23 Cu7 64.53(3) . . ?
Cu7 Cu23 Cu7 180.0 2_666 . ?
Cu21 Cu23 Cu19 115.52(3) . . ?
Cu21 Cu23 Cu19 64.48(3) 2_666 . ?
Cu22 Cu23 Cu19 64.29(3) 2_666 . ?
Cu22 Cu23 Cu19 115.71(3) . . ?
Cu20 Cu23 Cu19 64.06(3) . . ?
Cu20 Cu23 Cu19 115.94(3) 2_666 . ?
Cu18 Cu23 Cu19 115.54(3) 2_666 . ?
Cu18 Cu23 Cu19 64.46(3) . . ?
Cu7 Cu23 Cu19 120.03(3) 2_666 . ?
Cu7 Cu23 Cu19 59.97(3) . . ?
Cu21 Cu23 Cu19 64.48(3) . 2_666 ?
Cu21 Cu23 Cu19 115.52(3) 2_666 2_666 ?
Cu22 Cu23 Cu19 115.71(3) 2_666 2_666 ?
Cu22 Cu23 Cu19 64.29(3) . 2_666 ?
Cu20 Cu23 Cu19 115.94(3) . 2_666 ?
Cu20 Cu23 Cu19 64.06(3) 2_666 2_666 ?
Cu18 Cu23 Cu19 64.46(3) 2_666 2_666 ?
Cu18 Cu23 Cu19 115.54(3) . 2_666 ?
Cu7 Cu23 Cu19 59.97(3) 2_666 2_666 ?
Cu7 Cu23 Cu19 120.03(3) . 2_666 ?
Cu19 Cu23 Cu19 180.0 . 2_666 ?
C1B Cu24 Cu8 93.7(2) . . ?
C1B Cu24 Cu12 97.9(2) . 2_666 ?
Cu8 Cu24 Cu12 168.37(6) . 2_666 ?
C1B Cu24 Cu18 149.4(2) . . ?
Cu8 Cu24 Cu18 55.73(4) . . ?
Cu12 Cu24 Cu18 112.65(5) 2_666 . ?
C1B Cu24 Cu20 153.2(2) . 2_666 ?
Cu8 Cu24 Cu20 112.96(5) . 2_666 ?
Cu12 Cu24 Cu20 55.42(4) 2_666 2_666 ?
Cu18 Cu24 Cu20 57.23(4) . 2_666 ?
C1B Cu24 Cu28 111.4(2) . 2_666 ?
Cu8 Cu24 Cu28 116.19(6) . 2_666 ?
Cu12 Cu24 Cu28 59.23(5) 2_666 2_666 ?
Cu18 Cu24 Cu28 83.94(4) . 2_666 ?
Cu20 Cu24 Cu28 55.66(4) 2_666 2_666 ?
C1B Cu24 Cu17 109.5(2) . . ?
Cu8 Cu24 Cu17 59.55(5) . . ?
Cu12 Cu24 Cu17 115.83(6) 2_666 . ?
Cu18 Cu24 Cu17 55.74(4) . . ?
Cu20 Cu24 Cu17 83.74(4) 2_666 . ?
Cu28 Cu24 Cu17 56.89(4) 2_666 . ?
C1B Cu24 Cu13 115.9(2) . 2_666 ?
Cu8 Cu24 Cu13 115.54(6) . 2_666 ?
Cu12 Cu24 Cu13 58.93(4) 2_666 2_666 ?
Cu18 Cu24 Cu13 83.47(4) . 2_666 ?
Cu20 Cu24 Cu13 55.39(4) 2_666 2_666 ?
Cu28 Cu24 Cu13 104.46(5) 2_666 2_666 ?
Cu17 Cu24 Cu13 134.64(5) . 2_666 ?
C1B Cu24 Cu25 114.0(2) . . ?
Cu8 Cu24 Cu25 59.34(5) . . ?
Cu12 Cu24 Cu25 115.10(5) 2_666 . ?
Cu18 Cu24 Cu25 55.38(4) . . ?
Cu20 Cu24 Cu25 83.30(4) 2_666 . ?
Cu28 Cu24 Cu25 134.62(5) 2_666 . ?
Cu17 Cu24 Cu25 104.75(5) . . ?
Cu13 Cu24 Cu25 56.43(4) 2_666 . ?
Cu18 Cu25 Cu21 64.44(4) . 2_666 ?
Cu18 Cu25 Cu14 121.97(6) . 2_666 ?
Cu21 Cu25 Cu14 57.59(4) 2_666 2_666 ?
Cu18 Cu25 Cu13 89.16(5) . 2_666 ?
Cu21 Cu25 Cu13 59.37(4) 2_666 2_666 ?
Cu14 Cu25 Cu13 60.13(5) 2_666 2_666 ?
Cu18 Cu25 Cu26 91.10(5) . . ?
Cu21 Cu25 Cu26 57.86(4) 2_666 . ?
Cu14 Cu25 Cu26 60.93(5) 2_666 . ?
Cu13 Cu25 Cu26 109.30(5) 2_666 . ?
Cu18 Cu25 Cu9 58.70(4) . . ?
Cu21 Cu25 Cu9 90.00(5) 2_666 . ?
Cu14 Cu25 Cu9 121.21(6) 2_666 . ?
Cu13 Cu25 Cu9 144.04(6) 2_666 . ?
Cu26 Cu25 Cu9 60.28(4) . . ?
Cu18 Cu25 Cu8 56.73(4) . . ?
Cu21 Cu25 Cu8 121.11(6) 2_666 . ?
Cu14 Cu25 Cu8 178.70(7) 2_666 . ?
Cu13 Cu25 Cu8 119.36(6) 2_666 . ?
Cu26 Cu25 Cu8 118.65(6) . . ?
Cu9 Cu25 Cu8 58.37(5) . . ?
Cu18 Cu25 Cu24 60.02(4) . . ?
Cu21 Cu25 Cu24 95.43(5) 2_666 . ?
Cu14 Cu25 Cu24 121.63(6) 2_666 . ?
Cu13 Cu25 Cu24 61.64(4) 2_666 . ?
Cu26 Cu25 Cu24 148.43(6) . . ?
Cu9 Cu25 Cu24 107.74(5) . . ?
Cu8 Cu25 Cu24 57.96(5) . . ?
Cu21 Cu26 Cu19 64.56(4) 2_666 . ?
Cu21 Cu26 Cu10 121.97(6) 2_666 . ?
Cu19 Cu26 Cu10 57.47(4) . . ?
Cu21 Cu26 Cu27 89.49(5) 2_666 . ?
Cu19 Cu26 Cu27 59.16(4) . . ?
Cu10 Cu26 Cu27 59.79(5) . . ?
Cu21 Cu26 Cu25 59.00(4) 2_666 . ?
Cu19 Cu26 Cu25 90.25(5) . . ?
Cu10 Cu26 Cu25 120.96(6) . . ?
Cu27 Cu26 Cu25 144.45(6) . . ?
Cu21 Cu26 Cu14 57.09(4) 2_666 2_666 ?
Cu19 Cu26 Cu14 121.59(5) . 2_666 ?
Cu10 Cu26 Cu14 179.02(6) . 2_666 ?
Cu27 Cu26 Cu14 120.11(6) . 2_666 ?
Cu25 Cu26 Cu14 58.46(4) . 2_666 ?
Cu21 Cu26 Cu9 90.49(5) 2_666 . ?
Cu19 Cu26 Cu9 57.33(4) . . ?
Cu10 Cu26 Cu9 60.97(5) . . ?
Cu27 Cu26 Cu9 108.71(6) . . ?
Cu25 Cu26 Cu9 59.99(4) . . ?
Cu14 Cu26 Cu9 118.45(6) 2_666 . ?
Cu21 Cu26 Cu15 60.71(4) 2_666 2_666 ?
Cu19 Cu26 Cu15 96.07(5) . 2_666 ?
Cu10 Cu26 Cu15 121.76(6) . 2_666 ?
Cu27 Cu26 Cu15 62.15(4) . 2_666 ?
Cu25 Cu26 Cu15 108.40(5) . 2_666 ?
Cu14 Cu26 Cu15 58.25(4) 2_666 2_666 ?
Cu9 Cu26 Cu15 148.51(5) . 2_666 ?
Cu22 Cu27 Cu19 64.30(4) 2_666 . ?
Cu22 Cu27 Cu10 121.70(5) 2_666 . ?
Cu19 Cu27 Cu10 57.49(4) . . ?
Cu22 Cu27 Cu26 88.89(5) 2_666 . ?
Cu19 Cu27 Cu26 59.30(4) . . ?
Cu10 Cu27 Cu26 59.74(5) . . ?
Cu22 Cu27 Cu11 91.00(5) 2_666 . ?
Cu19 Cu27 Cu11 58.03(4) . . ?
Cu10 Cu27 Cu11 61.58(5) . . ?
Cu26 Cu27 Cu11 109.55(5) . . ?
Cu22 Cu27 Cu16 56.99(4) 2_666 2_666 ?
Cu19 Cu27 Cu16 121.24(6) . 2_666 ?
Cu10 Cu27 Cu16 178.61(6) . 2_666 ?
Cu26 Cu27 Cu16 119.31(6) . 2_666 ?
Cu11 Cu27 Cu16 118.46(6) . 2_666 ?
Cu22 Cu27 Cu28 59.07(4) 2_666 . ?
Cu19 Cu27 Cu28 90.09(5) . . ?
Cu10 Cu27 Cu28 121.47(6) . . ?
Cu26 Cu27 Cu28 144.12(5) . . ?
Cu11 Cu27 Cu28 59.90(4) . . ?
Cu16 Cu27 Cu28 58.57(5) 2_666 . ?
Cu22 Cu27 Cu15 60.54(4) 2_666 2_666 ?
Cu19 Cu27 Cu15 95.54(5) . 2_666 ?
Cu10 Cu27 Cu15 120.75(6) . 2_666 ?
Cu26 Cu27 Cu15 61.19(4) . 2_666 ?
Cu11 Cu27 Cu15 148.84(5) . 2_666 ?
Cu16 Cu27 Cu15 58.40(4) 2_666 2_666 ?
Cu28 Cu27 Cu15 108.55(5) . 2_666 ?
Cu20 Cu28 Cu22 64.01(4) . 2_666 ?
Cu20 Cu28 Cu16 121.25(5) . 2_666 ?
Cu22 Cu28 Cu16 57.27(4) 2_666 2_666 ?
Cu20 Cu28 Cu17 89.39(5) . 2_666 ?
Cu22 Cu28 Cu17 59.04(4) 2_666 2_666 ?
Cu16 Cu28 Cu17 59.66(5) 2_666 2_666 ?
Cu20 Cu28 Cu11 59.23(4) . . ?
Cu22 Cu28 Cu11 90.05(5) 2_666 . ?
Cu16 Cu28 Cu11 120.36(6) 2_666 . ?
Cu17 Cu28 Cu11 144.43(5) 2_666 . ?
Cu20 Cu28 Cu12 56.76(4) . . ?
Cu22 Cu28 Cu12 120.71(5) 2_666 . ?
Cu16 Cu28 Cu12 177.93(6) 2_666 . ?
Cu17 Cu28 Cu12 120.09(6) 2_666 . ?
Cu11 Cu28 Cu12 58.47(5) . . ?
Cu20 Cu28 Cu27 90.44(5) . . ?
Cu22 Cu28 Cu27 57.65(4) 2_666 . ?
Cu16 Cu28 Cu27 60.65(5) 2_666 . ?
Cu17 Cu28 Cu27 108.66(6) 2_666 . ?
Cu11 Cu28 Cu27 59.72(4) . . ?
Cu12 Cu28 Cu27 118.16(6) . . ?
Cu20 Cu28 Cu24 60.61(4) . 2_666 ?
Cu22 Cu28 Cu24 95.25(5) 2_666 2_666 ?
Cu16 Cu28 Cu24 121.36(6) 2_666 2_666 ?
Cu17 Cu28 Cu24 61.82(4) 2_666 2_666 ?
Cu11 Cu28 Cu24 108.82(5) . 2_666 ?
Cu12 Cu28 Cu24 58.58(5) . 2_666 ?
Cu27 Cu28 Cu24 148.22(5) . 2_666 ?
C3 N1 C1 112.4(7) . . ?
C3 N1 C16 121.9(7) . . ?
C1 N1 C16 125.7(6) . . ?
C2 N2 C1 113.3(7) . . ?
C2 N2 C4 123.0(7) . . ?
C1 N2 C4 123.7(6) . . ?
N2 C1 N1 100.8(6) . . ?
N2 C1 Cu3 129.7(5) . . ?
N1 C1 Cu3 129.6(5) . . ?
C3 C2 N2 105.2(8) . . ?
C3 C2 H2 127.4 . . ?
N2 C2 H2 127.4 . . ?
C2 C3 N1 108.3(8) . . ?
C2 C3 H3 125.9 . . ?
N1 C3 H3 125.9 . . ?
C5 C4 C9 121.4(8) . . ?
C5 C4 N2 119.5(7) . . ?
C9 C4 N2 118.8(7) . . ?
C6 C5 C4 116.4(8) . . ?
C6 C5 C10 121.9(8) . . ?
C4 C5 C10 121.6(8) . . ?
C7 C6 C5 123.5(9) . . ?
C7 C6 H6 118.3 . . ?
C5 C6 H6 118.3 . . ?
C6 C7 C8 119.5(9) . . ?
C6 C7 H7 120.3 . . ?
C8 C7 H7 120.3 . . ?
C9 C8 C7 120.3(9) . . ?
C9 C8 H8 119.9 . . ?
C7 C8 H8 119.9 . . ?
C8 C9 C4 118.7(8) . . ?
C8 C9 C13 120.1(8) . . ?
C4 C9 C13 121.2(8) . . ?
C11 C10 C5 114.8(8) . . ?
C11 C10 C12 107.5(8) . . ?
C5 C10 C12 109.9(8) . . ?
C11 C10 H10 108.2 . . ?
C5 C10 H10 108.2 . . ?
C12 C10 H10 108.2 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C15 C13 C9 109.0(9) . . ?
C15 C13 C14 108.5(9) . . ?
C9 C13 C14 111.2(10) . . ?
C15 C13 H13 109.4 . . ?
C9 C13 H13 109.4 . . ?
C14 C13 H13 109.4 . . ?
C13 C14 H14A 109.5 . . ?
C13 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C13 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C13 C15 H15A 109.5 . . ?
C13 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C13 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C17 C16 C21 124.2(8) . . ?
C17 C16 N1 117.7(7) . . ?
C21 C16 N1 118.1(7) . . ?
C18 C17 C16 117.6(8) . . ?
C18 C17 C22 117.7(7) . . ?
C16 C17 C22 124.6(8) . . ?
C17 C18 C19 119.6(8) . . ?
C17 C18 H18 120.2 . . ?
C19 C18 H18 120.2 . . ?
C20 C19 C18 120.9(9) . . ?
C20 C19 H19 119.5 . . ?
C18 C19 H19 119.5 . . ?
C19 C20 C21 122.1(9) . . ?
C19 C20 H20 118.9 . . ?
C21 C20 H20 118.9 . . ?
C20 C21 C16 115.4(8) . . ?
C20 C21 C25 121.8(8) . . ?
C16 C21 C25 122.6(8) . . ?
C17 C22 C24 112.6(9) . . ?
C17 C22 C23 112.6(9) . . ?
C24 C22 C23 108.2(8) . . ?
C17 C22 H22 107.8 . . ?
C24 C22 H22 107.8 . . ?
C23 C22 H22 107.8 . . ?
C22 C23 H23A 109.5 . . ?
C22 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C22 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C22 C24 H24A 109.5 . . ?
C22 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C22 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C21 C25 C26 114.6(9) . . ?
C21 C25 C27 111.5(8) . . ?
C26 C25 C27 107.2(8) . . ?
C21 C25 H25 107.7 . . ?
C26 C25 H25 107.7 . . ?
C27 C25 H25 107.7 . . ?
C25 C26 H26A 109.5 . . ?
C25 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C25 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C25 C27 H27A 109.5 . . ?
C25 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
C25 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
C2A N1A C1A 110.3(7) . . ?
C2A N1A C4A 122.7(7) . . ?
C1A N1A C4A 126.8(7) . . ?
C1A N2A C3A 111.2(7) . . ?
C1A N2A C16A 127.8(6) . . ?
C3A N2A C16A 120.8(7) . . ?
N2A C1A N1A 102.7(6) . . ?
N2A C1A Cu15 130.1(6) . . ?
N1A C1A Cu15 127.1(6) . . ?
C3A C2A N1A 108.8(8) . . ?
C3A C2A H2A 125.6 . . ?
N1A C2A H2A 125.6 . . ?
C2A C3A N2A 106.9(8) . . ?
C2A C3A H3A 126.6 . . ?
N2A C3A H3A 126.6 . . ?
C5A C4A C9A 121.6(8) . . ?
C5A C4A N1A 120.7(8) . . ?
C9A C4A N1A 117.0(8) . . ?
C6A C5A C4A 118.7(9) . . ?
C6A C5A C10A 120.0(9) . . ?
C4A C5A C10A 120.8(8) . . ?
C5A C6A C7A 120.0(10) . . ?
C5A C6A H6A 120.0 . . ?
C7A C6A H6A 120.0 . . ?
C6A C7A C8A 121.4(10) . . ?
C6A C7A H7A 119.3 . . ?
C8A C7A H7A 119.3 . . ?
C9A C8A C7A 121.6(11) . . ?
C9A C8A H8A 119.2 . . ?
C7A C8A H8A 119.2 . . ?
C8A C9A C4A 116.5(10) . . ?
C8A C9A C13A 122.7(11) . . ?
C4A C9A C13A 120.8(9) . . ?
C11A C10A C12A 111.5(14) . . ?
C11A C10A C5A 115.7(12) . . ?
C12A C10A C5A 101.1(13) . . ?
C11A C10A H10A 109.4 . . ?
C12A C10A H10A 109.4 . . ?
C5A C10A H10A 109.4 . . ?
C10A C11A H11D 109.5 . . ?
C10A C11A H11E 109.5 . . ?
H11D C11A H11E 109.5 . . ?
C10A C11A H11F 109.5 . . ?
H11D C11A H11F 109.5 . . ?
H11E C11A H11F 109.5 . . ?
C10A C12A H12D 109.5 . . ?
C10A C12A H12E 109.5 . . ?
H12D C12A H12E 109.5 . . ?
C10A C12A H12F 109.5 . . ?
H12D C12A H12F 109.5 . . ?
H12E C12A H12F 109.5 . . ?
C14A C13A C9A 111.9(12) . . ?
C14A C13A C15A 112.1(10) . . ?
C9A C13A C15A 109.2(10) . . ?
C14A C13A H13A 107.8 . . ?
C9A C13A H13A 107.8 . . ?
C15A C13A H13A 107.8 . . ?
C13A C14A H14D 109.5 . . ?
C13A C14A H14E 109.5 . . ?
H14D C14A H14E 109.5 . . ?
C13A C14A H14F 109.5 . . ?
H14D C14A H14F 109.5 . . ?
H14E C14A H14F 109.5 . . ?
C13A C15A H15D 109.5 . . ?
C13A C15A H15E 109.5 . . ?
H15D C15A H15E 109.5 . . ?
C13A C15A H15F 109.5 . . ?
H15D C15A H15F 109.5 . . ?
H15E C15A H15F 109.5 . . ?
C21A C16A C17A 122.0(7) . . ?
C21A C16A N2A 120.2(7) . . ?
C17A C16A N2A 117.1(7) . . ?
C18A C17A C16A 117.0(7) . . ?
C18A C17A C22A 122.9(9) . . ?
C16A C17A C22A 120.1(8) . . ?
C17A C18A C19A 121.3(9) . . ?
C17A C18A H18A 119.3 . . ?
C19A C18A H18A 119.3 . . ?
C20A C19A C18A 120.8(8) . . ?
C20A C19A H19A 119.6 . . ?
C18A C19A H19A 119.6 . . ?
C19A C20A C21A 119.7(8) . . ?
C19A C20A H20A 120.1 . . ?
C21A C20A H20A 120.1 . . ?
C16A C21A C20A 119.1(8) . . ?
C16A C21A C25A 122.7(8) . . ?
C20A C21A C25A 118.2(8) . . ?
C17A C22A C23A 111.0(10) . . ?
C17A C22A C24A 109.0(11) . . ?
C23A C22A C24A 111.5(11) . . ?
C17A C22A H22A 108.4 . . ?
C23A C22A H22A 108.4 . . ?
C24A C22A H22A 108.4 . . ?
C22A C23A H23D 109.5 . . ?
C22A C23A H23E 109.5 . . ?
H23D C23A H23E 109.5 . . ?
C22A C23A H23F 109.5 . . ?
H23D C23A H23F 109.5 . . ?
H23E C23A H23F 109.5 . . ?
C22A C24A H24D 109.5 . . ?
C22A C24A H24E 109.5 . . ?
H24D C24A H24E 109.5 . . ?
C22A C24A H24F 109.5 . . ?
H24D C24A H24F 109.5 . . ?
H24E C24A H24F 109.5 . . ?
C26A C25A C21A 113.7(9) . . ?
C26A C25A C27A 110.2(10) . . ?
C21A C25A C27A 108.1(9) . . ?
C26A C25A H25A 108.2 . . ?
C21A C25A H25A 108.2 . . ?
C27A C25A H25A 108.2 . . ?
C25A C26A H26D 109.5 . . ?
C25A C26A H26E 109.5 . . ?
H26D C26A H26E 109.5 . . ?
C25A C26A H26F 109.5 . . ?
H26D C26A H26F 109.5 . . ?
H26E C26A H26F 109.5 . . ?
C25A C27A H27D 109.5 . . ?
C25A C27A H27E 109.5 . . ?
H27D C27A H27E 109.5 . . ?
C25A C27A H27F 109.5 . . ?
H27D C27A H27F 109.5 . . ?
H27E C27A H27F 109.5 . . ?
C2B N1B C1B 111.4(7) . . ?
C2B N1B C4B 121.8(6) . . ?
C1B N1B C4B 126.8(6) . . ?
C1B N2B C3B 111.7(7) . . ?
C1B N2B C16B 125.8(6) . . ?
C3B N2B C16B 122.5(7) . . ?
N2B C1B N1B 102.1(6) . . ?
N2B C1B Cu24 129.3(6) . . ?
N1B C1B Cu24 128.6(6) . . ?
C3B C2B N1B 107.6(7) . . ?
C3B C2B H2B 126.2 . . ?
N1B C2B H2B 126.2 . . ?
C2B C3B N2B 107.1(8) . . ?
C2B C3B H3B 126.5 . . ?
N2B C3B H3B 126.5 . . ?
C9B C4B C5B 124.0(8) . . ?
C9B C4B N1B 116.9(8) . . ?
C5B C4B N1B 118.6(8) . . ?
C6B C5B C4B 118.0(10) . . ?
C6B C5B C10B 120.9(10) . . ?
C4B C5B C10B 120.8(8) . . ?
C7B C6B C5B 121.1(12) . . ?
C7B C6B H6B 119.4 . . ?
C5B C6B H6B 119.4 . . ?
C6B C7B C8B 119.9(11) . . ?
C6B C7B H7B 120.1 . . ?
C8B C7B H7B 120.1 . . ?
C7B C8B C9B 121.9(12) . . ?
C7B C8B H8B 119.1 . . ?
C9B C8B H8B 119.1 . . ?
C4B C9B C8B 115.0(10) . . ?
C4B C9B C13B 125.2(10) . . ?
C8B C9B C13B 119.7(11) . . ?
C12B C10B C11B 108.2(11) . . ?
C12B C10B C5B 108.9(13) . . ?
C11B C10B C5B 112.4(10) . . ?
C12B C10B H10B 109.1 . . ?
C11B C10B H10B 109.1 . . ?
C5B C10B H10B 109.1 . . ?
C10B C11B H11G 109.5 . . ?
C10B C11B H11H 109.5 . . ?
H11G C11B H11H 109.5 . . ?
C10B C11B H11I 109.5 . . ?
H11G C11B H11I 109.5 . . ?
H11H C11B H11I 109.5 . . ?
C10B C12B H12G 109.5 . . ?
C10B C12B H12H 109.5 . . ?
H12G C12B H12H 109.5 . . ?
C10B C12B H12I 109.5 . . ?
H12G C12B H12I 109.5 . . ?
H12H C12B H12I 109.5 . . ?
C9B C13B C14B 113.6(10) . . ?
C9B C13B C15B 112.1(14) . . ?
C14B C13B C15B 109.5(12) . . ?
C9B C13B H13B 107.1 . . ?
C14B C13B H13B 107.1 . . ?
C15B C13B H13B 107.1 . . ?
C13B C14B H14G 109.5 . . ?
C13B C14B H14H 109.5 . . ?
H14G C14B H14H 109.5 . . ?
C13B C14B H14I 109.5 . . ?
H14G C14B H14I 109.5 . . ?
H14H C14B H14I 109.5 . . ?
C13B C15B H15G 109.5 . . ?
C13B C15B H15H 109.5 . . ?
H15G C15B H15H 109.5 . . ?
C13B C15B H15I 109.5 . . ?
H15G C15B H15I 109.5 . . ?
H15H C15B H15I 109.5 . . ?
C21B C16B C17B 122.9(8) . . ?
C21B C16B N2B 118.6(7) . . ?
C17B C16B N2B 118.3(8) . . ?
C18B C17B C16B 116.8(10) . . ?
C18B C17B C22B 119.8(10) . . ?
C16B C17B C22B 123.3(9) . . ?
C17B C18B C19B 120.7(10) . . ?
C17B C18B H18B 119.7 . . ?
C19B C18B H18B 119.7 . . ?
C20B C19B C18B 120.2(9) . . ?
C20B C19B H19B 119.9 . . ?
C18B C19B H19B 119.9 . . ?
C21B C20B C19B 120.7(10) . . ?
C21B C20B H20B 119.6 . . ?
C19B C20B H20B 119.6 . . ?
C20B C21B C16B 118.7(9) . . ?
C20B C21B C25B 120.4(9) . . ?
C16B C21B C25B 120.9(8) . . ?
C23B C22B C17B 115.1(12) . . ?
C23B C22B C24B 110.6(11) . . ?
C17B C22B C24B 109.2(12) . . ?
C23B C22B H22B 107.2 . . ?
C17B C22B H22B 107.2 . . ?
C24B C22B H22B 107.2 . . ?
C22B C23B H23G 109.5 . . ?
C22B C23B H23H 109.5 . . ?
H23G C23B H23H 109.5 . . ?
C22B C23B H23I 109.5 . . ?
H23G C23B H23I 109.5 . . ?
H23H C23B H23I 109.5 . . ?
C22B C24B H24G 109.5 . . ?
C22B C24B H24H 109.5 . . ?
H24G C24B H24H 109.5 . . ?
C22B C24B H24I 109.5 . . ?
H24G C24B H24I 109.5 . . ?
H24H C24B H24I 109.5 . . ?
C26B C25B C21B 113.8(9) . . ?
C26B C25B C27B 111.3(9) . . ?
C21B C25B C27B 108.9(8) . . ?
C26B C25B H25B 107.5 . . ?
C21B C25B H25B 107.5 . . ?
C27B C25B H25B 107.5 . . ?
C25B C26B H26G 109.5 . . ?
C25B C26B H26H 109.5 . . ?
H26G C26B H26H 109.5 . . ?
C25B C26B H26I 109.5 . . ?
H26G C26B H26I 109.5 . . ?
H26H C26B H26I 109.5 . . ?
C25B C27B H27G 109.5 . . ?
C25B C27B H27H 109.5 . . ?
H27G C27B H27H 109.5 . . ?
C25B C27B H27I 109.5 . . ?
H27G C27B H27I 109.5 . . ?
H27H C27B H27I 109.5 . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C2 N2 C1 N1 -1.5(8) . . . . ?
C4 N2 C1 N1 -179.4(7) . . . . ?
C2 N2 C1 Cu3 177.8(6) . . . . ?
C4 N2 C1 Cu3 -0.1(11) . . . . ?
C3 N1 C1 N2 2.0(8) . . . . ?
C16 N1 C1 N2 180.0(7) . . . . ?
C3 N1 C1 Cu3 -177.3(6) . . . . ?
C16 N1 C1 Cu3 0.7(11) . . . . ?
C1 N2 C2 C3 0.5(10) . . . . ?
C4 N2 C2 C3 178.4(8) . . . . ?
N2 C2 C3 N1 0.8(11) . . . . ?
C1 N1 C3 C2 -1.9(11) . . . . ?
C16 N1 C3 C2 -179.9(7) . . . . ?
C2 N2 C4 C5 104.0(10) . . . . ?
C1 N2 C4 C5 -78.3(10) . . . . ?
C2 N2 C4 C9 -70.6(10) . . . . ?
C1 N2 C4 C9 107.1(9) . . . . ?
C9 C4 C5 C6 -4.9(13) . . . . ?
N2 C4 C5 C6 -179.3(8) . . . . ?
C9 C4 C5 C10 172.5(8) . . . . ?
N2 C4 C5 C10 -2.0(12) . . . . ?
C4 C5 C6 C7 4.3(16) . . . . ?
C10 C5 C6 C7 -173.0(10) . . . . ?
C5 C6 C7 C8 -0.4(18) . . . . ?
C6 C7 C8 C9 -3.1(16) . . . . ?
C7 C8 C9 C4 2.5(14) . . . . ?
C7 C8 C9 C13 -177.6(10) . . . . ?
C5 C4 C9 C8 1.6(13) . . . . ?
N2 C4 C9 C8 176.1(8) . . . . ?
C5 C4 C9 C13 -178.3(9) . . . . ?
N2 C4 C9 C13 -3.9(12) . . . . ?
C6 C5 C10 C11 -19.8(14) . . . . ?
C4 C5 C10 C11 163.1(8) . . . . ?
C6 C5 C10 C12 101.5(11) . . . . ?
C4 C5 C10 C12 -75.6(11) . . . . ?
C8 C9 C13 C15 -65.5(14) . . . . ?
C4 C9 C13 C15 114.5(11) . . . . ?
C8 C9 C13 C14 54.1(13) . . . . ?
C4 C9 C13 C14 -125.9(10) . . . . ?
C3 N1 C16 C17 71.4(10) . . . . ?
C1 N1 C16 C17 -106.4(9) . . . . ?
C3 N1 C16 C21 -105.1(9) . . . . ?
C1 N1 C16 C21 77.1(9) . . . . ?
C21 C16 C17 C18 0.4(12) . . . . ?
N1 C16 C17 C18 -175.9(7) . . . . ?
C21 C16 C17 C22 -179.4(8) . . . . ?
N1 C16 C17 C22 4.3(12) . . . . ?
C16 C17 C18 C19 -2.9(13) . . . . ?
C22 C17 C18 C19 176.9(9) . . . . ?
C17 C18 C19 C20 2.2(14) . . . . ?
C18 C19 C20 C21 1.1(16) . . . . ?
C19 C20 C21 C16 -3.5(14) . . . . ?
C19 C20 C21 C25 171.7(9) . . . . ?
C17 C16 C21 C20 2.7(12) . . . . ?
N1 C16 C21 C20 179.0(8) . . . . ?
C17 C16 C21 C25 -172.4(8) . . . . ?
N1 C16 C21 C25 3.9(11) . . . . ?
C18 C17 C22 C24 66.3(11) . . . . ?
C16 C17 C22 C24 -113.9(10) . . . . ?
C18 C17 C22 C23 -56.3(12) . . . . ?
C16 C17 C22 C23 123.5(10) . . . . ?
C20 C21 C25 C26 20.4(13) . . . . ?
C16 C21 C25 C26 -164.8(8) . . . . ?
C20 C21 C25 C27 -101.7(11) . . . . ?
C16 C21 C25 C27 73.1(12) . . . . ?
C3A N2A C1A N1A 3.4(11) . . . . ?
C16A N2A C1A N1A 178.6(8) . . . . ?
C3A N2A C1A Cu15 179.7(8) . . . . ?
C16A N2A C1A Cu15 -5.1(14) . . . . ?
C2A N1A C1A N2A -3.0(11) . . . . ?
C4A N1A C1A N2A -179.8(8) . . . . ?
C2A N1A C1A Cu15 -179.5(8) . . . . ?
C4A N1A C1A Cu15 3.7(14) . . . . ?
C1A N1A C2A C3A 1.6(14) . . . . ?
C4A N1A C2A C3A 178.5(10) . . . . ?
N1A C2A C3A N2A 0.5(14) . . . . ?
C1A N2A C3A C2A -2.6(13) . . . . ?
C16A N2A C3A C2A -178.2(10) . . . . ?
C2A N1A C4A C5A -86.3(13) . . . . ?
C1A N1A C4A C5A 90.0(12) . . . . ?
C2A N1A C4A C9A 84.1(12) . . . . ?
C1A N1A C4A C9A -99.5(11) . . . . ?
C9A C4A C5A C6A 5.6(15) . . . . ?
N1A C4A C5A C6A 175.6(9) . . . . ?
C9A C4A C5A C10A 177.3(10) . . . . ?
N1A C4A C5A C10A -12.7(14) . . . . ?
C4A C5A C6A C7A -5.9(18) . . . . ?
C10A C5A C6A C7A -177.7(12) . . . . ?
C5A C6A C7A C8A 3(2) . . . . ?
C6A C7A C8A C9A 0(2) . . . . ?
C7A C8A C9A C4A -0.3(18) . . . . ?
C7A C8A C9A C13A -178.7(12) . . . . ?
C5A C4A C9A C8A -2.4(14) . . . . ?
N1A C4A C9A C8A -172.8(9) . . . . ?
C5A C4A C9A C13A 176.0(10) . . . . ?
N1A C4A C9A C13A 5.6(13) . . . . ?
C6A C5A C10A C11A 23.5(17) . . . . ?
C4A C5A C10A C11A -148.2(11) . . . . ?
C6A C5A C10A C12A -97.2(15) . . . . ?
C4A C5A C10A C12A 91.2(14) . . . . ?
C8A C9A C13A C14A -42.1(15) . . . . ?
C4A C9A C13A C14A 139.6(10) . . . . ?
C8A C9A C13A C15A 82.7(15) . . . . ?
C4A C9A C13A C15A -95.6(12) . . . . ?
C1A N2A C16A C21A -92.3(11) . . . . ?
C3A N2A C16A C21A 82.5(11) . . . . ?
C1A N2A C16A C17A 96.8(11) . . . . ?
C3A N2A C16A C17A -88.4(11) . . . . ?
C21A C16A C17A C18A 0.5(13) . . . . ?
N2A C16A C17A C18A 171.1(8) . . . . ?
C21A C16A C17A C22A -178.9(9) . . . . ?
N2A C16A C17A C22A -8.2(13) . . . . ?
C16A C17A C18A C19A -0.2(14) . . . . ?
C22A C17A C18A C19A 179.2(10) . . . . ?
C17A C18A C19A C20A -0.1(15) . . . . ?
C18A C19A C20A C21A 0.1(15) . . . . ?
C17A C16A C21A C20A -0.5(13) . . . . ?
N2A C16A C21A C20A -170.9(8) . . . . ?
C17A C16A C21A C25A -179.6(8) . . . . ?
N2A C16A C21A C25A 10.0(12) . . . . ?
C19A C20A C21A C16A 0.2(14) . . . . ?
C19A C20A C21A C25A 179.4(9) . . . . ?
C18A C17A C22A C23A 39.4(14) . . . . ?
C16A C17A C22A C23A -141.2(9) . . . . ?
C18A C17A C22A C24A -83.8(15) . . . . ?
C16A C17A C22A C24A 95.6(12) . . . . ?
C16A C21A C25A C26A 140.0(10) . . . . ?
C20A C21A C25A C26A -39.1(12) . . . . ?
C16A C21A C25A C27A -97.3(11) . . . . ?
C20A C21A C25A C27A 83.6(12) . . . . ?
C3B N2B C1B N1B -2.5(10) . . . . ?
C16B N2B C1B N1B 178.1(7) . . . . ?
C3B N2B C1B Cu24 177.5(7) . . . . ?
C16B N2B C1B Cu24 -1.9(12) . . . . ?
C2B N1B C1B N2B 2.7(10) . . . . ?
C4B N1B C1B N2B -177.3(8) . . . . ?
C2B N1B C1B Cu24 -177.3(7) . . . . ?
C4B N1B C1B Cu24 2.7(12) . . . . ?
C1B N1B C2B C3B -2.0(12) . . . . ?
C4B N1B C2B C3B 178.0(9) . . . . ?
N1B C2B C3B N2B 0.4(13) . . . . ?
C1B N2B C3B C2B 1.4(13) . . . . ?
C16B N2B C3B C2B -179.2(9) . . . . ?
C2B N1B C4B C9B 78.5(11) . . . . ?
C1B N1B C4B C9B -101.4(10) . . . . ?
C2B N1B C4B C5B -93.7(11) . . . . ?
C1B N1B C4B C5B 86.4(11) . . . . ?
C9B C4B C5B C6B -1.3(14) . . . . ?
N1B C4B C5B C6B 170.3(8) . . . . ?
C9B C4B C5B C10B -175.0(10) . . . . ?
N1B C4B C5B C10B -3.3(13) . . . . ?
C4B C5B C6B C7B 2.2(16) . . . . ?
C10B C5B C6B C7B 175.8(11) . . . . ?
C5B C6B C7B C8B -1.1(19) . . . . ?
C6B C7B C8B C9B -0.9(19) . . . . ?
C5B C4B C9B C8B -0.5(13) . . . . ?
N1B C4B C9B C8B -172.3(8) . . . . ?
C5B C4B C9B C13B 177.1(10) . . . . ?
N1B C4B C9B C13B 5.3(14) . . . . ?
C7B C8B C9B C4B 1.6(15) . . . . ?
C7B C8B C9B C13B -176.1(11) . . . . ?
C6B C5B C10B C12B -84.6(14) . . . . ?
C4B C5B C10B C12B 88.8(15) . . . . ?
C6B C5B C10B C11B 35.4(17) . . . . ?
C4B C5B C10B C11B -151.2(10) . . . . ?
C4B C9B C13B C14B 135.9(11) . . . . ?
C8B C9B C13B C14B -46.6(15) . . . . ?
C4B C9B C13B C15B -99.3(16) . . . . ?
C8B C9B C13B C15B 78.2(17) . . . . ?
C1B N2B C16B C21B -86.1(10) . . . . ?
C3B N2B C16B C21B 94.5(11) . . . . ?
C1B N2B C16B C17B 98.4(10) . . . . ?
C3B N2B C16B C17B -81.0(11) . . . . ?
C21B C16B C17B C18B 0.8(13) . . . . ?
N2B C16B C17B C18B 176.0(8) . . . . ?
C21B C16B C17B C22B -176.8(10) . . . . ?
N2B C16B C17B C22B -1.5(14) . . . . ?
C16B C17B C18B C19B 0.4(15) . . . . ?
C22B C17B C18B C19B 178.1(11) . . . . ?
C17B C18B C19B C20B -1.5(16) . . . . ?
C18B C19B C20B C21B 1.3(16) . . . . ?
C19B C20B C21B C16B -0.1(14) . . . . ?
C19B C20B C21B C25B -177.9(9) . . . . ?
C17B C16B C21B C20B -0.9(13) . . . . ?
N2B C16B C21B C20B -176.2(8) . . . . ?
C17B C16B C21B C25B 176.8(8) . . . . ?
N2B C16B C21B C25B 1.6(12) . . . . ?
C18B C17B C22B C23B 45.2(17) . . . . ?
C16B C17B C22B C23B -137.3(12) . . . . ?
C18B C17B C22B C24B -79.9(15) . . . . ?
C16B C17B C22B C24B 97.6(14) . . . . ?
C20B C21B C25B C26B -32.5(13) . . . . ?
C16B C21B C25B C26B 149.8(9) . . . . ?
C20B C21B C25B C27B 92.4(11) . . . . ?
C16B C21B C25B C27B -85.4(11) . . . . ?

_refine_diff_density_max         1.709
_refine_diff_density_min         -1.287
_refine_diff_density_rms         0.166



####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_wo94wo
_database_code_depnum_ccdc_archive 'CCDC 2008216'
loop_
_audit_author_name
_audit_author_address
'Christian Kleeberg'
;Technische Universitaet Braunschweig, Institut fuer Anorganische und Analytische Chemie
Germany
;
_audit_update_record             
;
2020-06-05 deposited with the CCDC.	2020-07-28 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C74 H66 B Cu N2 O2'
_chemical_formula_sum            'C74 H66 B Cu N2 O2'
_chemical_formula_weight         1089.63

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu -1.9646 0.5888 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      orthorhombic
_space_group_IT_number           61
_space_group_name_H-M_alt        'P b c a'
_space_group_name_Hall           '-P 2ac 2ab'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, -y, z+1/2'
'-x, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z'
'-x, -y, -z'
'x-1/2, y, -z-1/2'
'x, -y-1/2, z-1/2'
'-x-1/2, y-1/2, z'

_cell_length_a                   10.83810(10)
_cell_length_b                   25.8186(2)
_cell_length_c                   41.5657(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     11631.11(16)
_cell_formula_units_Z            8
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    100328
_cell_measurement_theta_min      3.4140
_cell_measurement_theta_max      77.5270

_exptl_crystal_recrystallization_method 
;
 Slow evaporation of solution in diethylether at ambient temperature.
;
_exptl_special_details           
;
 The crystal was mounted at rt with perfluoroether oil on top of a Hampton
 loop and placed in a cold nitrogen gas stream on the diffractometer.
 
 It was noted that the lath-shaped crystals of 3 tend to be twinned, as 
 indicated by inspection under a polarisation microscope. The crystal 
 structure determination was conducted on 'mechanically detwinned' fragment.

 The collected data cover more than a hemisphere of the reciprocal space.
 A combination of 31 sets of ω scans were used; each set at different \j,
 2θ or κ angles and each scan 0.5 deg in ω. Each frame was exposured 
 for 1 s at low and 5 s at high angles. Nominal crystal to detector 
 distance 32 mm.
;

_exptl_crystal_description       'fragemnt of lath'
_exptl_crystal_colour            'clear colourless'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.245
_exptl_crystal_F_000             4592
_exptl_transmission_factor_min   ?
_exptl_transmission_factor_max   ?
_exptl_crystal_size_max          0.161
_exptl_crystal_size_mid          0.122
_exptl_crystal_size_min          0.051
_exptl_absorpt_coefficient_mu    0.905
_exptl_absorpt_correction_T_min  0.79516
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_type   multi-scan

_exptl_absorpt_process_details   
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2019)
 Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
 
 Empirical correction (ABSPACK) includes:
   - Absorption correction using spherical harmonics
   - Frame scaling
;

_diffrn_radiation_wavelength     1.54184
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_type           CuK\a
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'PhotonJet (Cu) X-ray Source'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  
'XtaLAB Synergy, Single source at home/near, HyPix'
_diffrn_detector                 'CCD plate'
_diffrn_detector_type            HyPix
_diffrn_measurement_method       ω-scan
_diffrn_reflns_number            187069
_diffrn_reflns_av_unetI/netI     0.0151
_diffrn_reflns_av_R_equivalents  0.0377
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_k_min       -32
_diffrn_reflns_limit_k_max       32
_diffrn_reflns_limit_l_min       -43
_diffrn_reflns_limit_l_max       51
_diffrn_reflns_theta_min         3.424
_diffrn_reflns_theta_max         77.834
_diffrn_reflns_theta_full        77.000
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.993
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.993
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             12343
_reflns_number_gt                11299
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000

_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
;
_computing_data_collection       
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2018)
;
_computing_cell_refinement       
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2018)
;
_computing_data_reduction        
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2018)
;
_computing_structure_solution    
;
 SHELXT (Ver. 2018/2) (G. M. Sheldrick, Acta Cryst., 2015, A71, 3--8)
;
_computing_structure_refinement  
;
 SHELXL-2018/3 (G. M. Sheldrick, Acta Cryst., 2015, A71, 3--8)
;
_computing_molecular_graphics    
;
 K. Brandenburg, 2017, Diamond 4.4.1, Crystal Impact GbR, Bonn, Germany.
;
_computing_publication_material  
;
 WinGX v2014.1 (L. J. Farrugia, J. Appl. Cryst., 2012, 45, 849-854.)
;

_refine_special_details          
;
 All H atoms were placed in idealised positions and refined using a riding
 model, with a common U restrained to be 1.2 (1.5 for methyl groups) times
 the equivalent isotropic displacement parameter of the parent atom.
 For disordered methyl groups the hydrogen atoms were placed in ideslised 
 positions and allowed to ride on the pvot atom, all other metyl groups were 
 were treated as rigid bodies and allowed to rotate about the E-CH3 bond 
 but not tip.

 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;

_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0538P)²+9.0962P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         12343
_refine_ls_number_parameters     725
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0458
_refine_ls_R_factor_gt           0.0423
_refine_ls_wR_factor_ref         0.1151
_refine_ls_wR_factor_gt          0.1117
_refine_ls_goodness_of_fit_ref   1.030
_refine_ls_restrained_S_all      1.030
_refine_ls_shift/su_max          0.005
_refine_ls_shift/su_mean         0.000

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
C1 C 0.26945(14) 0.55747(5) 0.61704(3) 0.0205(3) Uani 1 1 d . . . . .
C2 C 0.45592(14) 0.52747(6) 0.60004(4) 0.0237(3) Uani 1 1 d . . . . .
H2 H 0.540869 0.518410 0.600239 0.028 Uiso 1 1 calc R U . . .
C3 C 0.37699(14) 0.52173(6) 0.57536(4) 0.0223(3) Uani 1 1 d . . . . .
H3 H 0.395035 0.507834 0.554723 0.027 Uiso 1 1 calc R U . . .
C4 C 0.43918(14) 0.56000(6) 0.65663(3) 0.0224(3) Uani 1 1 d . . . . .
C5 C 0.43826(15) 0.52048(6) 0.67971(4) 0.0242(3) Uani 1 1 d . . . . .
C6 C 0.49209(16) 0.53084(6) 0.70932(4) 0.0283(3) Uani 1 1 d . . . . .
H6 H 0.490500 0.504866 0.725505 0.034 Uiso 1 1 calc R U . . .
C7 C 0.54861(17) 0.57830(6) 0.71608(4) 0.0292(3) Uani 1 1 d . . . . .
C8 C 0.54092(16) 0.61725(6) 0.69307(4) 0.0281(3) Uani 1 1 d . . . . .
H8 H 0.574061 0.650409 0.697920 0.034 Uiso 1 1 calc R U . . .
C9 C 0.48637(15) 0.60934(6) 0.66319(4) 0.0241(3) Uani 1 1 d . . . . .
C10 C 0.38061(15) 0.46781(6) 0.67236(4) 0.0244(3) Uani 1 1 d . . . . .
H10 H 0.306197 0.474440 0.658738 0.029 Uiso 1 1 calc R U . . .
C11 C 0.46443(16) 0.43221(6) 0.65328(4) 0.0262(3) Uani 1 1 d . . . . .
C12 C 0.41052(19) 0.39249(6) 0.63533(4) 0.0324(4) Uani 1 1 d . . . . .
H12 H 0.323279 0.390865 0.633359 0.039 Uiso 1 1 calc R U . . .
C13 C 0.4827(2) 0.35553(7) 0.62040(4) 0.0422(5) Uani 1 1 d . . . . .
H13 H 0.444921 0.328771 0.608199 0.051 Uiso 1 1 calc R U . . .
C14 C 0.6100(2) 0.35735(8) 0.62316(5) 0.0475(5) Uani 1 1 d . . . . .
H14 H 0.659515 0.331591 0.613183 0.057 Uiso 1 1 calc R U . . .
C15 C 0.6647(2) 0.39702(8) 0.64059(5) 0.0436(5) Uani 1 1 d . . . . .
H15 H 0.752044 0.398633 0.642363 0.052 Uiso 1 1 calc R U . . .
C16 C 0.59200(17) 0.43446(7) 0.65548(4) 0.0334(4) Uani 1 1 d . . . . .
H16 H 0.629995 0.461717 0.667212 0.040 Uiso 1 1 calc R U . . .
C17 C 0.33573(15) 0.44026(6) 0.70278(4) 0.0246(3) Uani 1 1 d . . . . .
C18 C 0.39465(17) 0.39724(6) 0.71560(4) 0.0298(3) Uani 1 1 d . . . . .
H18 H 0.466209 0.383854 0.705346 0.036 Uiso 1 1 calc R U . . .
C19 C 0.34992(19) 0.37341(7) 0.74339(4) 0.0369(4) Uani 1 1 d . . . . .
H19 H 0.391416 0.344060 0.751922 0.044 Uiso 1 1 calc R U . . .
C20 C 0.2472(2) 0.39193(8) 0.75838(4) 0.0423(5) Uani 1 1 d . . . . .
H20 H 0.217411 0.375792 0.777391 0.051 Uiso 1 1 calc R U . . .
C21 C 0.1873(2) 0.43394(9) 0.74582(6) 0.0526(6) Uani 1 1 d . . . . .
H21 H 0.115178 0.446714 0.756098 0.063 Uiso 1 1 calc R U . . .
C22 C 0.23078(19) 0.45814(7) 0.71822(5) 0.0411(4) Uani 1 1 d . . . . .
H22 H 0.188032 0.487281 0.709823 0.049 Uiso 1 1 calc R U . . .
C23 C 0.6164(2) 0.58569(7) 0.74741(4) 0.0367(4) Uani 1 1 d . . . . .
H23A H 0.640948 0.622055 0.749588 0.055 Uiso 1 1 calc R U . . .
H23B H 0.690095 0.563687 0.747665 0.055 Uiso 1 1 calc R U . . .
H23C H 0.562306 0.576128 0.765339 0.055 Uiso 1 1 calc R U . . .
C24 C 0.47807(15) 0.65256(6) 0.63815(4) 0.0257(3) Uani 1 1 d . . . . .
H24 H 0.402657 0.645177 0.625068 0.031 Uiso 1 1 calc R U . . .
C25 C 0.45716(16) 0.70557(6) 0.65371(4) 0.0274(3) Uani 1 1 d . . . . .
C26 C 0.33785(18) 0.72036(7) 0.66144(5) 0.0401(4) Uani 1 1 d . . . . .
H26 H 0.270932 0.697905 0.656617 0.048 Uiso 1 1 calc R U . . .
C27 C 0.3151(2) 0.76784(8) 0.67622(6) 0.0482(5) Uani 1 1 d . . . . .
H27 H 0.232856 0.777600 0.681277 0.058 Uiso 1 1 calc R U . . .
C28 C 0.4111(2) 0.80068(7) 0.68355(5) 0.0404(4) Uani 1 1 d . . . . .
H28 H 0.395653 0.832597 0.694174 0.048 Uiso 1 1 calc R U . . .
C29 C 0.5297(2) 0.78691(7) 0.67535(5) 0.0390(4) Uani 1 1 d . . . . .
H29 H 0.596079 0.809795 0.679935 0.047 Uiso 1 1 calc R U . . .
C30 C 0.55317(17) 0.73967(7) 0.66038(4) 0.0339(4) Uani 1 1 d . . . . .
H30 H 0.635306 0.730674 0.654680 0.041 Uiso 1 1 calc R U . . .
C31 C 0.58569(16) 0.65300(6) 0.61466(4) 0.0261(3) Uani 1 1 d . . . . .
C32 C 0.70172(18) 0.63318(7) 0.62173(4) 0.0354(4) Uani 1 1 d . . . . .
H32 H 0.715669 0.617135 0.641973 0.042 Uiso 1 1 calc R U . . .
C33 C 0.79743(19) 0.63646(7) 0.59973(5) 0.0407(4) Uani 1 1 d . . . . .
H33 H 0.876389 0.623039 0.605110 0.049 Uiso 1 1 calc R U . . .
C34 C 0.77868(19) 0.65921(7) 0.56991(5) 0.0373(4) Uani 1 1 d . . . . .
H34 H 0.843643 0.660686 0.554592 0.045 Uiso 1 1 calc R U . . .
C35 C 0.6641(2) 0.67971(8) 0.56280(5) 0.0431(4) Uani 1 1 d . . . . .
H35 H 0.650624 0.696042 0.542621 0.052 Uiso 1 1 calc R U . . .
C36 C 0.56885(18) 0.67661(7) 0.58483(4) 0.0366(4) Uani 1 1 d . . . . .
H36 H 0.490578 0.690826 0.579558 0.044 Uiso 1 1 calc R U . . .
C37 C 0.15163(13) 0.53917(6) 0.56758(3) 0.0194(3) Uani 1 1 d . . . . .
C38 C 0.12785(14) 0.57923(6) 0.54575(3) 0.0205(3) Uani 1 1 d . . . . .
C39 C 0.01692(14) 0.57772(6) 0.52883(3) 0.0217(3) Uani 1 1 d . . . . .
H39 H -0.001932 0.605046 0.514342 0.026 Uiso 1 1 calc R U . . .
C40 C -0.06716(14) 0.53737(6) 0.53252(3) 0.0216(3) Uani 1 1 d . . . . .
C41 C -0.03905(14) 0.49791(6) 0.55416(4) 0.0226(3) Uani 1 1 d . . . . .
H41 H -0.095366 0.470007 0.556684 0.027 Uiso 1 1 calc R U . . .
C42 C 0.06911(14) 0.49818(5) 0.57218(3) 0.0205(3) Uani 1 1 d . . . . .
C43 C 0.21962(15) 0.62359(6) 0.54104(4) 0.0237(3) Uani 1 1 d . . . . .
H43 H 0.276930 0.622420 0.559875 0.028 Uiso 1 1 calc R U . . .
C44 C 0.15115(15) 0.67529(6) 0.54323(4) 0.0252(3) Uani 1 1 d . . . . .
C45 C 0.10868(19) 0.68992(6) 0.57354(4) 0.0338(4) Uani 1 1 d . . . . .
H45 H 0.129469 0.669463 0.591743 0.041 Uiso 1 1 calc R U . . .
C46 C 0.0367(2) 0.73375(7) 0.57760(4) 0.0395(4) Uani 1 1 d . . . . .
H46 H 0.008078 0.742953 0.598424 0.047 Uiso 1 1 calc R U . . .
C47 C 0.00651(19) 0.76418(7) 0.55131(5) 0.0370(4) Uani 1 1 d . . . . .
H47 H -0.043703 0.794047 0.553935 0.044 Uiso 1 1 calc R U . . .
C48 C 0.05014(19) 0.75065(7) 0.52129(4) 0.0347(4) Uani 1 1 d . . . . .
H48 H 0.030510 0.771649 0.503230 0.042 Uiso 1 1 calc R U . . .
C49 C 0.12271(17) 0.70654(6) 0.51710(4) 0.0302(3) Uani 1 1 d . . . . .
H49 H 0.152725 0.697875 0.496313 0.036 Uiso 1 1 calc R U . . .
C50 C 0.29901(15) 0.61465(6) 0.51123(4) 0.0244(3) Uani 1 1 d . . . . .
C51 C 0.42675(16) 0.61279(7) 0.51441(4) 0.0334(4) Uani 1 1 d . . . . .
H51 H 0.462994 0.618534 0.534912 0.040 Uiso 1 1 calc R U . . .
C52 C 0.50228(17) 0.60268(8) 0.48811(5) 0.0404(4) Uani 1 1 d . . . . .
H52 H 0.589300 0.601663 0.490779 0.048 Uiso 1 1 calc R U . . .
C53 C 0.45135(17) 0.59412(7) 0.45813(5) 0.0350(4) Uani 1 1 d . . . . .
H53 H 0.502867 0.586977 0.440174 0.042 Uiso 1 1 calc R U . . .
C54 C 0.32444(17) 0.59605(6) 0.45449(4) 0.0318(4) Uani 1 1 d . . . . .
H54 H 0.288774 0.590440 0.433904 0.038 Uiso 1 1 calc R U . . .
C55 C 0.24892(16) 0.60613(6) 0.48077(4) 0.0273(3) Uani 1 1 d . . . . .
H55 H 0.161976 0.607241 0.477958 0.033 Uiso 1 1 calc R U . . .
C56 C -0.18672(15) 0.53743(6) 0.51413(4) 0.0278(3) Uani 1 1 d . . . . .
H56A H -0.253835 0.548533 0.528345 0.042 Uiso 1 1 calc R U . . .
H56B H -0.203788 0.502428 0.506166 0.042 Uiso 1 1 calc R U . . .
H56C H -0.180419 0.561358 0.495903 0.042 Uiso 1 1 calc R U . . .
C57 C 0.09297(14) 0.45625(6) 0.59723(3) 0.0215(3) Uani 1 1 d . . . . .
H57 H 0.180986 0.460515 0.603942 0.026 Uiso 1 1 calc R U . . .
C58 C 0.08384(15) 0.40219(6) 0.58252(4) 0.0232(3) Uani 1 1 d . . . . .
C59 C 0.18447(17) 0.38293(7) 0.56576(4) 0.0323(4) Uani 1 1 d . . . . .
H59 H 0.256511 0.403615 0.563652 0.039 Uiso 1 1 calc R U . . .
C60 C 0.1818(2) 0.33389(7) 0.55201(5) 0.0413(4) Uani 1 1 d . . . . .
H60 H 0.251255 0.321292 0.540478 0.050 Uiso 1 1 calc R U . . .
C61 C 0.0774(2) 0.30355(7) 0.55519(5) 0.0414(4) Uani 1 1 d . . . . .
H61 H 0.075279 0.269885 0.545980 0.050 Uiso 1 1 calc R U . . .
C62 C -0.0234(2) 0.32205(7) 0.57168(5) 0.0424(4) Uani 1 1 d . . . . .
H62 H -0.095075 0.301151 0.573776 0.051 Uiso 1 1 calc R U . . .
C63 C -0.02073(17) 0.37143(7) 0.58536(4) 0.0328(4) Uani 1 1 d . . . . .
H63 H -0.090752 0.384037 0.596665 0.039 Uiso 1 1 calc R U . . .
C64 C 0.01612(15) 0.46375(6) 0.62774(4) 0.0242(3) Uani 1 1 d . . . . .
C65 C 0.02692(18) 0.42776(7) 0.65255(4) 0.0353(4) Uani 1 1 d . . . . .
H65 H 0.077484 0.398066 0.649666 0.042 Uiso 1 1 calc R U . . .
C66 C -0.0351(2) 0.43471(8) 0.68133(5) 0.0419(4) Uani 1 1 d . . . . .
H66 H -0.027114 0.409615 0.697916 0.050 Uiso 1 1 calc R U . . .
C67 C -0.10847(19) 0.47785(7) 0.68620(4) 0.0378(4) Uani 1 1 d . . . . .
H67 H -0.150781 0.482542 0.706008 0.045 Uiso 1 1 calc R U . . .
C68 C -0.11934(19) 0.51385(7) 0.66196(5) 0.0364(4) Uani 1 1 d . . . . .
H68 H -0.168820 0.543797 0.665129 0.044 Uiso 1 1 calc R U . . .
C69 C -0.05825(17) 0.50668(6) 0.63280(4) 0.0310(3) Uani 1 1 d . . . . .
H69 H -0.067697 0.531571 0.616152 0.037 Uiso 1 1 calc R U . . .
C70 C -0.11706(18) 0.66196(8) 0.70792(5) 0.0426(4) Uani 1 1 d . . . . .
H70A H -0.120463 0.648894 0.730297 0.051 Uiso 1 1 calc R U . . .
H70B H -0.202153 0.661761 0.699263 0.051 Uiso 1 1 calc R U . . .
C71 C -0.06878(18) 0.71798(8) 0.70824(5) 0.0383(4) Uani 1 1 d . . . . .
C72 C -0.0497(2) 0.73284(8) 0.67317(5) 0.0414(4) Uani 1 1 d . . . . .
H72A H -0.130629 0.733951 0.662168 0.050 Uiso 1 1 calc R U . . .
H72B H -0.013077 0.767935 0.672082 0.050 Uiso 1 1 calc R U . . .
C73 C 0.05234(19) 0.72181(7) 0.72682(5) 0.0387(4) Uani 1 1 d . . . . .
H73A H 0.113720 0.698888 0.716972 0.058 Uiso 1 1 calc R U . . .
H73B H 0.038732 0.711400 0.749215 0.058 Uiso 1 1 calc R U . . .
H73C H 0.082348 0.757603 0.726207 0.058 Uiso 1 1 calc R U . . .
C74 C -0.1631(2) 0.75374(10) 0.72377(6) 0.0580(6) Uani 1 1 d . . . . .
H74A H -0.134269 0.789641 0.722299 0.087 Uiso 1 1 calc R U . . .
H74B H -0.173535 0.744243 0.746431 0.087 Uiso 1 1 calc R U . . .
H74C H -0.242279 0.750386 0.712571 0.087 Uiso 1 1 calc R U . . .
B1 B 0.03226(18) 0.64457(8) 0.66446(5) 0.0321(4) Uani 1 1 d . . . . .
N1 N 0.38957(12) 0.54915(5) 0.62512(3) 0.0207(2) Uani 1 1 d . . . . .
N2 N 0.26369(11) 0.54017(5) 0.58604(3) 0.0195(2) Uani 1 1 d . . . . .
O1 O -0.04296(13) 0.62805(5) 0.68924(3) 0.0392(3) Uani 1 1 d . . . . .
O2 O 0.02921(12) 0.69714(5) 0.65681(3) 0.0367(3) Uani 1 1 d . . . . .
Cu1 Cu 0.14659(2) 0.59535(2) 0.64126(2) 0.02590(8) Uani 1 1 d . . . . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C1 N1 1.3616(19) . ?
C1 N2 1.3654(18) . ?
C1 Cu1 1.9346(15) . ?
C2 C3 1.344(2) . ?
C2 N1 1.385(2) . ?
C3 N2 1.3899(19) . ?
C4 C9 1.399(2) . ?
C4 C5 1.401(2) . ?
C4 N1 1.4432(18) . ?
C5 C6 1.388(2) . ?
C5 C10 1.527(2) . ?
C6 C7 1.399(2) . ?
C7 C8 1.390(2) . ?
C7 C23 1.507(2) . ?
C8 C9 1.390(2) . ?
C9 C24 1.529(2) . ?
C10 C11 1.516(2) . ?
C10 C17 1.530(2) . ?
C11 C16 1.387(3) . ?
C11 C12 1.397(2) . ?
C12 C13 1.381(3) . ?
C13 C14 1.385(3) . ?
C14 C15 1.388(3) . ?
C15 C16 1.393(3) . ?
C17 C22 1.385(2) . ?
C17 C18 1.388(2) . ?
C18 C19 1.396(2) . ?
C19 C20 1.362(3) . ?
C20 C21 1.367(3) . ?
C21 C22 1.389(3) . ?
C24 C31 1.521(2) . ?
C24 C25 1.531(2) . ?
C25 C26 1.386(3) . ?
C25 C30 1.391(2) . ?
C26 C27 1.393(3) . ?
C27 C28 1.376(3) . ?
C28 C29 1.377(3) . ?
C29 C30 1.392(2) . ?
C31 C32 1.389(2) . ?
C31 C36 1.393(2) . ?
C32 C33 1.385(3) . ?
C33 C34 1.387(3) . ?
C34 C35 1.382(3) . ?
C35 C36 1.382(3) . ?
C37 C42 1.399(2) . ?
C37 C38 1.400(2) . ?
C37 N2 1.4369(18) . ?
C38 C39 1.393(2) . ?
C38 C43 1.529(2) . ?
C39 C40 1.392(2) . ?
C40 C41 1.393(2) . ?
C40 C56 1.504(2) . ?
C41 C42 1.391(2) . ?
C42 C57 1.5243(19) . ?
C43 C50 1.526(2) . ?
C43 C44 1.530(2) . ?
C44 C49 1.388(2) . ?
C44 C45 1.393(2) . ?
C45 C46 1.384(3) . ?
C46 C47 1.385(3) . ?
C47 C48 1.380(3) . ?
C48 C49 1.395(2) . ?
C50 C51 1.392(2) . ?
C50 C55 1.395(2) . ?
C51 C52 1.390(3) . ?
C52 C53 1.381(3) . ?
C53 C54 1.385(3) . ?
C54 C55 1.390(2) . ?
C57 C58 1.527(2) . ?
C57 C64 1.529(2) . ?
C58 C59 1.386(2) . ?
C58 C63 1.389(2) . ?
C59 C60 1.390(3) . ?
C60 C61 1.382(3) . ?
C61 C62 1.375(3) . ?
C62 C63 1.396(2) . ?
C64 C69 1.387(2) . ?
C64 C65 1.393(2) . ?
C65 C66 1.384(3) . ?
C66 C67 1.384(3) . ?
C67 C68 1.376(3) . ?
C68 C69 1.394(2) . ?
C70 O1 1.419(2) . ?
C70 C71 1.538(3) . ?
C71 C74 1.521(3) . ?
C71 C72 1.522(3) . ?
C71 C73 1.526(3) . ?
C72 O2 1.429(2) . ?
B1 O1 1.381(2) . ?
B1 O2 1.394(2) . ?
B1 Cu1 2.020(2) . ?

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
_geom_angle_publ_flag
N1 C1 N2 103.00(12) . . ?
N1 C1 Cu1 127.56(10) . . ?
N2 C1 Cu1 128.68(11) . . ?
C3 C2 N1 106.79(13) . . ?
C2 C3 N2 106.30(13) . . ?
C9 C4 C5 122.16(14) . . ?
C9 C4 N1 119.33(13) . . ?
C5 C4 N1 118.51(13) . . ?
C6 C5 C4 117.64(14) . . ?
C6 C5 C10 121.40(14) . . ?
C4 C5 C10 120.95(13) . . ?
C5 C6 C7 122.08(15) . . ?
C8 C7 C6 117.99(14) . . ?
C8 C7 C23 122.14(15) . . ?
C6 C7 C23 119.86(15) . . ?
C9 C8 C7 122.24(15) . . ?
C8 C9 C4 117.60(14) . . ?
C8 C9 C24 121.72(14) . . ?
C4 C9 C24 120.68(13) . . ?
C11 C10 C5 113.53(13) . . ?
C11 C10 C17 109.92(12) . . ?
C5 C10 C17 112.23(12) . . ?
C16 C11 C12 118.89(16) . . ?
C16 C11 C10 122.51(15) . . ?
C12 C11 C10 118.30(16) . . ?
C13 C12 C11 120.69(19) . . ?
C12 C13 C14 120.24(19) . . ?
C13 C14 C15 119.61(19) . . ?
C14 C15 C16 120.2(2) . . ?
C11 C16 C15 120.40(18) . . ?
C22 C17 C18 117.83(16) . . ?
C22 C17 C10 119.27(15) . . ?
C18 C17 C10 122.90(15) . . ?
C17 C18 C19 120.71(17) . . ?
C20 C19 C18 120.51(18) . . ?
C19 C20 C21 119.45(17) . . ?
C20 C21 C22 120.74(19) . . ?
C17 C22 C21 120.75(18) . . ?
C31 C24 C9 113.41(13) . . ?
C31 C24 C25 112.22(13) . . ?
C9 C24 C25 111.95(13) . . ?
C26 C25 C30 118.51(16) . . ?
C26 C25 C24 118.85(15) . . ?
C30 C25 C24 122.64(16) . . ?
C25 C26 C27 120.65(19) . . ?
C28 C27 C26 120.4(2) . . ?
C27 C28 C29 119.48(17) . . ?
C28 C29 C30 120.47(18) . . ?
C25 C30 C29 120.46(18) . . ?
C32 C31 C36 117.90(17) . . ?
C32 C31 C24 123.75(14) . . ?
C36 C31 C24 118.28(15) . . ?
C33 C32 C31 121.04(16) . . ?
C32 C33 C34 120.41(18) . . ?
C35 C34 C33 119.01(18) . . ?
C36 C35 C34 120.48(18) . . ?
C35 C36 C31 121.14(18) . . ?
C42 C37 C38 122.01(13) . . ?
C42 C37 N2 118.76(13) . . ?
C38 C37 N2 119.24(13) . . ?
C39 C38 C37 117.72(13) . . ?
C39 C38 C43 121.17(13) . . ?
C37 C38 C43 121.11(13) . . ?
C40 C39 C38 122.02(13) . . ?
C39 C40 C41 118.37(14) . . ?
C39 C40 C56 120.47(13) . . ?
C41 C40 C56 121.14(14) . . ?
C42 C41 C40 121.89(14) . . ?
C41 C42 C37 117.97(13) . . ?
C41 C42 C57 120.47(13) . . ?
C37 C42 C57 121.49(13) . . ?
C50 C43 C38 110.94(12) . . ?
C50 C43 C44 117.01(12) . . ?
C38 C43 C44 109.28(13) . . ?
C49 C44 C45 118.46(15) . . ?
C49 C44 C43 124.63(14) . . ?
C45 C44 C43 116.80(14) . . ?
C46 C45 C44 121.19(16) . . ?
C45 C46 C47 120.05(16) . . ?
C48 C47 C46 119.26(17) . . ?
C47 C48 C49 120.85(17) . . ?
C44 C49 C48 120.15(16) . . ?
C51 C50 C55 117.90(15) . . ?
C51 C50 C43 119.28(15) . . ?
C55 C50 C43 122.77(14) . . ?
C52 C51 C50 121.17(17) . . ?
C53 C52 C51 120.29(17) . . ?
C52 C53 C54 119.33(17) . . ?
C53 C54 C55 120.40(17) . . ?
C54 C55 C50 120.92(16) . . ?
C42 C57 C58 111.39(12) . . ?
C42 C57 C64 112.59(12) . . ?
C58 C57 C64 114.36(12) . . ?
C59 C58 C63 118.66(15) . . ?
C59 C58 C57 118.56(14) . . ?
C63 C58 C57 122.78(14) . . ?
C58 C59 C60 121.13(18) . . ?
C61 C60 C59 119.61(18) . . ?
C62 C61 C60 120.06(17) . . ?
C61 C62 C63 120.26(19) . . ?
C58 C63 C62 120.28(17) . . ?
C69 C64 C65 118.01(15) . . ?
C69 C64 C57 122.94(14) . . ?
C65 C64 C57 118.91(14) . . ?
C66 C65 C64 120.85(17) . . ?
C67 C66 C65 120.67(17) . . ?
C68 C67 C66 119.07(17) . . ?
C67 C68 C69 120.43(17) . . ?
C64 C69 C68 120.97(16) . . ?
O1 C70 C71 113.09(15) . . ?
C74 C71 C72 110.17(18) . . ?
C74 C71 C73 108.91(17) . . ?
C72 C71 C73 110.56(17) . . ?
C74 C71 C70 110.23(18) . . ?
C72 C71 C70 105.97(16) . . ?
C73 C71 C70 110.97(17) . . ?
O2 C72 C71 112.00(15) . . ?
O1 B1 O2 117.16(16) . . ?
O1 B1 Cu1 121.60(14) . . ?
O2 B1 Cu1 121.21(14) . . ?
C1 N1 C2 112.00(12) . . ?
C1 N1 C4 123.32(13) . . ?
C2 N1 C4 124.63(13) . . ?
C1 N2 C3 111.91(12) . . ?
C1 N2 C37 123.28(12) . . ?
C3 N2 C37 124.74(12) . . ?
B1 O1 C70 123.48(16) . . ?
B1 O2 C72 122.25(15) . . ?
C1 Cu1 B1 171.36(8) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N1 C2 C3 N2 0.03(16) . . . . ?
C9 C4 C5 C6 -3.3(2) . . . . ?
N1 C4 C5 C6 176.76(15) . . . . ?
C9 C4 C5 C10 177.08(15) . . . . ?
N1 C4 C5 C10 -2.9(2) . . . . ?
C4 C5 C6 C7 -1.7(3) . . . . ?
C10 C5 C6 C7 177.99(16) . . . . ?
C5 C6 C7 C8 5.3(3) . . . . ?
C5 C6 C7 C23 -174.05(17) . . . . ?
C6 C7 C8 C9 -4.2(3) . . . . ?
C23 C7 C8 C9 175.13(17) . . . . ?
C7 C8 C9 C4 -0.5(3) . . . . ?
C7 C8 C9 C24 179.76(16) . . . . ?
C5 C4 C9 C8 4.3(2) . . . . ?
N1 C4 C9 C8 -175.73(15) . . . . ?
C5 C4 C9 C24 -175.91(15) . . . . ?
N1 C4 C9 C24 4.0(2) . . . . ?
C6 C5 C10 C11 -98.86(18) . . . . ?
C4 C5 C10 C11 80.77(18) . . . . ?
C6 C5 C10 C17 26.6(2) . . . . ?
C4 C5 C10 C17 -153.81(15) . . . . ?
C5 C10 C11 C16 29.5(2) . . . . ?
C17 C10 C11 C16 -97.16(18) . . . . ?
C5 C10 C11 C12 -156.93(14) . . . . ?
C17 C10 C11 C12 76.43(18) . . . . ?
C16 C11 C12 C13 1.0(2) . . . . ?
C10 C11 C12 C13 -172.81(15) . . . . ?
C11 C12 C13 C14 0.2(3) . . . . ?
C12 C13 C14 C15 -1.0(3) . . . . ?
C13 C14 C15 C16 0.7(3) . . . . ?
C12 C11 C16 C15 -1.4(3) . . . . ?
C10 C11 C16 C15 172.15(16) . . . . ?
C14 C15 C16 C11 0.6(3) . . . . ?
C11 C10 C17 C22 -159.80(16) . . . . ?
C5 C10 C17 C22 72.83(19) . . . . ?
C11 C10 C17 C18 19.2(2) . . . . ?
C5 C10 C17 C18 -108.14(17) . . . . ?
C22 C17 C18 C19 -0.8(3) . . . . ?
C10 C17 C18 C19 -179.88(15) . . . . ?
C17 C18 C19 C20 0.2(3) . . . . ?
C18 C19 C20 C21 0.5(3) . . . . ?
C19 C20 C21 C22 -0.6(3) . . . . ?
C18 C17 C22 C21 0.7(3) . . . . ?
C10 C17 C22 C21 179.80(19) . . . . ?
C20 C21 C22 C17 0.0(4) . . . . ?
C8 C9 C24 C31 92.73(19) . . . . ?
C4 C9 C24 C31 -87.03(18) . . . . ?
C8 C9 C24 C25 -35.5(2) . . . . ?
C4 C9 C24 C25 144.74(15) . . . . ?
C31 C24 C25 C26 146.95(16) . . . . ?
C9 C24 C25 C26 -84.19(19) . . . . ?
C31 C24 C25 C30 -32.9(2) . . . . ?
C9 C24 C25 C30 95.94(19) . . . . ?
C30 C25 C26 C27 -1.4(3) . . . . ?
C24 C25 C26 C27 178.70(18) . . . . ?
C25 C26 C27 C28 -0.4(3) . . . . ?
C26 C27 C28 C29 1.8(3) . . . . ?
C27 C28 C29 C30 -1.4(3) . . . . ?
C26 C25 C30 C29 1.8(3) . . . . ?
C24 C25 C30 C29 -178.28(16) . . . . ?
C28 C29 C30 C25 -0.5(3) . . . . ?
C9 C24 C31 C32 -25.8(2) . . . . ?
C25 C24 C31 C32 102.29(18) . . . . ?
C9 C24 C31 C36 157.13(15) . . . . ?
C25 C24 C31 C36 -74.79(19) . . . . ?
C36 C31 C32 C33 -0.5(3) . . . . ?
C24 C31 C32 C33 -177.55(16) . . . . ?
C31 C32 C33 C34 -0.7(3) . . . . ?
C32 C33 C34 C35 1.6(3) . . . . ?
C33 C34 C35 C36 -1.3(3) . . . . ?
C34 C35 C36 C31 0.1(3) . . . . ?
C32 C31 C36 C35 0.8(3) . . . . ?
C24 C31 C36 C35 178.01(17) . . . . ?
C42 C37 C38 C39 1.1(2) . . . . ?
N2 C37 C38 C39 -178.43(13) . . . . ?
C42 C37 C38 C43 -179.81(13) . . . . ?
N2 C37 C38 C43 0.6(2) . . . . ?
C37 C38 C39 C40 -1.7(2) . . . . ?
C43 C38 C39 C40 179.25(14) . . . . ?
C38 C39 C40 C41 0.8(2) . . . . ?
C38 C39 C40 C56 179.24(14) . . . . ?
C39 C40 C41 C42 0.7(2) . . . . ?
C56 C40 C41 C42 -177.74(14) . . . . ?
C40 C41 C42 C37 -1.2(2) . . . . ?
C40 C41 C42 C57 175.95(14) . . . . ?
C38 C37 C42 C41 0.3(2) . . . . ?
N2 C37 C42 C41 179.84(13) . . . . ?
C38 C37 C42 C57 -176.85(13) . . . . ?
N2 C37 C42 C57 2.7(2) . . . . ?
C39 C38 C43 C50 -81.92(17) . . . . ?
C37 C38 C43 C50 99.06(16) . . . . ?
C39 C38 C43 C44 48.54(18) . . . . ?
C37 C38 C43 C44 -130.48(14) . . . . ?
C50 C43 C44 C49 21.9(2) . . . . ?
C38 C43 C44 C49 -105.20(18) . . . . ?
C50 C43 C44 C45 -162.05(15) . . . . ?
C38 C43 C44 C45 70.85(18) . . . . ?
C49 C44 C45 C46 1.8(3) . . . . ?
C43 C44 C45 C46 -174.46(17) . . . . ?
C44 C45 C46 C47 -0.5(3) . . . . ?
C45 C46 C47 C48 -0.8(3) . . . . ?
C46 C47 C48 C49 0.8(3) . . . . ?
C45 C44 C49 C48 -1.9(3) . . . . ?
C43 C44 C49 C48 174.13(16) . . . . ?
C47 C48 C49 C44 0.6(3) . . . . ?
C38 C43 C50 C51 -122.21(16) . . . . ?
C44 C43 C50 C51 111.50(17) . . . . ?
C38 C43 C50 C55 55.20(19) . . . . ?
C44 C43 C50 C55 -71.09(19) . . . . ?
C55 C50 C51 C52 -0.1(2) . . . . ?
C43 C50 C51 C52 177.42(15) . . . . ?
C50 C51 C52 C53 -0.1(3) . . . . ?
C51 C52 C53 C54 0.4(3) . . . . ?
C52 C53 C54 C55 -0.5(3) . . . . ?
C53 C54 C55 C50 0.2(3) . . . . ?
C51 C50 C55 C54 0.1(2) . . . . ?
C43 C50 C55 C54 -177.35(14) . . . . ?
C41 C42 C57 C58 55.05(18) . . . . ?
C37 C42 C57 C58 -127.90(15) . . . . ?
C41 C42 C57 C64 -74.95(17) . . . . ?
C37 C42 C57 C64 102.11(16) . . . . ?
C42 C57 C58 C59 80.90(17) . . . . ?
C64 C57 C58 C59 -150.04(14) . . . . ?
C42 C57 C58 C63 -99.44(17) . . . . ?
C64 C57 C58 C63 29.6(2) . . . . ?
C63 C58 C59 C60 0.0(3) . . . . ?
C57 C58 C59 C60 179.66(15) . . . . ?
C58 C59 C60 C61 -0.4(3) . . . . ?
C59 C60 C61 C62 0.5(3) . . . . ?
C60 C61 C62 C63 -0.2(3) . . . . ?
C59 C58 C63 C62 0.3(3) . . . . ?
C57 C58 C63 C62 -179.34(16) . . . . ?
C61 C62 C63 C58 -0.2(3) . . . . ?
C42 C57 C64 C69 -5.4(2) . . . . ?
C58 C57 C64 C69 -133.84(16) . . . . ?
C42 C57 C64 C65 178.95(15) . . . . ?
C58 C57 C64 C65 50.5(2) . . . . ?
C69 C64 C65 C66 0.1(3) . . . . ?
C57 C64 C65 C66 176.02(18) . . . . ?
C64 C65 C66 C67 -0.5(3) . . . . ?
C65 C66 C67 C68 0.1(3) . . . . ?
C66 C67 C68 C69 0.7(3) . . . . ?
C65 C64 C69 C68 0.6(3) . . . . ?
C57 C64 C69 C68 -175.07(16) . . . . ?
C67 C68 C69 C64 -1.0(3) . . . . ?
O1 C70 C71 C74 170.43(18) . . . . ?
O1 C70 C71 C72 51.2(2) . . . . ?
O1 C70 C71 C73 -68.8(2) . . . . ?
C74 C71 C72 O2 -174.32(18) . . . . ?
C73 C71 C72 O2 65.2(2) . . . . ?
C70 C71 C72 O2 -55.1(2) . . . . ?
N2 C1 N1 C2 0.00(16) . . . . ?
Cu1 C1 N1 C2 -170.60(11) . . . . ?
N2 C1 N1 C4 -177.77(12) . . . . ?
Cu1 C1 N1 C4 11.6(2) . . . . ?
C3 C2 N1 C1 -0.02(17) . . . . ?
C3 C2 N1 C4 177.72(13) . . . . ?
C9 C4 N1 C1 -88.80(19) . . . . ?
C5 C4 N1 C1 91.16(18) . . . . ?
C9 C4 N1 C2 93.71(18) . . . . ?
C5 C4 N1 C2 -86.33(19) . . . . ?
N1 C1 N2 C3 0.02(15) . . . . ?
Cu1 C1 N2 C3 170.47(11) . . . . ?
N1 C1 N2 C37 177.23(12) . . . . ?
Cu1 C1 N2 C37 -12.3(2) . . . . ?
C2 C3 N2 C1 -0.03(17) . . . . ?
C2 C3 N2 C37 -177.20(13) . . . . ?
C42 C37 N2 C1 -80.87(18) . . . . ?
C38 C37 N2 C1 98.71(17) . . . . ?
C42 C37 N2 C3 95.99(17) . . . . ?
C38 C37 N2 C3 -84.43(18) . . . . ?
O2 B1 O1 C70 -3.2(3) . . . . ?
Cu1 B1 O1 C70 174.64(14) . . . . ?
C71 C70 O1 B1 -24.0(3) . . . . ?
O1 B1 O2 C72 -1.3(3) . . . . ?
Cu1 B1 O2 C72 -179.14(13) . . . . ?
C71 C72 O2 B1 32.6(3) . . . . ?

_refine_diff_density_max         0.536
_refine_diff_density_min         -0.885
_refine_diff_density_rms         0.049

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_wo13ck
_database_code_depnum_ccdc_archive 'CCDC 2008214'
loop_
_audit_author_name
_audit_author_address
'Christian Kleeberg'
;Technische Universitaet Braunschweig, Institut fuer Anorganische und Analytische Chemie
Germany
;
_audit_update_record             
;
2020-06-05 deposited with the CCDC.	2020-07-28 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C54 H72 Cu N4, C10 H20 B O4'
_chemical_formula_sum            'C64 H92 B Cu N4 O4'
_chemical_formula_weight         1055.76

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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'
B B 0.0090 0.0039 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu -1.9646 0.5888 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0492 0.0322 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_H-M_alt        'C 2/c'
_space_group_name_Hall           '-C 2yc'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, -y+1/2, z-1/2'

_cell_length_a                   16.1031(3)
_cell_length_b                   18.2156(3)
_cell_length_c                   20.4319(4)
_cell_angle_alpha                90
_cell_angle_beta                 97.627(2)
_cell_angle_gamma                90
_cell_volume                     5940.22(19)
_cell_formula_units_Z            4
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    20183
_cell_measurement_theta_min      3.670
_cell_measurement_theta_max      77.347

_exptl_crystal_description       rhombohedron
_exptl_crystal_colour            'clear colourless'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    1.181
_exptl_crystal_F_000             2280
_exptl_crystal_size_max          0.123
_exptl_crystal_size_mid          0.060
_exptl_crystal_size_min          0.047
_exptl_absorpt_coefficient_mu    0.891
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.784
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_process_details   
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2019)
 Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
 
  Empirical correction (ABSPACK) includes:
     - Absorption correction using spherical harmonics
     - Frame scaling
     - Detector area scaling
;


_exptl_crystal_recrystallization_method 
;
 From a solution in THF colled from rt to -40 deg C.
;

_exptl_special_details           
;
 The crystal was mounted at rt with perfluoroether oil on top of a MITEGEN
 mount and placed in a cold nitrogen gas stream on the diffractometer.

 The collected data cover more than a hemisphere of the reciprocal space.
 A combination of 21 sets of ω scans were used; each set at different \j,
 2θ or κ angles and each scan 0.5 deg in ω.
 Each frame was exposured for 0.5 s (low 2θ angles) or 2 s (high 2θ angles).
 Nominal crystal to detector distance 32 mm.
;




_diffrn_radiation_wavelength     1.54184
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_type           CuK\a
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'PhotonJet (Cu) X-ray Source'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  
'XtaLAB Synergy, Single source at home/near, HyPix'
_diffrn_detector                 'CCD plate'
_diffrn_detector_type            HyPix
_diffrn_measurement_method       ω-scan
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            33152
_diffrn_reflns_av_unetI/netI     0.0253
_diffrn_reflns_av_R_equivalents  0.0337
_diffrn_reflns_limit_h_min       -20
_diffrn_reflns_limit_h_max       19
_diffrn_reflns_limit_k_min       -23
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_theta_min         3.682
_diffrn_reflns_theta_max         77.725
_diffrn_reflns_theta_full        67.684
_diffrn_measured_fraction_theta_max 0.980
_diffrn_measured_fraction_theta_full 0.998
_diffrn_reflns_Laue_measured_fraction_max 0.980
_diffrn_reflns_Laue_measured_fraction_full 0.998
_diffrn_reflns_point_group_measured_fraction_max 0.980
_diffrn_reflns_point_group_measured_fraction_full 0.998
_reflns_number_total             6219
_reflns_number_gt                5748
_reflns_threshold_expression     'I > 2σ(I)'


_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
;




_computing_data_collection       
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2018)
;
_computing_cell_refinement       
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2018)
;
_computing_data_reduction        
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2018)
;
_computing_structure_solution    
;
 SHELXT (Ver. 2018/2) (G. M. Sheldrick, Acta Cryst., 2015, A71, 3--8)
;
_computing_structure_refinement  
;
 SHELXL-2018/3 (G. M. Sheldrick, Acta Cryst., 2015, A71, 3--8)
;
_computing_molecular_graphics    
;
 K. Brandenburg, 2017, Diamond 4.4.1, Crystal Impact GbR, Bonn, Germany.
;
_computing_publication_material  
;
 Olex2 (Dolomanov et al., J. Appl. Cryst., 2009, 42, 339-341)
;




_refine_special_details          
;
 All H atoms were placed in idealised positions and refined using a riding
 model, with a common U restrained to be 1.2 (1.5 for methyl groups) times
 the equivalent isotropic displacement parameter of the parent atom.
 Methyl groups were treated as a rigid bodies and allowed to rotate about
 the E-CH3 bond but not to tip.


 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;




_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0393P)²+7.1922P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         6219
_refine_ls_number_parameters     345
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0420
_refine_ls_R_factor_gt           0.0390
_refine_ls_wR_factor_ref         0.0984
_refine_ls_wR_factor_gt          0.0965
_refine_ls_goodness_of_fit_ref   1.039
_refine_ls_restrained_S_all      1.039
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000

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
Cu1 Cu 1.000000 0.59878(2) 0.750000 0.01803(9) Uani 1 2 d S T P . .
N1 N 0.82946(7) 0.65830(6) 0.74886(6) 0.0191(2) Uani 1 1 d . . . . .
N2 N 0.82571(7) 0.54179(6) 0.73836(6) 0.0197(2) Uani 1 1 d . . . . .
C1 C 0.88002(8) 0.59930(7) 0.74431(6) 0.0190(3) Uani 1 1 d . . . . .
C2 C 0.74630(8) 0.63758(8) 0.74711(7) 0.0217(3) Uani 1 1 d . . . . .
H2 H 0.700081 0.669165 0.750382 0.026 Uiso 1 1 calc R U . . .
C3 C 0.74368(8) 0.56464(8) 0.73995(7) 0.0220(3) Uani 1 1 d . . . . .
H3 H 0.695262 0.534370 0.736609 0.026 Uiso 1 1 calc R U . . .
C4 C 0.85688(8) 0.73260(8) 0.76321(8) 0.0240(3) Uani 1 1 d . . . . .
C5 C 0.86941(9) 0.75212(9) 0.82982(8) 0.0300(3) Uani 1 1 d . . . . .
C6 C 0.89229(11) 0.82509(10) 0.84393(10) 0.0399(4) Uani 1 1 d . . . . .
H6 H 0.901606 0.841263 0.888505 0.048 Uiso 1 1 calc R U . . .
C7 C 0.90145(11) 0.87379(9) 0.79360(12) 0.0462(5) Uani 1 1 d . . . . .
H7 H 0.917198 0.923083 0.804144 0.055 Uiso 1 1 calc R U . . .
C8 C 0.88818(10) 0.85226(9) 0.72821(11) 0.0414(4) Uani 1 1 d . . . . .
H8 H 0.895130 0.886967 0.694658 0.050 Uiso 1 1 calc R U . . .
C9 C 0.86475(9) 0.78046(9) 0.71057(9) 0.0316(3) Uani 1 1 d . . . . .
C10 C 0.85997(10) 0.69710(10) 0.88482(8) 0.0333(3) Uani 1 1 d . . . . .
H10 H 0.835158 0.651284 0.863474 0.040 Uiso 1 1 calc R U . . .
C11 C 0.94402(13) 0.67686(13) 0.92304(11) 0.0519(5) Uani 1 1 d . . . . .
H11A H 0.979332 0.654197 0.893099 0.078 Uiso 1 1 calc R U . . .
H11B H 0.935579 0.642094 0.958166 0.078 Uiso 1 1 calc R U . . .
H11C H 0.971490 0.721197 0.942572 0.078 Uiso 1 1 calc R U . . .
C12 C 0.80051(13) 0.72462(12) 0.93131(10) 0.0463(5) Uani 1 1 d . . . . .
H12A H 0.821579 0.771046 0.951313 0.070 Uiso 1 1 calc R U . . .
H12B H 0.796805 0.688170 0.966075 0.070 Uiso 1 1 calc R U . . .
H12C H 0.744830 0.732403 0.906496 0.070 Uiso 1 1 calc R U . . .
C13 C 0.84976(11) 0.75476(11) 0.63888(9) 0.0392(4) Uani 1 1 d . . . . .
H13 H 0.879931 0.707043 0.636508 0.047 Uiso 1 1 calc R U . . .
C14 C 0.88426(12) 0.80788(13) 0.59073(11) 0.0548(6) Uani 1 1 d . . . . .
H14A H 0.853279 0.854273 0.589520 0.082 Uiso 1 1 calc R U . . .
H14B H 0.877761 0.786150 0.546467 0.082 Uiso 1 1 calc R U . . .
H14C H 0.943758 0.817118 0.605473 0.082 Uiso 1 1 calc R U . . .
C15 C 0.75664(13) 0.74081(13) 0.61335(10) 0.0514(5) Uani 1 1 d . . . . .
H15A H 0.735865 0.700152 0.638079 0.077 Uiso 1 1 calc R U . . .
H15B H 0.750750 0.728221 0.566333 0.077 Uiso 1 1 calc R U . . .
H15C H 0.724113 0.785185 0.619429 0.077 Uiso 1 1 calc R U . . .
C16 C 0.84591(9) 0.46626(8) 0.72618(8) 0.0248(3) Uani 1 1 d . . . . .
C17 C 0.83030(9) 0.44203(9) 0.66074(8) 0.0301(3) Uani 1 1 d . . . . .
C18 C 0.84456(11) 0.36759(10) 0.64962(10) 0.0408(4) Uani 1 1 d . . . . .
H18 H 0.834601 0.348523 0.606006 0.049 Uiso 1 1 calc R U . . .
C19 C 0.87300(12) 0.32158(9) 0.70150(12) 0.0464(5) Uani 1 1 d . . . . .
H19 H 0.882304 0.271172 0.693040 0.056 Uiso 1 1 calc R U . . .
C20 C 0.88814(11) 0.34753(9) 0.76540(11) 0.0412(4) Uani 1 1 d . . . . .
H20 H 0.908170 0.314767 0.800109 0.049 Uiso 1 1 calc R U . . .
C21 C 0.87453(9) 0.42125(9) 0.77998(9) 0.0306(3) Uani 1 1 d . . . . .
C22 C 0.79995(10) 0.49424(10) 0.60442(8) 0.0339(4) Uani 1 1 d . . . . .
H22 H 0.767147 0.533879 0.623120 0.041 Uiso 1 1 calc R U . . .
C23 C 0.87409(12) 0.53115(11) 0.57771(9) 0.0437(4) Uani 1 1 d . . . . .
H23A H 0.910990 0.553562 0.614296 0.065 Uiso 1 1 calc R U . . .
H23B H 0.853254 0.569164 0.545748 0.065 Uiso 1 1 calc R U . . .
H23C H 0.905446 0.494343 0.556020 0.065 Uiso 1 1 calc R U . . .
C24 C 0.74198(13) 0.45827(13) 0.54838(10) 0.0486(5) Uani 1 1 d . . . . .
H24A H 0.773953 0.423234 0.525245 0.073 Uiso 1 1 calc R U . . .
H24B H 0.717952 0.496074 0.517362 0.073 Uiso 1 1 calc R U . . .
H24C H 0.696805 0.432406 0.566531 0.073 Uiso 1 1 calc R U . . .
C25 C 0.88769(11) 0.45092(10) 0.85005(9) 0.0362(4) Uani 1 1 d . . . . .
H25 H 0.916133 0.499617 0.848916 0.043 Uiso 1 1 calc R U . . .
C26 C 0.94347(12) 0.40191(12) 0.89844(11) 0.0511(5) Uani 1 1 d . . . . .
H26A H 0.914215 0.355775 0.904709 0.077 Uiso 1 1 calc R U . . .
H26B H 0.956080 0.427158 0.940950 0.077 Uiso 1 1 calc R U . . .
H26C H 0.995796 0.391421 0.880629 0.077 Uiso 1 1 calc R U . . .
C27 C 0.80417(13) 0.46352(12) 0.87718(10) 0.0477(5) Uani 1 1 d . . . . .
H27A H 0.769535 0.497781 0.848338 0.072 Uiso 1 1 calc R U . . .
H27B H 0.815182 0.484155 0.921785 0.072 Uiso 1 1 calc R U . . .
H27C H 0.774580 0.416666 0.878695 0.072 Uiso 1 1 calc R U . . .
O1 O 0.56320(6) 0.61622(6) 0.72393(5) 0.0282(2) Uani 1 1 d . . . . .
O2 O 0.45698(8) 0.52191(6) 0.69908(6) 0.0388(3) Uani 1 1 d . . . . .
C28 C 0.53160(10) 0.65463(9) 0.66631(8) 0.0296(3) Uani 1 1 d . . . . .
H28A H 0.577804 0.682156 0.650103 0.036 Uiso 1 1 calc R U . . .
H28B H 0.489388 0.690655 0.677016 0.036 Uiso 1 1 calc R U . . .
C29 C 0.49140(10) 0.60363(9) 0.61165(8) 0.0296(3) Uani 1 1 d . . . . .
C30 C 0.42479(11) 0.55895(10) 0.64059(8) 0.0370(4) Uani 1 1 d . . . . .
H30A H 0.379190 0.592182 0.650005 0.044 Uiso 1 1 calc R U . . .
H30B H 0.400480 0.522565 0.607467 0.044 Uiso 1 1 calc R U . . .
C31 C 0.45055(12) 0.64896(11) 0.55356(9) 0.0420(4) Uani 1 1 d . . . . .
H31A H 0.408397 0.681590 0.568389 0.063 Uiso 1 1 calc R U . . .
H31B H 0.423589 0.616117 0.519117 0.063 Uiso 1 1 calc R U . . .
H31C H 0.493341 0.678353 0.535760 0.063 Uiso 1 1 calc R U . . .
C32 C 0.55863(13) 0.55393(11) 0.58931(9) 0.0454(5) Uani 1 1 d . . . . .
H32A H 0.598803 0.583753 0.568830 0.068 Uiso 1 1 calc R U . . .
H32B H 0.532314 0.518203 0.557170 0.068 Uiso 1 1 calc R U . . .
H32C H 0.587936 0.527932 0.627577 0.068 Uiso 1 1 calc R U . . .
B1 B 0.500000 0.56941(13) 0.750000 0.0259(5) Uani 1 2 d S T P . .


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
Cu1 C1 1.9201(13) 2_756 ?
Cu1 C1 1.9201(13) . ?
N1 C1 1.3589(17) . ?
N1 C2 1.3872(17) . ?
N1 C4 1.4418(18) . ?
N2 C1 1.3597(17) . ?
N2 C3 1.3893(17) . ?
N2 C16 1.4431(17) . ?
C2 C3 1.337(2) . ?
C2 H2 0.9500 . ?
C3 H3 0.9500 . ?
C4 C5 1.395(2) . ?
C4 C9 1.403(2) . ?
C5 C6 1.399(2) . ?
C5 C10 1.528(2) . ?
C6 C7 1.381(3) . ?
C6 H6 0.9500 . ?
C7 C8 1.381(3) . ?
C7 H7 0.9500 . ?
C8 C9 1.395(2) . ?
C8 H8 0.9500 . ?
C9 C13 1.526(3) . ?
C10 C11 1.516(3) . ?
C10 C12 1.520(2) . ?
C10 H10 1.0000 . ?
C11 H11A 0.9800 . ?
C11 H11B 0.9800 . ?
C11 H11C 0.9800 . ?
C12 H12A 0.9800 . ?
C12 H12B 0.9800 . ?
C12 H12C 0.9800 . ?
C13 C14 1.536(2) . ?
C13 C15 1.542(3) . ?
C13 H13 1.0000 . ?
C14 H14A 0.9800 . ?
C14 H14B 0.9800 . ?
C14 H14C 0.9800 . ?
C15 H15A 0.9800 . ?
C15 H15B 0.9800 . ?
C15 H15C 0.9800 . ?
C16 C17 1.399(2) . ?
C16 C21 1.399(2) . ?
C17 C18 1.399(2) . ?
C17 C22 1.522(2) . ?
C18 C19 1.381(3) . ?
C18 H18 0.9500 . ?
C19 C20 1.379(3) . ?
C19 H19 0.9500 . ?
C20 C21 1.399(2) . ?
C20 H20 0.9500 . ?
C21 C25 1.519(3) . ?
C22 C24 1.526(2) . ?
C22 C23 1.532(2) . ?
C22 H22 1.0000 . ?
C23 H23A 0.9800 . ?
C23 H23B 0.9800 . ?
C23 H23C 0.9800 . ?
C24 H24A 0.9800 . ?
C24 H24B 0.9800 . ?
C24 H24C 0.9800 . ?
C25 C26 1.532(2) . ?
C25 C27 1.538(2) . ?
C25 H25 1.0000 . ?
C26 H26A 0.9800 . ?
C26 H26B 0.9800 . ?
C26 H26C 0.9800 . ?
C27 H27A 0.9800 . ?
C27 H27B 0.9800 . ?
C27 H27C 0.9800 . ?
O1 C28 1.4055(19) . ?
O1 B1 1.4800(17) . ?
O2 C30 1.4100(19) . ?
O2 B1 1.4558(18) . ?
C28 C29 1.529(2) . ?
C28 H28A 0.9900 . ?
C28 H28B 0.9900 . ?
C29 C31 1.522(2) . ?
C29 C30 1.527(2) . ?
C29 C32 1.527(2) . ?
C30 H30A 0.9900 . ?
C30 H30B 0.9900 . ?
C31 H31A 0.9800 . ?
C31 H31B 0.9800 . ?
C31 H31C 0.9800 . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?

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
_geom_angle_publ_flag
C1 Cu1 C1 179.44(8) 2_756 . ?
C1 N1 C2 111.61(11) . . ?
C1 N1 C4 125.89(11) . . ?
C2 N1 C4 121.95(11) . . ?
C1 N2 C3 111.68(11) . . ?
C1 N2 C16 126.36(11) . . ?
C3 N2 C16 121.76(11) . . ?
N1 C1 N2 103.37(11) . . ?
N1 C1 Cu1 127.37(10) . . ?
N2 C1 Cu1 129.18(10) . . ?
C3 C2 N1 106.82(12) . . ?
C3 C2 H2 126.6 . . ?
N1 C2 H2 126.6 . . ?
C2 C3 N2 106.50(12) . . ?
C2 C3 H3 126.7 . . ?
N2 C3 H3 126.7 . . ?
C5 C4 C9 124.98(14) . . ?
C5 C4 N1 116.00(13) . . ?
C9 C4 N1 118.93(14) . . ?
C4 C5 C6 116.30(16) . . ?
C4 C5 C10 122.31(14) . . ?
C6 C5 C10 121.38(16) . . ?
C7 C6 C5 120.54(18) . . ?
C7 C6 H6 119.7 . . ?
C5 C6 H6 119.7 . . ?
C6 C7 C8 121.32(16) . . ?
C6 C7 H7 119.3 . . ?
C8 C7 H7 119.3 . . ?
C7 C8 C9 121.18(17) . . ?
C7 C8 H8 119.4 . . ?
C9 C8 H8 119.4 . . ?
C8 C9 C4 115.67(17) . . ?
C8 C9 C13 122.58(16) . . ?
C4 C9 C13 121.75(14) . . ?
C11 C10 C12 110.59(16) . . ?
C11 C10 C5 111.66(15) . . ?
C12 C10 C5 112.05(14) . . ?
C11 C10 H10 107.4 . . ?
C12 C10 H10 107.4 . . ?
C5 C10 H10 107.4 . . ?
C10 C11 H11A 109.5 . . ?
C10 C11 H11B 109.5 . . ?
H11A C11 H11B 109.5 . . ?
C10 C11 H11C 109.5 . . ?
H11A C11 H11C 109.5 . . ?
H11B C11 H11C 109.5 . . ?
C10 C12 H12A 109.5 . . ?
C10 C12 H12B 109.5 . . ?
H12A C12 H12B 109.5 . . ?
C10 C12 H12C 109.5 . . ?
H12A C12 H12C 109.5 . . ?
H12B C12 H12C 109.5 . . ?
C9 C13 C14 113.39(17) . . ?
C9 C13 C15 113.45(15) . . ?
C14 C13 C15 107.78(15) . . ?
C9 C13 H13 107.3 . . ?
C14 C13 H13 107.3 . . ?
C15 C13 H13 107.3 . . ?
C13 C14 H14A 109.5 . . ?
C13 C14 H14B 109.5 . . ?
H14A C14 H14B 109.5 . . ?
C13 C14 H14C 109.5 . . ?
H14A C14 H14C 109.5 . . ?
H14B C14 H14C 109.5 . . ?
C13 C15 H15A 109.5 . . ?
C13 C15 H15B 109.5 . . ?
H15A C15 H15B 109.5 . . ?
C13 C15 H15C 109.5 . . ?
H15A C15 H15C 109.5 . . ?
H15B C15 H15C 109.5 . . ?
C17 C16 C21 124.38(14) . . ?
C17 C16 N2 116.72(14) . . ?
C21 C16 N2 118.78(14) . . ?
C16 C17 C18 116.64(16) . . ?
C16 C17 C22 121.63(13) . . ?
C18 C17 C22 121.73(16) . . ?
C19 C18 C17 120.56(17) . . ?
C19 C18 H18 119.7 . . ?
C17 C18 H18 119.7 . . ?
C20 C19 C18 121.17(16) . . ?
C20 C19 H19 119.4 . . ?
C18 C19 H19 119.4 . . ?
C19 C20 C21 121.16(18) . . ?
C19 C20 H20 119.4 . . ?
C21 C20 H20 119.4 . . ?
C20 C21 C16 116.08(16) . . ?
C20 C21 C25 122.42(16) . . ?
C16 C21 C25 121.48(14) . . ?
C17 C22 C24 113.71(15) . . ?
C17 C22 C23 110.86(14) . . ?
C24 C22 C23 110.43(14) . . ?
C17 C22 H22 107.2 . . ?
C24 C22 H22 107.2 . . ?
C23 C22 H22 107.2 . . ?
C22 C23 H23A 109.5 . . ?
C22 C23 H23B 109.5 . . ?
H23A C23 H23B 109.5 . . ?
C22 C23 H23C 109.5 . . ?
H23A C23 H23C 109.5 . . ?
H23B C23 H23C 109.5 . . ?
C22 C24 H24A 109.5 . . ?
C22 C24 H24B 109.5 . . ?
H24A C24 H24B 109.5 . . ?
C22 C24 H24C 109.5 . . ?
H24A C24 H24C 109.5 . . ?
H24B C24 H24C 109.5 . . ?
C21 C25 C26 113.43(16) . . ?
C21 C25 C27 111.93(15) . . ?
C26 C25 C27 108.68(15) . . ?
C21 C25 H25 107.5 . . ?
C26 C25 H25 107.5 . . ?
C27 C25 H25 107.5 . . ?
C25 C26 H26A 109.5 . . ?
C25 C26 H26B 109.5 . . ?
H26A C26 H26B 109.5 . . ?
C25 C26 H26C 109.5 . . ?
H26A C26 H26C 109.5 . . ?
H26B C26 H26C 109.5 . . ?
C25 C27 H27A 109.5 . . ?
C25 C27 H27B 109.5 . . ?
H27A C27 H27B 109.5 . . ?
C25 C27 H27C 109.5 . . ?
H27A C27 H27C 109.5 . . ?
H27B C27 H27C 109.5 . . ?
C28 O1 B1 113.48(9) . . ?
C30 O2 B1 114.07(13) . . ?
O1 C28 C29 112.37(13) . . ?
O1 C28 H28A 109.1 . . ?
C29 C28 H28A 109.1 . . ?
O1 C28 H28B 109.1 . . ?
C29 C28 H28B 109.1 . . ?
H28A C28 H28B 107.9 . . ?
C31 C29 C30 109.75(14) . . ?
C31 C29 C32 109.80(14) . . ?
C30 C29 C32 111.23(15) . . ?
C31 C29 C28 109.72(14) . . ?
C30 C29 C28 106.99(13) . . ?
C32 C29 C28 109.29(14) . . ?
O2 C30 C29 112.66(14) . . ?
O2 C30 H30A 109.1 . . ?
C29 C30 H30A 109.1 . . ?
O2 C30 H30B 109.1 . . ?
C29 C30 H30B 109.1 . . ?
H30A C30 H30B 107.8 . . ?
C29 C31 H31A 109.5 . . ?
C29 C31 H31B 109.5 . . ?
H31A C31 H31B 109.5 . . ?
C29 C31 H31C 109.5 . . ?
H31A C31 H31C 109.5 . . ?
H31B C31 H31C 109.5 . . ?
C29 C32 H32A 109.5 . . ?
C29 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C29 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
O2 B1 O2 107.07(18) 2_656 . ?
O2 B1 O1 108.35(7) 2_656 . ?
O2 B1 O1 111.71(6) . . ?
O2 B1 O1 111.72(6) 2_656 2_656 ?
O2 B1 O1 108.35(7) . 2_656 ?
O1 B1 O1 109.63(17) . 2_656 ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
C2 N1 C1 N2 1.19(15) . . . . ?
C4 N1 C1 N2 172.76(12) . . . . ?
C2 N1 C1 Cu1 -175.78(10) . . . . ?
C4 N1 C1 Cu1 -4.2(2) . . . . ?
C3 N2 C1 N1 -0.66(15) . . . . ?
C16 N2 C1 N1 174.31(13) . . . . ?
C3 N2 C1 Cu1 176.23(10) . . . . ?
C16 N2 C1 Cu1 -8.8(2) . . . . ?
C1 N1 C2 C3 -1.30(16) . . . . ?
C4 N1 C2 C3 -173.25(13) . . . . ?
N1 C2 C3 N2 0.81(15) . . . . ?
C1 N2 C3 C2 -0.10(16) . . . . ?
C16 N2 C3 C2 -175.34(13) . . . . ?
C1 N1 C4 C5 -90.08(16) . . . . ?
C2 N1 C4 C5 80.68(17) . . . . ?
C1 N1 C4 C9 93.18(17) . . . . ?
C2 N1 C4 C9 -96.06(16) . . . . ?
C9 C4 C5 C6 -0.6(2) . . . . ?
N1 C4 C5 C6 -177.16(13) . . . . ?
C9 C4 C5 C10 -179.87(14) . . . . ?
N1 C4 C5 C10 3.6(2) . . . . ?
C4 C5 C6 C7 0.0(2) . . . . ?
C10 C5 C6 C7 179.25(15) . . . . ?
C5 C6 C7 C8 0.2(3) . . . . ?
C6 C7 C8 C9 0.2(3) . . . . ?
C7 C8 C9 C4 -0.7(2) . . . . ?
C7 C8 C9 C13 -179.86(15) . . . . ?
C5 C4 C9 C8 1.0(2) . . . . ?
N1 C4 C9 C8 177.42(13) . . . . ?
C5 C4 C9 C13 -179.87(14) . . . . ?
N1 C4 C9 C13 -3.4(2) . . . . ?
C4 C5 C10 C11 108.32(18) . . . . ?
C6 C5 C10 C11 -70.9(2) . . . . ?
C4 C5 C10 C12 -126.99(17) . . . . ?
C6 C5 C10 C12 53.8(2) . . . . ?
C8 C9 C13 C14 14.9(2) . . . . ?
C4 C9 C13 C14 -164.16(15) . . . . ?
C8 C9 C13 C15 -108.48(19) . . . . ?
C4 C9 C13 C15 72.5(2) . . . . ?
C1 N2 C16 C17 -97.49(17) . . . . ?
C3 N2 C16 C17 77.02(17) . . . . ?
C1 N2 C16 C21 86.33(17) . . . . ?
C3 N2 C16 C21 -99.16(16) . . . . ?
C21 C16 C17 C18 0.1(2) . . . . ?
N2 C16 C17 C18 -175.81(13) . . . . ?
C21 C16 C17 C22 -179.41(14) . . . . ?
N2 C16 C17 C22 4.6(2) . . . . ?
C16 C17 C18 C19 -0.3(2) . . . . ?
C22 C17 C18 C19 179.26(15) . . . . ?
C17 C18 C19 C20 -0.1(3) . . . . ?
C18 C19 C20 C21 0.6(3) . . . . ?
C19 C20 C21 C16 -0.7(2) . . . . ?
C19 C20 C21 C25 177.82(15) . . . . ?
C17 C16 C21 C20 0.3(2) . . . . ?
N2 C16 C21 C20 176.21(13) . . . . ?
C17 C16 C21 C25 -178.17(14) . . . . ?
N2 C16 C21 C25 -2.3(2) . . . . ?
C16 C17 C22 C24 -147.35(15) . . . . ?
C18 C17 C22 C24 33.1(2) . . . . ?
C16 C17 C22 C23 87.52(17) . . . . ?
C18 C17 C22 C23 -92.00(18) . . . . ?
C20 C21 C25 C26 19.5(2) . . . . ?
C16 C21 C25 C26 -162.12(15) . . . . ?
C20 C21 C25 C27 -103.97(18) . . . . ?
C16 C21 C25 C27 74.46(19) . . . . ?
B1 O1 C28 C29 -55.24(16) . . . . ?
O1 C28 C29 C31 174.10(13) . . . . ?
O1 C28 C29 C30 55.09(17) . . . . ?
O1 C28 C29 C32 -65.45(17) . . . . ?
B1 O2 C30 C29 54.49(19) . . . . ?
C31 C29 C30 O2 -173.42(15) . . . . ?
C32 C29 C30 O2 64.87(19) . . . . ?
C28 C29 C30 O2 -54.43(19) . . . . ?
C30 O2 B1 O2 -169.05(15) . . . 2_656 ?
C30 O2 B1 O1 -50.57(18) . . . . ?
C30 O2 B1 O1 70.30(16) . . . 2_656 ?
C28 O1 B1 O2 168.80(11) . . . 2_656 ?
C28 O1 B1 O2 51.09(17) . . . . ?
C28 O1 B1 O1 -69.04(10) . . . 2_656 ?

_refine_diff_density_max         0.416
_refine_diff_density_min         -0.339
_refine_diff_density_rms         0.044

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_wo12ck
_database_code_depnum_ccdc_archive 'CCDC 2008218'
loop_
_audit_author_name
_audit_author_address
'Christian Kleeberg'
;Technische Universitaet Braunschweig, Institut fuer Anorganische und Analytische Chemie
Germany
;
_audit_update_record             
;
2020-06-05 deposited with the CCDC.	2020-07-28 downloaded from the CCDC.
;

_audit_creation_method           SHELXL-2018/3
_shelx_SHELXL_version_number     2018/3
_chemical_name_systematic        ?
_chemical_name_common            ?
_chemical_melting_point          ?
_chemical_formula_moiety         'C324 H432 Cu179.02 N24'
_chemical_formula_sum            'C324 H432 Cu179.02 N24'
_chemical_formula_weight         16037.94

loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0181 0.0091 '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 0.0311 0.0180 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu -1.9646 0.5888 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'

_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_H-M_alt        'P 21/n'
_space_group_name_Hall           '-P 2yn'

_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.
;

loop_
_space_group_symop_operation_xyz
'x, y, z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x-1/2, -y-1/2, z-1/2'

_cell_length_a                   24.7078(3)
_cell_length_b                   34.1167(6)
_cell_length_c                   26.0758(3)
_cell_angle_alpha                90
_cell_angle_beta                 93.7630(10)
_cell_angle_gamma                90
_cell_volume                     21933.2(5)
_cell_formula_units_Z            2
_cell_measurement_temperature    100(2)
_cell_measurement_reflns_used    80804
_cell_measurement_theta_min      2.38
_cell_measurement_theta_max      76.01

_exptl_crystal_description       block
_exptl_crystal_colour            'metallic black'
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    ?
_exptl_crystal_density_diffrn    2.428
_exptl_crystal_F_000             15471
_exptl_crystal_size_max          0.078
_exptl_crystal_size_mid          0.072
_exptl_crystal_size_min          0.054
_exptl_absorpt_coefficient_mu    9.235
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_correction_T_min  0.775
_exptl_absorpt_correction_T_max  1.000
_exptl_absorpt_process_details   
;
 CrysAlisPro 1.171.40.50a (Rigaku Oxford Diffraction, 2019)
 Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
 
 Empirical correction (ABSPACK) includes:
     - Absorption correction using spherical harmonics
     - Frame scaling
;


_exptl_crystal_recrystallization_method 
;
 From a solution in Et2O layered with n-pentane at rt.
;

_exptl_special_details           
;
 The crystal was mounted at rt with perfluoroether oil on top of a MITEGEN
 mount and placed in a cold nitrogen gas stream on the diffractometer.

 The collected data cover more than a hemisphere of the reciprocal space.
 A combination of 34 sets of ω scans were used; each set at different \j,
 2θ or κ angles and each scan 0.5 deg in ω.
 Each frame was exposured for 5 s (low 2θ angles) or 20 s (high 2θ angles).
 Nominal crystal to detector distance 32 mm.
;


_diffrn_radiation_wavelength     1.54184
_diffrn_ambient_environment      N~2~
_diffrn_ambient_temperature      100(2)
_diffrn_radiation_type           CuK\a
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'PhotonJet (Cu) X-ray Source'
_diffrn_radiation_probe          x-ray
_diffrn_radiation_monochromator  mirror
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  
'XtaLAB Synergy, Single source at home/near, HyPix'
_diffrn_detector                 'CCD plate'
_diffrn_detector_type            HyPix
_diffrn_measurement_method       ω-scan
_diffrn_detector_area_resol_mean ?
_diffrn_reflns_number            405489
_diffrn_reflns_av_unetI/netI     0.0410
_diffrn_reflns_av_R_equivalents  0.0794
_diffrn_reflns_limit_h_min       -29
_diffrn_reflns_limit_h_max       31
_diffrn_reflns_limit_k_min       -42
_diffrn_reflns_limit_k_max       43
_diffrn_reflns_limit_l_min       -33
_diffrn_reflns_limit_l_max       33
_diffrn_reflns_theta_min         2.387
_diffrn_reflns_theta_max         77.838
_diffrn_reflns_theta_full        67.684
_diffrn_measured_fraction_theta_max 0.982
_diffrn_measured_fraction_theta_full 1.000
_diffrn_reflns_Laue_measured_fraction_max 0.982
_diffrn_reflns_Laue_measured_fraction_full 1.000
_diffrn_reflns_point_group_measured_fraction_max 0.982
_diffrn_reflns_point_group_measured_fraction_full 1.000
_reflns_number_total             45979
_reflns_number_gt                31835
_reflns_threshold_expression     'I > 2σ(I)'
_reflns_Friedel_coverage         0.000




_reflns_special_details          
;
 Reflections were merged by SHELXL according to the crystal
 class for the calculation of statistics and refinement.
 
 Structure factors included contributions from the .fab file.
;



_computing_data_collection       
;
 CrysAlisPro 1.171.40.35a (Rigaku Oxford Diffraction, 2018)
;
_computing_cell_refinement       
;
 CrysAlisPro 1.171.40.35a (Rigaku Oxford Diffraction, 2018)
;
_computing_data_reduction        
;
 CrysAlisPro 1.171.40.35a (Rigaku Oxford Diffraction, 2018)
;
_computing_structure_solution    
;
 SHELXT (Ver. 2018/2) (G. M. Sheldrick, Acta Cryst., 2015, A71, 3--8)
;
_computing_structure_refinement  
;
 SHELXL-2018/3 (G. M. Sheldrick, Acta Cryst., 2015, A71, 3--8)
;
_computing_molecular_graphics    
;
 K. Brandenburg, 2017, Diamond 4.4.1, Crystal Impact GbR, Bonn, Germany.
;
_computing_publication_material  
;
 WinGX v2014.1 (L. J. Farrugia, J. Appl. Cryst., 2012, 45, 849-854.)
;



_refine_special_details          
;
 No appropriate model could be established for cocrystallised Et2O molecules;
 the data were processed using the PLATON/SQUEEZE program 
 (A.L.Spek, Acta Cryst. 2009, D65, 148-155).


 All H atoms were placed in idealised positions and refined using a riding
 model, with a common U restrained to be 1.2 (1.5 for methyl groups) times
 the equivalent isotropic displacement parameter of the parent atom.
 Methyl groups were treated as a rigid bodies and placed in idealised 
 positions.


 Refinement of F² against ALL reflections.  The weighted R-factor wR and
 goodness of fit S are based on F², conventional R-factors R are based
 on F, with F set to zero for negative F². The threshold expression of
 F² > 2sigma(F²) is used only for calculating R-factors(gt) etc. and is
 not relevant to the choice of reflections for refinement.  R-factors based
 on F² are statistically about twice as large as those based on F, and R-
 factors based on ALL data will be even larger.
;




_refine_ls_structure_factor_coef Fsqd
_refine_ls_matrix_type           full
_refine_ls_weighting_scheme      calc
_refine_ls_weighting_details     
'w=1/[σ²(Fo²)+(0.0789P)²+26.1778P] where P=(Fo²+2Fc²)/3'
_atom_sites_solution_primary     iterative
_atom_sites_solution_secondary   difmap
_atom_sites_solution_hydrogens   geom
_refine_ls_hydrogen_treatment    constr
_refine_ls_extinction_method     none
_refine_ls_extinction_coef       .
_refine_ls_number_reflns         45979
_refine_ls_number_parameters     2733
_refine_ls_number_restraints     0
_refine_ls_R_factor_all          0.0735
_refine_ls_R_factor_gt           0.0520
_refine_ls_wR_factor_ref         0.1590
_refine_ls_wR_factor_gt          0.1447
_refine_ls_goodness_of_fit_ref   1.046
_refine_ls_restrained_S_all      1.046
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000

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
C101 C 0.1346(3) -0.1199(2) -0.3444(3) 0.0723(18) Uani 1 1 d . . . . .
C102 C 0.1579(4) -0.1497(3) -0.4176(3) 0.103(3) Uani 1 1 d . . . . .
H102 H 0.161036 -0.169442 -0.442962 0.124 Uiso 1 1 calc R U . . .
C103 C 0.1774(4) -0.1137(3) -0.4191(3) 0.114(4) Uani 1 1 d . . . . .
H103 H 0.197493 -0.102801 -0.445476 0.136 Uiso 1 1 calc R U . . .
C104 C 0.1072(3) -0.1896(2) -0.3585(3) 0.0757(19) Uani 1 1 d . . . . .
C105 C 0.1339(4) -0.2134(3) -0.3223(3) 0.093(2) Uani 1 1 d . . . . .
C106 C 0.1139(5) -0.2507(3) -0.3162(4) 0.115(3) Uani 1 1 d . . . . .
H106 H 0.131940 -0.268072 -0.292286 0.138 Uiso 1 1 calc R U . . .
C107 C 0.0676(5) -0.2632(3) -0.3446(4) 0.113(3) Uani 1 1 d . . . . .
H107 H 0.054666 -0.289183 -0.340416 0.135 Uiso 1 1 calc R U . . .
C108 C 0.0404(4) -0.2385(3) -0.3785(3) 0.098(3) Uani 1 1 d . . . . .
H108 H 0.007926 -0.246923 -0.396787 0.117 Uiso 1 1 calc R U . . .
C109 C 0.0602(3) -0.2010(3) -0.3863(3) 0.083(2) Uani 1 1 d . . . . .
C110 C 0.1851(4) -0.1996(3) -0.2909(4) 0.113(3) Uani 1 1 d . . . . .
H110 H 0.180199 -0.171035 -0.283999 0.136 Uiso 1 1 calc R U . . .
C111 C 0.1910(6) -0.2201(4) -0.2382(5) 0.154(5) Uani 1 1 d . . . . .
H11A H 0.223913 -0.210797 -0.219041 0.232 Uiso 1 1 calc R U . . .
H11B H 0.159325 -0.214171 -0.218834 0.232 Uiso 1 1 calc R U . . .
H11C H 0.193440 -0.248541 -0.243247 0.232 Uiso 1 1 calc R U . . .
C112 C 0.2360(4) -0.2035(4) -0.3216(5) 0.146(5) Uani 1 1 d . . . . .
H11D H 0.267820 -0.194449 -0.300412 0.219 Uiso 1 1 calc R U . . .
H11E H 0.240968 -0.230980 -0.331023 0.219 Uiso 1 1 calc R U . . .
H11F H 0.231571 -0.187472 -0.352752 0.219 Uiso 1 1 calc R U . . .
C113 C 0.0283(4) -0.1731(3) -0.4220(3) 0.095(2) Uani 1 1 d . . . . .
H113 H 0.054988 -0.154089 -0.434839 0.114 Uiso 1 1 calc R U . . .
C114 C -0.0103(6) -0.1498(5) -0.3923(5) 0.190(8) Uani 1 1 d . . . . .
H11G H 0.009428 -0.137753 -0.362485 0.284 Uiso 1 1 calc R U . . .
H11H H -0.026858 -0.129221 -0.414389 0.284 Uiso 1 1 calc R U . . .
H11I H -0.038657 -0.167061 -0.380613 0.284 Uiso 1 1 calc R U . . .
C115 C 0.0013(7) -0.1926(4) -0.4684(5) 0.190(8) Uani 1 1 d . . . . .
H11J H 0.028267 -0.207439 -0.486356 0.285 Uiso 1 1 calc R U . . .
H11K H -0.026962 -0.210470 -0.457789 0.285 Uiso 1 1 calc R U . . .
H11L H -0.015162 -0.172630 -0.491565 0.285 Uiso 1 1 calc R U . . .
C116 C 0.1765(4) -0.0548(3) -0.3604(3) 0.094(3) Uani 1 1 d . . . . .
C117 C 0.2247(4) -0.0498(3) -0.3297(4) 0.102(3) Uani 1 1 d . . . . .
C118 C 0.2360(4) -0.0119(4) -0.3115(4) 0.106(3) Uani 1 1 d . . . . .
H118 H 0.267187 -0.007076 -0.289129 0.127 Uiso 1 1 calc R U . . .
C119 C 0.2019(5) 0.0177(4) -0.3261(4) 0.116(4) Uani 1 1 d . . . . .
H119 H 0.209796 0.043327 -0.313501 0.139 Uiso 1 1 calc R U . . .
C120 C 0.1553(5) 0.0120(3) -0.3592(4) 0.112(3) Uani 1 1 d . . . . .
H120 H 0.133004 0.033620 -0.369415 0.134 Uiso 1 1 calc R U . . .
C121 C 0.1423(4) -0.0246(3) -0.3764(4) 0.095(3) Uani 1 1 d . . . . .
C122 C 0.2634(4) -0.0824(4) -0.3156(4) 0.128(4) Uani 1 1 d . . . . .
H122 H 0.241516 -0.106969 -0.314230 0.153 Uiso 1 1 calc R U . . .
C123 C 0.2948(4) -0.0782(4) -0.2642(5) 0.148(5) Uani 1 1 d . . . . .
H12A H 0.318873 -0.100815 -0.258414 0.221 Uiso 1 1 calc R U . . .
H12B H 0.316450 -0.054119 -0.263920 0.221 Uiso 1 1 calc R U . . .
H12C H 0.269450 -0.076943 -0.236841 0.221 Uiso 1 1 calc R U . . .
C124 C 0.3044(5) -0.0882(5) -0.3576(5) 0.185(7) Uani 1 1 d . . . . .
H12D H 0.329280 -0.109682 -0.347530 0.277 Uiso 1 1 calc R U . . .
H12E H 0.284707 -0.094690 -0.390373 0.277 Uiso 1 1 calc R U . . .
H12F H 0.325167 -0.064052 -0.361471 0.277 Uiso 1 1 calc R U . . .
C125 C 0.0935(5) -0.0310(4) -0.4147(3) 0.113(3) Uani 1 1 d . . . . .
H125 H 0.087249 -0.059951 -0.417255 0.135 Uiso 1 1 calc R U . . .
C126 C 0.0436(5) -0.0137(5) -0.4018(4) 0.167(7) Uani 1 1 d . . . . .
H12G H 0.015235 -0.019509 -0.428690 0.250 Uiso 1 1 calc R U . . .
H12H H 0.033191 -0.024335 -0.368935 0.250 Uiso 1 1 calc R U . . .
H12I H 0.048215 0.014796 -0.398718 0.250 Uiso 1 1 calc R U . . .
C127 C 0.1117(5) -0.0172(4) -0.4675(4) 0.140(5) Uani 1 1 d . . . . .
H12J H 0.145975 -0.030041 -0.474396 0.210 Uiso 1 1 calc R U . . .
H12K H 0.083898 -0.024208 -0.494485 0.210 Uiso 1 1 calc R U . . .
H12L H 0.116763 0.011247 -0.466963 0.210 Uiso 1 1 calc R U . . .
C201 C -0.0964(3) -0.2706(3) -0.1113(3) 0.083(2) Uani 1 1 d . . . . .
C202 C -0.1214(5) -0.3351(3) -0.1166(4) 0.116(3) Uani 1 1 d . . . . .
H202 H -0.125629 -0.361911 -0.107937 0.139 Uiso 1 1 calc R U . . .
C203 C -0.1383(5) -0.3164(3) -0.1616(4) 0.130(4) Uani 1 1 d . . . . .
H203 H -0.157199 -0.328183 -0.190517 0.156 Uiso 1 1 calc R U . . .
C204 C -0.0725(4) -0.3137(3) -0.0359(4) 0.098(3) Uani 1 1 d . . . . .
C205 C -0.1012(6) -0.3047(4) 0.0060(4) 0.123(4) Uani 1 1 d . . . . .
C206 C -0.0803(8) -0.3128(4) 0.0546(5) 0.150(5) Uani 1 1 d . . . . .
H206 H -0.100280 -0.307954 0.083911 0.180 Uiso 1 1 calc R U . . .
C207 C -0.0272(8) -0.3289(5) 0.0592(6) 0.171(6) Uani 1 1 d . . . . .
H207 H -0.010957 -0.333449 0.092655 0.205 Uiso 1 1 calc R U . . .
C208 C 0.0027(7) -0.3385(4) 0.0166(6) 0.156(5) Uani 1 1 d . . . . .
H208 H 0.037880 -0.349753 0.021153 0.187 Uiso 1 1 calc R U . . .
C209 C -0.0203(5) -0.3313(3) -0.0303(6) 0.126(4) Uani 1 1 d . . . . .
C210 C -0.1593(6) -0.2883(5) -0.0014(6) 0.163(6) Uani 1 1 d . . . . .
H210 H -0.160590 -0.271407 -0.032838 0.195 Uiso 1 1 calc R U . . .
C211 C -0.1722(7) -0.2615(6) 0.0443(6) 0.236(11) Uani 1 1 d . . . . .
H21A H -0.143045 -0.242294 0.050398 0.354 Uiso 1 1 calc R U . . .
H21B H -0.206574 -0.247787 0.036107 0.354 Uiso 1 1 calc R U . . .
H21C H -0.175244 -0.277519 0.075149 0.354 Uiso 1 1 calc R U . . .
C212 C -0.2044(9) -0.3159(8) -0.0081(9) 0.346(19) Uani 1 1 d . . . . .
H21D H -0.238581 -0.301372 -0.012406 0.519 Uiso 1 1 calc R U . . .
H21E H -0.199882 -0.332034 -0.038608 0.519 Uiso 1 1 calc R U . . .
H21F H -0.204855 -0.332779 0.022267 0.519 Uiso 1 1 calc R U . . .
C213 C 0.0094(6) -0.3406(4) -0.0790(6) 0.151(5) Uani 1 1 d . . . . .
H213 H -0.018470 -0.350473 -0.105409 0.181 Uiso 1 1 calc R U . . .
C214 C 0.0378(6) -0.3058(4) -0.1028(7) 0.181(7) Uani 1 1 d . . . . .
H21G H 0.055375 -0.314552 -0.133389 0.271 Uiso 1 1 calc R U . . .
H21H H 0.010953 -0.285494 -0.112550 0.271 Uiso 1 1 calc R U . . .
H21I H 0.065105 -0.295043 -0.077735 0.271 Uiso 1 1 calc R U . . .
C215 C 0.0507(7) -0.3753(5) -0.0665(8) 0.227(10) Uani 1 1 d . . . . .
H21J H 0.031674 -0.397224 -0.051294 0.340 Uiso 1 1 calc R U . . .
H21K H 0.066082 -0.384042 -0.098253 0.340 Uiso 1 1 calc R U . . .
H21L H 0.079940 -0.366212 -0.042158 0.340 Uiso 1 1 calc R U . . .
C216 C -0.1310(5) -0.2486(3) -0.1981(4) 0.108(3) Uani 1 1 d . . . . .
C217 C -0.0920(5) -0.2462(4) -0.2335(4) 0.120(4) Uani 1 1 d . . . . .
C218 C -0.0949(8) -0.2169(4) -0.2704(4) 0.147(5) Uani 1 1 d . . . . .
H218 H -0.068095 -0.214296 -0.294634 0.177 Uiso 1 1 calc R U . . .
C219 C -0.1405(8) -0.1908(5) -0.2701(5) 0.168(7) Uani 1 1 d . . . . .
H219 H -0.143484 -0.170440 -0.295024 0.202 Uiso 1 1 calc R U . . .
C220 C -0.1813(7) -0.1939(5) -0.2344(5) 0.158(6) Uani 1 1 d . . . . .
H220 H -0.211163 -0.176343 -0.235049 0.190 Uiso 1 1 calc R U . . .
C221 C -0.1752(5) -0.2247(4) -0.1976(4) 0.113(3) Uani 1 1 d . . . . .
C222 C -0.0435(8) -0.2755(4) -0.2312(6) 0.169(6) Uani 1 1 d . . . . .
H222 H -0.046129 -0.292227 -0.199931 0.203 Uiso 1 1 calc R U . . .
C223 C 0.0110(7) -0.2554(5) -0.2271(6) 0.217(10) Uani 1 1 d . . . . .
H22A H 0.039832 -0.275155 -0.225827 0.325 Uiso 1 1 calc R U . . .
H22B H 0.014329 -0.238507 -0.257181 0.325 Uiso 1 1 calc R U . . .
H22C H 0.014207 -0.239457 -0.195828 0.325 Uiso 1 1 calc R U . . .
C224 C -0.0484(9) -0.3030(6) -0.2795(7) 0.261(13) Uani 1 1 d . . . . .
H22D H -0.083972 -0.315809 -0.281563 0.392 Uiso 1 1 calc R U . . .
H22E H -0.044500 -0.287370 -0.310561 0.392 Uiso 1 1 calc R U . . .
H22F H -0.019820 -0.322904 -0.276459 0.392 Uiso 1 1 calc R U . . .
C225 C -0.2184(5) -0.2290(4) -0.1583(6) 0.144(5) Uani 1 1 d . . . . .
H225 H -0.200373 -0.234543 -0.123585 0.173 Uiso 1 1 calc R U . . .
C226 C -0.2520(5) -0.1933(4) -0.1558(7) 0.188(8) Uani 1 1 d . . . . .
H22G H -0.279030 -0.196983 -0.130428 0.283 Uiso 1 1 calc R U . . .
H22H H -0.228762 -0.170891 -0.145801 0.283 Uiso 1 1 calc R U . . .
H22I H -0.270370 -0.188277 -0.189637 0.283 Uiso 1 1 calc R U . . .
C227 C -0.2548(6) -0.2648(5) -0.1764(9) 0.239(11) Uani 1 1 d . . . . .
H22J H -0.232307 -0.288328 -0.177899 0.359 Uiso 1 1 calc R U . . .
H22K H -0.282786 -0.268970 -0.151933 0.359 Uiso 1 1 calc R U . . .
H22L H -0.272186 -0.259349 -0.210499 0.359 Uiso 1 1 calc R U . . .
C301 C 0.2897(3) -0.1990(2) -0.0004(4) 0.088(2) Uani 1 1 d . . . . .
C302 C 0.3327(6) -0.2563(4) 0.0195(7) 0.164(6) Uani 1 1 d . . . . .
H302 H 0.338741 -0.282066 0.032425 0.197 Uiso 1 1 calc R U . . .
C303 C 0.3692(5) -0.2322(4) 0.0000(7) 0.171(7) Uani 1 1 d . . . . .
H303 H 0.405864 -0.238090 -0.005710 0.206 Uiso 1 1 calc R U . . .
C304 C 0.2330(5) -0.2499(4) 0.0353(6) 0.130(4) Uani 1 1 d . . . . .
C305 C 0.1991(5) -0.2705(4) -0.0012(6) 0.132(4) Uani 1 1 d . . . . .
C306 C 0.1490(7) -0.2790(5) 0.0118(8) 0.187(7) Uani 1 1 d . . . . .
H306 H 0.125269 -0.293277 -0.011444 0.224 Uiso 1 1 calc R U . . .
C307 C 0.1302(8) -0.2666(6) 0.0608(8) 0.186(7) Uani 1 1 d . . . . .
H307 H 0.094232 -0.272175 0.069402 0.223 Uiso 1 1 calc R U . A 5
C308 C 0.1661(7) -0.2462(6) 0.0953(7) 0.184(7) Uani 1 1 d . . . . .
H308 H 0.153842 -0.237507 0.127183 0.220 Uiso 1 1 calc R U . B 8
C309 C 0.2182(6) -0.2387(4) 0.0839(6) 0.136(4) Uani 1 1 d . . . . .
C310 C 0.2217(5) -0.2842(4) -0.0524(7) 0.143(5) Uani 1 1 d . . . . .
H310 H 0.261883 -0.280055 -0.049769 0.172 Uiso 1 1 calc R U . . .
C311 C 0.1980(7) -0.2611(4) -0.0982(6) 0.169(6) Uani 1 1 d . . . . .
H31A H 0.204770 -0.233089 -0.092556 0.253 Uiso 1 1 calc R U . . .
H31B H 0.215002 -0.269559 -0.129286 0.253 Uiso 1 1 calc R U . . .
H31C H 0.158791 -0.265754 -0.102497 0.253 Uiso 1 1 calc R U . . .
C312 C 0.2110(7) -0.3273(4) -0.0615(8) 0.219(9) Uani 1 1 d . . . . .
H31D H 0.226257 -0.342359 -0.032067 0.328 Uiso 1 1 calc R U . . .
H31E H 0.171817 -0.331776 -0.065873 0.328 Uiso 1 1 calc R U . . .
H31F H 0.228029 -0.335581 -0.092662 0.328 Uiso 1 1 calc R U . . .
C313 C 0.2601(7) -0.2164(5) 0.1224(7) 0.172(6) Uani 1 1 d . . . . .
H313 H 0.277867 -0.196619 0.100719 0.206 Uiso 1 1 calc R U . . .
C314 C 0.2372(8) -0.1938(6) 0.1632(6) 0.240(12) Uani 1 1 d . . . . .
H31G H 0.208685 -0.176511 0.148320 0.360 Uiso 1 1 calc R U . . .
H31H H 0.221833 -0.211705 0.187761 0.360 Uiso 1 1 calc R U . . .
H31I H 0.265835 -0.178008 0.180908 0.360 Uiso 1 1 calc R U . . .
C315 C 0.3043(9) -0.2441(6) 0.1396(10) 0.314(17) Uani 1 1 d . . . . .
H31J H 0.317030 -0.257937 0.109685 0.470 Uiso 1 1 calc R U . . .
H31K H 0.334383 -0.229483 0.156715 0.470 Uiso 1 1 calc R U . . .
H31L H 0.290381 -0.263180 0.163568 0.470 Uiso 1 1 calc R U . . .
C316 C 0.3677(3) -0.1597(3) -0.0242(5) 0.105(3) Uani 1 1 d . . . . .
C317 C 0.3901(4) -0.1372(4) 0.0181(5) 0.112(3) Uani 1 1 d . . . . .
C318 C 0.4087(5) -0.1009(5) 0.0072(7) 0.155(5) Uani 1 1 d . . . . .
H318 H 0.423658 -0.084938 0.034429 0.186 Uiso 1 1 calc R U . . .
C319 C 0.4066(7) -0.0869(6) -0.0420(7) 0.187(8) Uani 1 1 d . . . . .
H319 H 0.419817 -0.061379 -0.048742 0.224 Uiso 1 1 calc R U . . .
C320 C 0.3845(6) -0.1105(6) -0.0830(6) 0.176(7) Uani 1 1 d . . . . .
H320 H 0.383681 -0.101027 -0.117275 0.211 Uiso 1 1 calc R U . . .
C321 C 0.3644(4) -0.1470(6) -0.0732(5) 0.140(5) Uani 1 1 d . . . . .
C322 C 0.3930(4) -0.1527(4) 0.0715(5) 0.132(4) Uani 1 1 d . . . . .
H322 H 0.373985 -0.178605 0.070757 0.158 Uiso 1 1 calc R U . . .
C323 C 0.3660(6) -0.1271(5) 0.1078(6) 0.172(6) Uani 1 1 d . . . . .
H32A H 0.369159 -0.138726 0.142255 0.258 Uiso 1 1 calc R U . . .
H32B H 0.383287 -0.101214 0.108792 0.258 Uiso 1 1 calc R U . . .
H32C H 0.327544 -0.124286 0.096522 0.258 Uiso 1 1 calc R U . . .
C324 C 0.4509(5) -0.1599(5) 0.0880(7) 0.184(7) Uani 1 1 d . . . . .
H32D H 0.467172 -0.176921 0.062949 0.275 Uiso 1 1 calc R U . . .
H32E H 0.470405 -0.134854 0.090132 0.275 Uiso 1 1 calc R U . . .
H32F H 0.453328 -0.172577 0.121779 0.275 Uiso 1 1 calc R U . . .
C325 C 0.3375(5) -0.1739(5) -0.1149(6) 0.168(6) Uani 1 1 d . . . . .
H325 H 0.303931 -0.185302 -0.101396 0.202 Uiso 1 1 calc R U . . .
C326 C 0.3221(6) -0.1541(6) -0.1648(5) 0.210(10) Uani 1 1 d . . . . .
H32G H 0.297513 -0.132250 -0.158910 0.314 Uiso 1 1 calc R U . . .
H32H H 0.354834 -0.144076 -0.179633 0.314 Uiso 1 1 calc R U . . .
H32I H 0.303977 -0.172892 -0.188536 0.314 Uiso 1 1 calc R U . . .
C327 C 0.3748(9) -0.2068(7) -0.1258(8) 0.279(13) Uani 1 1 d . . . . .
H32J H 0.385664 -0.220441 -0.093748 0.418 Uiso 1 1 calc R U . . .
H32K H 0.356173 -0.225117 -0.149911 0.418 Uiso 1 1 calc R U . . .
H32L H 0.407030 -0.196300 -0.141008 0.418 Uiso 1 1 calc R U . . .
C401 C 0.3500(2) 0.0807(2) -0.1262(2) 0.0662(16) Uani 1 1 d . . . . .
C402 C 0.4172(3) 0.1248(3) -0.1082(4) 0.096(3) Uani 1 1 d . . . . .
H402 H 0.439361 0.143403 -0.089597 0.115 Uiso 1 1 calc R U . . .
C403 C 0.4234(3) 0.1122(3) -0.1553(3) 0.092(2) Uani 1 1 d . . . . .
H403 H 0.449879 0.120687 -0.177634 0.110 Uiso 1 1 calc R U . . .
C404 C 0.3526(3) 0.1130(3) -0.0401(3) 0.0745(19) Uani 1 1 d . . . . .
C405 C 0.3635(3) 0.0846(2) -0.0020(3) 0.0743(18) Uani 1 1 d . . . . .
C406 C 0.3441(3) 0.0920(3) 0.0456(3) 0.080(2) Uani 1 1 d . . . . .
H406 H 0.349612 0.073035 0.072051 0.096 Uiso 1 1 calc R U . . .
C407 C 0.3170(3) 0.1259(3) 0.0556(3) 0.086(2) Uani 1 1 d . . . . .
H407 H 0.304078 0.130434 0.088620 0.103 Uiso 1 1 calc R U . . .
C408 C 0.3089(3) 0.1535(3) 0.0171(3) 0.090(2) Uani 1 1 d . . . . .
H408 H 0.290012 0.177000 0.023895 0.108 Uiso 1 1 calc R U . . .
C409 C 0.3278(3) 0.1477(3) -0.0317(3) 0.081(2) Uani 1 1 d . . . . .
C410 C 0.3958(3) 0.0475(3) -0.0117(4) 0.096(3) Uani 1 1 d . . . . .
H410 H 0.383172 0.036620 -0.046021 0.115 Uiso 1 1 calc R U . . .
C411 C 0.3906(4) 0.0161(3) 0.0280(4) 0.106(3) Uani 1 1 d . . . . .
H41A H 0.412272 -0.006668 0.019320 0.159 Uiso 1 1 calc R U . . .
H41B H 0.403573 0.026191 0.061798 0.159 Uiso 1 1 calc R U . . .
H41C H 0.352428 0.008433 0.028813 0.159 Uiso 1 1 calc R U . . .
C412 C 0.4572(4) 0.0574(4) -0.0123(5) 0.137(4) Uani 1 1 d . . . . .
H41D H 0.462301 0.077887 -0.037922 0.205 Uiso 1 1 calc R U . . .
H41E H 0.470582 0.066763 0.021698 0.205 Uiso 1 1 calc R U . . .
H41F H 0.477272 0.033872 -0.021184 0.205 Uiso 1 1 calc R U . . .
C413 C 0.3212(5) 0.1803(3) -0.0727(4) 0.107(3) Uani 1 1 d . . . . .
H413 H 0.349827 0.174496 -0.096994 0.128 Uiso 1 1 calc R U . . .
C414 C 0.2726(5) 0.1769(4) -0.1027(6) 0.180(7) Uani 1 1 d . . . . .
H41G H 0.267443 0.149679 -0.113852 0.271 Uiso 1 1 calc R U . . .
H41H H 0.242370 0.184850 -0.082440 0.271 Uiso 1 1 calc R U . . .
H41I H 0.273710 0.193940 -0.132904 0.271 Uiso 1 1 calc R U . . .
C415 C 0.3347(6) 0.2204(3) -0.0527(5) 0.143(5) Uani 1 1 d . . . . .
H41J H 0.369429 0.219570 -0.032245 0.215 Uiso 1 1 calc R U . . .
H41K H 0.337509 0.238445 -0.081621 0.215 Uiso 1 1 calc R U . . .
H41L H 0.306169 0.229356 -0.031157 0.215 Uiso 1 1 calc R U . . .
C416 C 0.3785(3) 0.0631(3) -0.2133(3) 0.078(2) Uani 1 1 d . . . . .
C417 C 0.3539(4) 0.0811(3) -0.2563(4) 0.097(3) Uani 1 1 d . . . . .
C418 C 0.3547(5) 0.0609(4) -0.3034(4) 0.118(4) Uani 1 1 d . . . . .
H418 H 0.338237 0.072496 -0.333661 0.142 Uiso 1 1 calc R U . . .
C419 C 0.3782(5) 0.0255(4) -0.3063(5) 0.119(4) Uani 1 1 d . . . . .
H419 H 0.378407 0.012604 -0.338512 0.143 Uiso 1 1 calc R U . . .
C420 C 0.4019(5) 0.0079(4) -0.2630(5) 0.128(4) Uani 1 1 d . . . . .
H420 H 0.417756 -0.017365 -0.265525 0.153 Uiso 1 1 calc R U . . .
C421 C 0.4029(4) 0.0268(3) -0.2156(4) 0.102(3) Uani 1 1 d . . . . .
C422 C 0.3298(5) 0.1221(4) -0.2536(4) 0.126(4) Uani 1 1 d . . . . .
H422 H 0.331066 0.129550 -0.216460 0.152 Uiso 1 1 calc R U . . .
C423 C 0.2715(6) 0.1217(4) -0.2725(6) 0.165(6) Uani 1 1 d . . . . .
H42A H 0.252314 0.101337 -0.254265 0.248 Uiso 1 1 calc R U . . .
H42B H 0.255222 0.147288 -0.266111 0.248 Uiso 1 1 calc R U . . .
H42C H 0.268544 0.116155 -0.309428 0.248 Uiso 1 1 calc R U . . .
C424 C 0.3607(6) 0.1532(4) -0.2808(7) 0.180(7) Uani 1 1 d . . . . .
H42D H 0.398839 0.152815 -0.267769 0.270 Uiso 1 1 calc R U . . .
H42E H 0.358385 0.147823 -0.317834 0.270 Uiso 1 1 calc R U . . .
H42F H 0.345063 0.178956 -0.274517 0.270 Uiso 1 1 calc R U . . .
C425 C 0.4301(5) 0.0068(4) -0.1676(5) 0.136(4) Uani 1 1 d . . . . .
H425 H 0.414185 0.019412 -0.137402 0.164 Uiso 1 1 calc R U . . .
C426 C 0.4174(10) -0.0343(5) -0.1645(9) 0.284(15) Uani 1 1 d . . . . .
H42G H 0.377979 -0.037873 -0.168553 0.426 Uiso 1 1 calc R U . . .
H42H H 0.434478 -0.048449 -0.191899 0.426 Uiso 1 1 calc R U . . .
H42I H 0.431070 -0.044543 -0.131037 0.426 Uiso 1 1 calc R U . . .
C427 C 0.4903(8) 0.0148(7) -0.1617(11) 0.325(17) Uani 1 1 d . . . . .
H42J H 0.496727 0.043021 -0.164101 0.488 Uiso 1 1 calc R U . . .
H42K H 0.504908 0.005157 -0.128203 0.488 Uiso 1 1 calc R U . . .
H42L H 0.508316 0.001250 -0.189065 0.488 Uiso 1 1 calc R U . . .
C501 C 0.0165(3) 0.1650(2) -0.3068(3) 0.0728(18) Uani 1 1 d . . . . .
C502 C 0.0155(4) 0.2298(3) -0.3300(4) 0.109(3) Uani 1 1 d . . . . .
H502 H 0.015902 0.257582 -0.327031 0.131 Uiso 1 1 calc R U . . .
C503 C 0.0119(5) 0.2083(3) -0.3731(4) 0.116(3) Uani 1 1 d . . . . .
H503 H 0.009159 0.218098 -0.407275 0.140 Uiso 1 1 calc R U . . .
C504 C 0.0184(5) 0.2151(3) -0.2377(4) 0.108(3) Uani 1 1 d . . . . .
C505 C -0.0309(7) 0.2269(4) -0.2215(6) 0.155(5) Uani 1 1 d . . . . .
C506 C -0.0311(11) 0.2409(6) -0.1715(8) 0.238(13) Uani 1 1 d . . . . .
H506 H -0.063495 0.251226 -0.159167 0.286 Uiso 1 1 calc R U . C 6
C507 C 0.0156(12) 0.2399(5) -0.1400(7) 0.194(10) Uani 1 1 d . . . . .
H507 H 0.013478 0.245646 -0.104545 0.233 Uiso 1 1 calc R U . D 6
C508 C 0.0659(8) 0.2308(4) -0.1577(5) 0.159(6) Uani 1 1 d . . . . .
H508 H 0.097887 0.233431 -0.135691 0.191 Uiso 1 1 calc R U . . .
C509 C 0.0688(6) 0.2178(3) -0.2084(4) 0.123(4) Uani 1 1 d . . . . .
C510 C -0.0844(8) 0.2258(8) -0.2584(7) 0.233(13) Uani 1 1 d . . . . .
H510 H -0.072761 0.223577 -0.294309 0.280 Uiso 1 1 calc R U . . .
C511 C -0.1151(10) 0.1953(6) -0.2504(10) 0.277(17) Uani 1 1 d . . . . .
H51A H -0.147480 0.196105 -0.274189 0.416 Uiso 1 1 calc R U . . .
H51B H -0.094736 0.171207 -0.256132 0.416 Uiso 1 1 calc R U . . .
H51C H -0.125976 0.195785 -0.214947 0.416 Uiso 1 1 calc R U . . .
C512 C -0.1079(6) 0.2689(5) -0.2525(9) 0.237(11) Uani 1 1 d . . . . .
H51D H -0.080016 0.288124 -0.259706 0.355 Uiso 1 1 calc R U . . .
H51E H -0.139550 0.272444 -0.276721 0.355 Uiso 1 1 calc R U . . .
H51F H -0.118754 0.272539 -0.217290 0.355 Uiso 1 1 calc R U . . .
C513 C 0.1215(6) 0.2055(5) -0.2314(5) 0.178(8) Uani 1 1 d . . . . .
H513 H 0.113754 0.180670 -0.251012 0.213 Uiso 1 1 calc R U . . .
C514 C 0.1669(7) 0.1967(5) -0.1916(6) 0.226(11) Uani 1 1 d . . . . .
H51G H 0.154364 0.177851 -0.166692 0.339 Uiso 1 1 calc R U . . .
H51H H 0.197759 0.185616 -0.208489 0.339 Uiso 1 1 calc R U . . .
H51I H 0.178186 0.220979 -0.173881 0.339 Uiso 1 1 calc R U . . .
C515 C 0.1430(7) 0.2342(8) -0.2682(8) 0.346(19) Uani 1 1 d . . . . .
H51J H 0.114524 0.240708 -0.294839 0.519 Uiso 1 1 calc R U . . .
H51K H 0.154493 0.258134 -0.249708 0.519 Uiso 1 1 calc R U . . .
H51L H 0.174066 0.222771 -0.284316 0.519 Uiso 1 1 calc R U . . .
C516 C 0.0113(4) 0.1367(3) -0.3950(3) 0.095(3) Uani 1 1 d . . . . .
C517 C 0.0590(5) 0.1265(4) -0.4125(4) 0.113(3) Uani 1 1 d . . . . .
C518 C 0.0577(8) 0.0973(5) -0.4517(6) 0.158(5) Uani 1 1 d . . . . .
H518 H 0.089686 0.088820 -0.466645 0.189 Uiso 1 1 calc R U . . .
C519 C 0.0059(9) 0.0816(5) -0.4671(5) 0.168(6) Uani 1 1 d . . . . .
H519 H 0.004196 0.061574 -0.492467 0.202 Uiso 1 1 calc R U . . .
C520 C -0.0410(8) 0.0932(6) -0.4483(6) 0.190(8) Uani 1 1 d . . . . .
H520 H -0.074640 0.082137 -0.460629 0.228 Uiso 1 1 calc R U . . .
C521 C -0.0388(6) 0.1212(4) -0.4111(4) 0.128(4) Uani 1 1 d . . . . .
C522 C 0.1106(6) 0.1458(5) -0.3960(7) 0.165(6) Uani 1 1 d . . . . .
H522 H 0.100371 0.167244 -0.372303 0.198 Uiso 1 1 calc R U . . .
C523 C 0.1501(6) 0.1215(5) -0.3651(6) 0.170(6) Uani 1 1 d . . . . .
H52A H 0.182778 0.136881 -0.356035 0.254 Uiso 1 1 calc R U . . .
H52B H 0.133896 0.112938 -0.333596 0.254 Uiso 1 1 calc R U . . .
H52C H 0.159631 0.098462 -0.385060 0.254 Uiso 1 1 calc R U . . .
C524 C 0.1383(8) 0.1661(8) -0.4377(8) 0.307(16) Uani 1 1 d . . . . .
H52D H 0.172086 0.178037 -0.423361 0.461 Uiso 1 1 calc R U . . .
H52E H 0.146628 0.147036 -0.464213 0.461 Uiso 1 1 calc R U . . .
H52F H 0.114502 0.186525 -0.452998 0.461 Uiso 1 1 calc R U . . .
C525 C -0.0914(6) 0.1353(6) -0.3902(6) 0.178(7) Uani 1 1 d . . . . .
H525 H -0.082302 0.149068 -0.356911 0.213 Uiso 1 1 calc R U . . .
C526 C -0.1286(7) 0.0990(7) -0.3792(8) 0.264(13) Uani 1 1 d . . . . .
H52G H -0.108613 0.080916 -0.355770 0.395 Uiso 1 1 calc R U . . .
H52H H -0.161304 0.108094 -0.363542 0.395 Uiso 1 1 calc R U . . .
H52I H -0.138884 0.085534 -0.411605 0.395 Uiso 1 1 calc R U . . .
C527 C -0.1206(8) 0.1639(6) -0.4262(9) 0.226(10) Uani 1 1 d . . . . .
H52J H -0.154222 0.172389 -0.411562 0.338 Uiso 1 1 calc R U . . .
H52K H -0.097371 0.186707 -0.430966 0.338 Uiso 1 1 calc R U . . .
H52L H -0.129260 0.151214 -0.459426 0.338 Uiso 1 1 calc R U . . .
C601 C -0.2538(3) -0.0354(2) -0.3035(2) 0.0669(16) Uani 1 1 d . . . . .
C602 C -0.3286(3) -0.0077(3) -0.3439(3) 0.103(3) Uani 1 1 d . . . . .
H602 H -0.359875 0.008352 -0.349335 0.124 Uiso 1 1 calc R U . . .
C603 C -0.3077(3) -0.0309(3) -0.3775(3) 0.096(3) Uani 1 1 d . . . . .
H603 H -0.321352 -0.035399 -0.411864 0.116 Uiso 1 1 calc R U . . .
C604 C -0.3114(4) 0.0045(4) -0.2487(4) 0.109(3) Uani 1 1 d . . . . .
C605 C -0.3384(4) -0.0215(3) -0.2168(4) 0.098(3) Uani 1 1 d . . . . .
C606 C -0.3513(5) -0.0077(5) -0.1695(4) 0.132(4) Uani 1 1 d . . . . .
H606 H -0.367203 -0.024515 -0.145627 0.158 Uiso 1 1 calc R U . . .
C607 C -0.3399(5) 0.0332(4) -0.1571(5) 0.131(4) Uani 1 1 d . . . . .
H607 H -0.350765 0.043245 -0.125348 0.157 Uiso 1 1 calc R U . . .
C608 C -0.3143(5) 0.0581(4) -0.1892(4) 0.128(4) Uani 1 1 d . . . . .
H608 H -0.306409 0.084397 -0.179496 0.154 Uiso 1 1 calc R U . . .
C609 C -0.2994(4) 0.0428(4) -0.2388(4) 0.112(3) Uani 1 1 d . . . . .
C610 C -0.3510(4) -0.0618(4) -0.2313(4) 0.119(4) Uani 1 1 d . . . . .
H610 H -0.324743 -0.069468 -0.257129 0.143 Uiso 1 1 calc R U . . .
C611 C -0.3456(5) -0.0927(4) -0.1879(5) 0.148(5) Uani 1 1 d . . . . .
H61A H -0.355034 -0.118578 -0.202050 0.222 Uiso 1 1 calc R U . . .
H61B H -0.308177 -0.092995 -0.172993 0.222 Uiso 1 1 calc R U . . .
H61C H -0.370204 -0.085971 -0.161270 0.222 Uiso 1 1 calc R U . . .
C612 C -0.4076(6) -0.0630(6) -0.2592(7) 0.207(8) Uani 1 1 d . . . . .
H61D H -0.416507 -0.090093 -0.269190 0.310 Uiso 1 1 calc R U . . .
H61E H -0.434446 -0.053262 -0.236295 0.310 Uiso 1 1 calc R U . . .
H61F H -0.408044 -0.046546 -0.290026 0.310 Uiso 1 1 calc R U . . .
C613 C -0.2703(5) 0.0698(3) -0.2757(4) 0.117(3) Uani 1 1 d . . . . .
H613 H -0.242880 0.053820 -0.292969 0.140 Uiso 1 1 calc R U . . .
C614 C -0.2425(10) 0.1045(5) -0.2525(7) 0.250(12) Uani 1 1 d . . . . .
H61G H -0.216685 0.096102 -0.224513 0.376 Uiso 1 1 calc R U . . .
H61H H -0.222970 0.118178 -0.278728 0.376 Uiso 1 1 calc R U . . .
H61I H -0.269319 0.122190 -0.238965 0.376 Uiso 1 1 calc R U . . .
C615 C -0.3079(14) 0.0896(7) -0.3177(12) 0.46(3) Uani 1 1 d . . . . .
H61J H -0.329318 0.069492 -0.336665 0.683 Uiso 1 1 calc R U . . .
H61K H -0.332233 0.107889 -0.301702 0.683 Uiso 1 1 calc R U . . .
H61L H -0.285884 0.103876 -0.341465 0.683 Uiso 1 1 calc R U . . .
C616 C -0.2326(4) -0.0791(3) -0.3743(3) 0.088(2) Uani 1 1 d . . . . .
C617 C -0.2565(5) -0.1167(3) -0.3763(4) 0.117(3) Uani 1 1 d . . . . .
C618 C -0.2268(8) -0.1465(4) -0.3995(6) 0.165(6) Uani 1 1 d . . . . .
H618 H -0.241684 -0.172122 -0.403395 0.198 Uiso 1 1 calc R U . . .
C619 C -0.1761(9) -0.1385(6) -0.4167(8) 0.210(10) Uani 1 1 d . . . . .
H619 H -0.155977 -0.159105 -0.430932 0.252 Uiso 1 1 calc R U . . .
C620 C -0.1550(6) -0.1030(5) -0.4137(5) 0.144(5) Uani 1 1 d . . . . .
H620 H -0.120225 -0.098905 -0.426248 0.173 Uiso 1 1 calc R U . . .
C621 C -0.1813(4) -0.0713(3) -0.3930(3) 0.101(3) Uani 1 1 d . . . . .
C622 C -0.3121(5) -0.1230(4) -0.3548(5) 0.138(4) Uani 1 1 d . . . . .
H622 H -0.323127 -0.097560 -0.339518 0.166 Uiso 1 1 calc R U . . .
C623 C -0.3063(7) -0.1529(5) -0.3112(7) 0.207(8) Uani 1 1 d . . . . .
H62A H -0.341677 -0.157149 -0.297158 0.311 Uiso 1 1 calc R U . . .
H62B H -0.292899 -0.177744 -0.324350 0.311 Uiso 1 1 calc R U . . .
H62C H -0.280575 -0.143036 -0.283978 0.311 Uiso 1 1 calc R U . . .
C624 C -0.3553(6) -0.1335(6) -0.3979(7) 0.226(9) Uani 1 1 d . . . . .
H62D H -0.356471 -0.112932 -0.424206 0.340 Uiso 1 1 calc R U . . .
H62E H -0.346007 -0.158560 -0.413319 0.340 Uiso 1 1 calc R U . . .
H62F H -0.390822 -0.135541 -0.383486 0.340 Uiso 1 1 calc R U . . .
C625 C -0.1573(4) -0.0314(4) -0.3895(3) 0.113(4) Uani 1 1 d . . . . .
H625 H -0.162617 -0.021223 -0.354264 0.135 Uiso 1 1 calc R U . . .
C626 C -0.0963(4) -0.0318(4) -0.3961(3) 0.143(5) Uani 1 1 d . . . . .
H62G H -0.082134 -0.005016 -0.393554 0.215 Uiso 1 1 calc R U . . .
H62H H -0.078124 -0.048017 -0.369077 0.215 Uiso 1 1 calc R U . . .
H62I H -0.089438 -0.042743 -0.429818 0.215 Uiso 1 1 calc R U . . .
C627 C -0.1874(5) -0.0037(4) -0.4278(5) 0.153(5) Uani 1 1 d . . . . .
H62J H -0.171057 0.022468 -0.425071 0.229 Uiso 1 1 calc R U . . .
H62K H -0.184821 -0.013671 -0.462825 0.229 Uiso 1 1 calc R U . . .
H62L H -0.225633 -0.002108 -0.420101 0.229 Uiso 1 1 calc R U . . .
N101 N 0.1318(3) -0.1534(2) -0.3720(2) 0.0785(17) Uani 1 1 d . . . . .
N102 N 0.1630(3) -0.0945(2) -0.3747(3) 0.097(2) Uani 1 1 d . . . . .
N201 N -0.0967(3) -0.3055(2) -0.0870(3) 0.094(2) Uani 1 1 d . . . . .
N202 N -0.1235(3) -0.2780(2) -0.1576(3) 0.100(2) Uani 1 1 d . . . . .
N301 N 0.2856(4) -0.2362(3) 0.0167(4) 0.125(3) Uani 1 1 d . . . . .
N302 N 0.3429(3) -0.1975(3) -0.0099(4) 0.118(3) Uani 1 1 d . . . . .
N401 N 0.3723(2) 0.10593(19) -0.0908(2) 0.0744(15) Uani 1 1 d . . . . .
N402 N 0.3834(2) 0.08396(19) -0.1657(2) 0.0734(15) Uani 1 1 d . . . . .
N501 N 0.0185(3) 0.2025(2) -0.2908(3) 0.0870(18) Uani 1 1 d . . . . .
N502 N 0.0129(3) 0.1691(2) -0.3590(2) 0.090(2) Uani 1 1 d . . . . .
N601 N -0.2956(3) -0.0111(2) -0.2985(2) 0.0880(19) Uani 1 1 d . . . . .
N602 N -0.2615(2) -0.0476(2) -0.3527(2) 0.0767(16) Uani 1 1 d . . . . .
Cu1 Cu 0.10544(3) -0.10230(3) -0.27997(3) 0.0577(2) Uani 1 1 d . . . . .
Cu2 Cu 0.04917(3) -0.14036(3) -0.21685(3) 0.05474(19) Uani 1 1 d . . . . .
Cu3 Cu 0.14794(3) -0.12069(3) -0.19001(3) 0.0566(2) Uani 1 1 d . . . . .
Cu4 Cu 0.16465(3) -0.05149(3) -0.22523(3) 0.0572(2) Uani 1 1 d . . . . .
Cu5 Cu 0.07569(3) -0.02827(3) -0.27387(3) 0.0565(2) Uani 1 1 d . . . . .
Cu6 Cu 0.00484(3) -0.08341(3) -0.26867(3) 0.05471(19) Uani 1 1 d . . . . .
Cu7 Cu 0.07521(3) -0.07204(2) -0.19979(3) 0.04971(18) Uani 1 1 d . . . . .
Cu8 Cu -0.00645(3) -0.17913(3) -0.15523(3) 0.05566(19) Uani 1 1 d . . . . .
Cu9 Cu 0.09377(3) -0.16306(3) -0.13102(3) 0.05456(19) Uani 1 1 d . . . . .
Cu10 Cu 0.19056(3) -0.14000(3) -0.10233(3) 0.0576(2) Uani 1 1 d . . . . .
Cu11 Cu 0.21079(3) -0.07246(3) -0.13969(3) 0.0567(2) Uani 1 1 d . . . . .
Cu12 Cu 0.22392(3) -0.00210(3) -0.17268(3) 0.0584(2) Uani 1 1 d . . . . .
Cu13 Cu 0.13791(3) 0.02098(3) -0.22551(3) 0.0566(2) Uani 1 1 d . . . . .
Cu14 Cu 0.04692(3) 0.04394(3) -0.26968(3) 0.0574(2) Uani 1 1 d . . . . .
Cu15 Cu -0.02389(3) -0.01127(3) -0.26884(3) 0.05475(19) Uani 1 1 d . . . . .
Cu16 Cu -0.09420(3) -0.06584(3) -0.25911(3) 0.05498(19) Uani 1 1 d . . . . .
Cu17 Cu -0.05145(3) -0.12473(3) -0.21092(3) 0.05378(19) Uani 1 1 d . . . . .
Cu18 Cu 0.01916(3) -0.11132(2) -0.13716(3) 0.04755(17) Uani 1 1 d . . . . .
Cu19 Cu 0.11771(3) -0.09151(2) -0.11054(3) 0.04853(17) Uani 1 1 d . . . . .
Cu20 Cu 0.13420(3) -0.02246(2) -0.14627(3) 0.04902(17) Uani 1 1 d . . . . .
Cu21 Cu 0.04628(3) 0.00037(2) -0.19439(3) 0.04851(17) Uani 1 1 d . . . . .
Cu22 Cu -0.02506(3) -0.05426(2) -0.18892(3) 0.04736(17) Uani 1 1 d . . . . .
Cu23 Cu -0.06408(4) -0.21982(3) -0.09306(3) 0.0623(2) Uani 1 1 d . . . . .
Cu24 Cu 0.03674(3) -0.20034(3) -0.06833(3) 0.0578(2) Uani 1 1 d . . . . .
Cu25 Cu 0.13491(3) -0.18033(3) -0.04220(3) 0.0587(2) Uani 1 1 d . . . . .
Cu26 Cu 0.23376(3) -0.16019(3) -0.01335(4) 0.0635(2) Uani 1 1 d . . . . .
Cu27 Cu 0.25117(3) -0.09103(3) -0.05076(3) 0.0600(2) Uani 1 1 d . . . . .
Cu28 Cu 0.26723(3) -0.02217(3) -0.08636(3) 0.0597(2) Uani 1 1 d . . . . .
Cu29 Cu 0.28406(3) 0.04896(3) -0.12129(3) 0.0628(2) Uani 1 1 d . . . . .
Cu30 Cu 0.19411(3) 0.06908(3) -0.17027(3) 0.0593(2) Uani 1 1 d . . . . .
Cu31 Cu 0.10684(3) 0.09148(3) -0.21808(3) 0.0590(2) Uani 1 1 d . . . . .
Cu32 Cu 0.01864(4) 0.11734(3) -0.26563(3) 0.0626(2) Uani 1 1 d . . . . .
Cu33 Cu -0.05155(4) 0.06057(3) -0.26095(3) 0.0585(2) Uani 1 1 d . . . . .
Cu34 Cu -0.12154(3) 0.00652(3) -0.25565(3) 0.0576(2) Uani 1 1 d . . . . .
Cu35 Cu -0.19500(3) -0.04680(3) -0.25155(3) 0.0602(2) Uani 1 1 d . . . . .
Cu36 Cu -0.14999(3) -0.10468(3) -0.19900(3) 0.0570(2) Uani 1 1 d . . . . .
Cu37 Cu -0.10655(3) -0.16197(3) -0.14703(3) 0.0572(2) Uani 1 1 d . . . . .
Cu38 Cu -0.03715(3) -0.15198(2) -0.07540(3) 0.04928(17) Uani 1 1 d . . . . .
Cu39 Cu 0.06227(3) -0.13167(2) -0.04882(3) 0.04925(17) Uani 1 1 d . . . . .
Cu40 Cu 0.16194(3) -0.11189(2) -0.02200(3) 0.05064(18) Uani 1 1 d . . . . .
Cu41 Cu 0.17848(3) -0.04256(3) -0.05757(3) 0.04952(18) Uani 1 1 d . . . . .
Cu42 Cu 0.19544(3) 0.02726(3) -0.09318(3) 0.05126(18) Uani 1 1 d . . . . .
Cu43 Cu 0.10569(3) 0.04985(2) -0.14168(3) 0.04879(17) Uani 1 1 d . . . . .
Cu44 Cu 0.01686(3) 0.07348(2) -0.19067(3) 0.04957(18) Uani 1 1 d . . . . .
Cu45 Cu -0.05416(3) 0.01789(2) -0.18467(3) 0.04722(17) Uani 1 1 d . . . . .
Cu46 Cu -0.12626(3) -0.03687(2) -0.18024(3) 0.04832(17) Uani 1 1 d . . . . .
Cu47 Cu -0.08120(3) -0.09470(2) -0.12768(3) 0.04683(17) Uani 1 1 d . . . . .
Cu48 Cu 0.04423(3) -0.04265(2) -0.11804(3) 0.04422(16) Uani 1 1 d . . . . .
Cu49 Cu -0.01080(3) -0.08245(2) -0.05682(3) 0.04343(16) Uani 1 1 d . . . . .
Cu50 Cu 0.08779(3) -0.06244(2) -0.03049(3) 0.04385(16) Uani 1 1 d . . . . .
Cu51 Cu 0.10421(3) 0.00603(2) -0.06622(3) 0.04428(16) Uani 1 1 d . . . . .
Cu52 Cu 0.01602(3) 0.02894(2) -0.11424(3) 0.04332(16) Uani 1 1 d . . . . .
Cu53 Cu -0.05521(3) -0.02604(2) -0.10868(3) 0.04293(16) Uani 1 1 d . . . . .
Cu54 Cu 0.01480(3) -0.01420(2) -0.03921(3) 0.04165(15) Uani 1 1 d . . . . .
Cu1W Cu -0.05738(5) 0.03343(4) -0.05005(5) 0.0429(3) Uani 0.5 1 d . . P E 1
Cu2W Cu 0.03932(6) 0.05287(4) -0.02398(5) 0.0428(3) Uani 0.5 1 d . . P E 1
Cu3W Cu 0.08294(5) -0.00256(4) 0.02696(5) 0.0421(3) Uani 0.5 1 d . . P E 1
Cu4W Cu 0.01322(5) -0.05677(4) 0.03236(5) 0.0412(3) Uani 0.5 1 d . . P E 1
Cu5W Cu -0.07369(5) -0.03405(4) -0.01510(5) 0.0415(3) Uani 0.5 1 d . . P E 1
Cu1Z Cu 0.08509(6) -0.14812(5) 0.11777(6) 0.0506(3) Uani 0.5 1 d . . P F 2
Cu2Z Cu -0.01399(7) -0.16949(5) 0.09185(6) 0.0508(4) Uani 0.5 1 d . . P F 2
Cu3Z Cu -0.10390(6) -0.14850(5) 0.04496(6) 0.0493(3) Uani 0.5 1 d . . P F 2
Cu4Z Cu -0.18919(6) -0.12291(5) -0.00464(6) 0.0514(4) Uani 0.5 1 d . . P F 2
Cu5Z Cu -0.23445(6) -0.06582(6) -0.05704(6) 0.0529(4) Uani 0.5 1 d . . P F 2
Cu6Z Cu -0.22300(6) 0.00301(6) -0.09279(6) 0.0539(4) Uani 0.5 1 d . . P F 2
Cu7Z Cu -0.20182(6) 0.07151(6) -0.12634(6) 0.0570(4) Uani 0.5 1 d . . P F 2
Cu8Z Cu -0.13110(7) 0.12604(5) -0.13202(6) 0.0578(4) Uani 0.5 1 d . . P F 2
Cu9Z Cu -0.03466(7) 0.14989(5) -0.10747(6) 0.0563(4) Uani 0.5 1 d . . P F 2
CuAZ Cu 0.06446(7) 0.16633(5) -0.07974(6) 0.0576(4) Uani 0.5 1 d . . P F 2
CuBZ Cu 0.15247(7) 0.14312(5) -0.03134(6) 0.0562(4) Uani 0.5 1 d . . P F 2
CuCZ Cu 0.20170(6) 0.08922(5) 0.02171(6) 0.0535(4) Uani 0.5 1 d . . P F 2
CuDZ Cu 0.24113(6) 0.03018(6) 0.07171(6) 0.0537(4) Uani 0.5 1 d . . P F 2
CuEZ Cu 0.22696(6) -0.03933(5) 0.10776(6) 0.0520(4) Uani 0.5 1 d . . P F 2
CuFZ Cu 0.15864(6) -0.09557(5) 0.11556(6) 0.0499(3) Uani 0.5 1 d . . P F 2
Cu1Y Cu -0.05785(6) 0.07796(5) -0.12440(6) 0.0493(3) Uani 0.5 1 d . . P E 3
Cu2Y Cu 0.03990(6) 0.09794(5) -0.09817(6) 0.0490(3) Uani 0.5 1 d . . P E 3
Cu3Y Cu 0.12865(6) 0.07468(5) -0.04926(6) 0.0487(3) Uani 0.5 1 d . . P E 3
Cu4Y Cu 0.17316(5) 0.01850(5) 0.00191(6) 0.0469(3) Uani 0.5 1 d . . P E 3
Cu5Y Cu 0.15729(6) -0.05057(5) 0.03820(5) 0.0456(3) Uani 0.5 1 d . . P E 3
Cu6Y Cu 0.08604(6) -0.10596(5) 0.04256(5) 0.0451(3) Uani 0.5 1 d . . P E 3
Cu7Y Cu -0.01259(6) -0.12619(5) 0.01704(5) 0.0450(3) Uani 0.5 1 d . . P E 3
Cu8Y Cu -0.10082(6) -0.10254(5) -0.03153(5) 0.0446(3) Uani 0.5 1 d . . P E 3
Cu9Y Cu -0.14566(6) -0.04575(5) -0.08360(5) 0.0457(3) Uani 0.5 1 d . . P E 3
CuAY Cu -0.12912(6) 0.02295(5) -0.11929(5) 0.0478(3) Uani 0.5 1 d . . P E 3
CuBY Cu -0.05825(7) 0.12176(5) -0.19758(6) 0.0580(4) Uani 0.5 1 d . . P E 3
CuCY Cu 0.04091(7) 0.14199(5) -0.17125(6) 0.0578(4) Uani 0.5 1 d . . P E 3
CuDY Cu 0.13063(7) 0.12058(5) -0.12533(6) 0.0569(4) Uani 0.5 1 d . . P E 3
CuEY Cu 0.21613(7) 0.09617(5) -0.07524(6) 0.0569(4) Uani 0.5 1 d . . P E 3
CuFY Cu 0.26174(6) 0.03894(6) -0.02296(6) 0.0556(4) Uani 0.5 1 d . . P E 3
CuGY Cu 0.25062(6) -0.03049(5) 0.01282(6) 0.0521(4) Uani 0.5 1 d . . P E 3
CuHY Cu 0.22971(6) -0.09878(5) 0.04738(6) 0.0524(4) Uani 0.5 1 d . . P E 3
CuIY Cu 0.15826(6) -0.15404(5) 0.05285(6) 0.0526(4) Uani 0.5 1 d . . P E 3
CuJY Cu 0.06125(6) -0.17757(5) 0.02732(6) 0.0500(3) Uani 0.5 1 d . . P E 3
CuKY Cu -0.03835(7) -0.19391(5) -0.00026(6) 0.0508(3) Uani 0.5 1 d . . P E 3
CuLY Cu -0.12741(6) -0.17038(5) -0.04826(6) 0.0515(4) Uani 0.5 1 d . . P E 3
CuMY Cu -0.17410(6) -0.11552(5) -0.10187(6) 0.0505(4) Uani 0.5 1 d . . P E 3
CuNY Cu -0.21518(6) -0.05707(6) -0.15247(6) 0.0531(4) Uani 0.5 1 d . . P E 3
CuOY Cu -0.19941(6) 0.01276(6) -0.18720(6) 0.0553(4) Uani 0.5 1 d . . P E 3
CuPY Cu -0.13060(7) 0.06835(5) -0.19605(6) 0.0556(4) Uani 0.5 1 d . . P E 3
Cu1X Cu 0.08323(6) -0.04597(5) 0.10329(5) 0.0433(3) Uani 0.5 1 d . . P G 4
Cu2X Cu -0.07636(6) -0.07803(5) 0.06029(5) 0.0437(3) Uani 0.5 1 d . . P G 4
Cu3X Cu -0.14860(6) 0.01428(5) -0.02340(5) 0.0468(3) Uani 0.5 1 d . . P G 4
Cu4X Cu -0.03367(6) 0.10307(5) -0.03223(6) 0.0477(3) Uani 0.5 1 d . . P G 4
Cu5X Cu 0.11005(6) 0.06623(5) 0.04628(5) 0.0464(3) Uani 0.5 1 d . . P G 4
Cu6X Cu 0.01150(6) -0.09977(5) 0.10798(5) 0.0450(3) Uani 0.5 1 d . . P G 4
Cu7X Cu -0.16320(6) -0.05419(5) 0.01231(5) 0.0461(3) Uani 0.5 1 d . . P G 4
Cu8X Cu -0.13046(6) 0.08205(5) -0.05739(6) 0.0502(3) Uani 0.5 1 d . . P G 4
Cu9X Cu 0.06347(6) 0.12149(5) -0.00530(6) 0.0492(3) Uani 0.5 1 d . . P G 4
CuAX Cu 0.15219(6) 0.00921(5) 0.09753(5) 0.0467(3) Uani 0.5 1 d . . P G 4
CuBX Cu 0.08325(6) -0.08911(5) 0.18032(5) 0.0493(3) Uani 0.5 1 d . . P G 4
CuCX Cu 0.01162(7) -0.14240(5) 0.18260(6) 0.0544(4) Uani 0.5 1 d . . P G 4
CuDX Cu -0.07866(6) -0.12137(5) 0.13676(6) 0.0500(3) Uani 0.5 1 d . . P G 4
CuEX Cu -0.16650(6) -0.09884(5) 0.08875(6) 0.0519(4) Uani 0.5 1 d . . P G 4
CuFX Cu -0.25179(6) -0.07399(6) 0.03892(6) 0.0579(4) Uani 0.5 1 d . . P G 4
CuGX Cu -0.23947(6) -0.00521(6) 0.00402(6) 0.0544(4) Uani 0.5 1 d . . P G 4
CuHX Cu -0.22439(6) 0.06295(6) -0.03112(6) 0.0562(4) Uani 0.5 1 d . . P G 4
CuIX Cu -0.20331(7) 0.12961(6) -0.06578(7) 0.0624(4) Uani 0.5 1 d . . P G 4
CuJX Cu -0.10761(7) 0.15323(5) -0.04026(6) 0.0570(4) Uani 0.5 1 d . . P G 4
CuKX Cu -0.00950(7) 0.17314(5) -0.01410(7) 0.0572(4) Uani 0.5 1 d . . P G 4
CuLX Cu 0.08857(8) 0.18945(5) 0.01169(7) 0.0600(4) Uani 0.5 1 d . . P G 4
CuMX Cu 0.13629(6) 0.13565(5) 0.06542(6) 0.0537(4) Uani 0.5 1 d . . P G 4
CuNX Cu 0.18014(6) 0.07936(5) 0.11733(6) 0.0528(4) Uani 0.5 1 d . . P G 4
CuOX Cu 0.22160(6) 0.02226(6) 0.16639(6) 0.0568(4) Uani 0.5 1 d . . P G 4
CuPX Cu 0.15336(6) -0.03453(5) 0.17466(6) 0.0501(3) Uani 0.5 1 d . . P G 4
Cu91 Cu 0.0833(2) -0.21972(15) 0.0152(2) 0.068(2) Uani 0.189(4) 1 d . . . E 5
Cu92 Cu -0.0055(5) 0.2164(4) -0.0852(5) 0.081(5) Uani 0.093(4) 1 d . . . H 6
Cu93 Cu -0.1022(11) 0.1960(8) -0.1135(10) 0.071(11) Uani 0.038(4) 1 d . . . I 7
Cu94 Cu 0.1737(11) -0.1993(8) 0.0442(12) 0.095(12) Uani 0.047(4) 1 d . . . E 8
Cu95 Cu -0.0151(3) -0.2374(2) -0.0094(3) 0.072(3) Uani 0.144(4) 1 d . . . E 9


_geom_special_details            
;
 All esds (except the esd in the dihedral angle between two l.s. planes)
 are estimated using the full covariance matrix.  The cell esds are taken
 into account individually in the estimation of esds in distances, angles
 and torsion angles; correlations between esds in cell parameters are only
 used when they are defined by crystal symmetry.  An approximate (isotropic)
 treatment of cell esds is used for estimating esds involving l.s. planes.
;

loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
_geom_bond_publ_flag
C101 N101 1.353(9) . ?
C101 N102 1.391(10) . ?
C101 Cu1 1.964(6) . ?
C102 C103 1.323(13) . ?
C102 N101 1.395(9) . ?
C103 N102 1.395(10) . ?
C104 C105 1.382(12) . ?
C104 C109 1.383(11) . ?
C104 N101 1.429(10) . ?
C105 C106 1.379(14) . ?
C105 C110 1.535(13) . ?
C106 C107 1.389(15) . ?
C107 C108 1.367(14) . ?
C108 C109 1.389(12) . ?
C109 C113 1.515(12) . ?
C110 C112 1.540(15) . ?
C110 C111 1.540(16) . ?
C113 C114 1.495(14) . ?
C113 C115 1.500(13) . ?
C116 C121 1.378(14) . ?
C116 C117 1.401(14) . ?
C116 N102 1.439(11) . ?
C117 C118 1.397(14) . ?
C117 C122 1.497(17) . ?
C118 C119 1.354(15) . ?
C119 C120 1.406(15) . ?
C120 C121 1.359(14) . ?
C121 C125 1.532(14) . ?
C122 C123 1.511(16) . ?
C122 C124 1.555(14) . ?
C125 C126 1.427(16) . ?
C125 C127 1.548(13) . ?
C201 N201 1.350(11) . ?
C201 N202 1.367(10) . ?
C201 Cu23 1.953(8) . ?
C202 C203 1.376(16) . ?
C202 N201 1.388(11) . ?
C203 N202 1.360(12) . ?
C204 C205 1.376(15) . ?
C204 C209 1.422(16) . ?
C204 N201 1.450(12) . ?
C205 C206 1.365(17) . ?
C205 C210 1.542(19) . ?
C206 C207 1.42(2) . ?
C207 C208 1.41(2) . ?
C208 C209 1.338(17) . ?
C209 C213 1.540(18) . ?
C210 C212 1.46(2) . ?
C210 C211 1.55(2) . ?
C213 C214 1.531(18) . ?
C213 C215 1.584(19) . ?
C216 C221 1.363(15) . ?
C216 C217 1.380(15) . ?
C216 N202 1.460(13) . ?
C217 C218 1.384(16) . ?
C217 C222 1.56(2) . ?
C218 C219 1.44(2) . ?
C219 C220 1.42(2) . ?
C220 C221 1.426(18) . ?
C221 C225 1.533(18) . ?
C222 C223 1.51(2) . ?
C222 C224 1.568(18) . ?
C225 C226 1.477(17) . ?
C225 C227 1.572(17) . ?
C301 N301 1.351(12) . ?
C301 N302 1.353(11) . ?
C301 Cu26 1.929(7) . ?
C302 C303 1.345(19) . ?
C302 N301 1.346(13) . ?
C303 N302 1.365(14) . ?
C304 C309 1.395(19) . ?
C304 C305 1.414(19) . ?
C304 N301 1.492(15) . ?
C304 Cu94 2.29(3) . ?
C305 C306 1.337(19) . ?
C305 C310 1.55(2) . ?
C306 C307 1.45(2) . ?
C307 C308 1.41(2) . ?
C307 Cu91 2.26(2) . ?
C308 C309 1.366(19) . ?
C308 Cu94 2.10(3) . ?
C308 Cu93 2.40(3) 3 ?
C309 C313 1.59(2) . ?
C309 Cu94 1.99(3) . ?
C310 C312 1.509(18) . ?
C310 C311 1.518(18) . ?
C313 C314 1.46(2) . ?
C313 C315 1.49(2) . ?
C316 C321 1.346(17) . ?
C316 C317 1.426(15) . ?
C316 N302 1.488(14) . ?
C317 C318 1.356(17) . ?
C317 C322 1.486(17) . ?
C318 C319 1.37(2) . ?
C319 C320 1.42(2) . ?
C320 C321 1.37(2) . ?
C321 C325 1.541(19) . ?
C322 C323 1.481(16) . ?
C322 C324 1.487(15) . ?
C325 C327 1.49(2) . ?
C325 C326 1.49(2) . ?
C401 N401 1.353(9) . ?
C401 N402 1.364(8) . ?
C401 Cu29 1.967(6) . ?
C402 C403 1.320(12) . ?
C402 N401 1.384(9) . ?
C403 N402 1.394(10) . ?
C404 C409 1.357(11) . ?
C404 C405 1.400(11) . ?
C404 N401 1.459(9) . ?
C405 C406 1.383(10) . ?
C405 C410 1.527(12) . ?
C406 C407 1.370(12) . ?
C407 C408 1.382(12) . ?
C408 C409 1.398(11) . ?
C409 C413 1.543(13) . ?
C410 C411 1.499(12) . ?
C410 C412 1.554(13) . ?
C413 C414 1.394(15) . ?
C413 C415 1.494(14) . ?
C416 C421 1.380(13) . ?
C416 C417 1.385(13) . ?
C416 N402 1.431(10) . ?
C417 C418 1.408(14) . ?
C417 C422 1.525(16) . ?
C418 C419 1.343(15) . ?
C419 C420 1.375(17) . ?
C420 C421 1.393(15) . ?
C421 C425 1.540(17) . ?
C422 C423 1.491(17) . ?
C422 C424 1.511(16) . ?
C425 C426 1.44(2) . ?
C425 C427 1.51(2) . ?
C501 N501 1.346(10) . ?
C501 N502 1.366(9) . ?
C501 Cu32 1.947(7) . ?
C502 C503 1.343(15) . ?
C502 N501 1.381(11) . ?
C503 N502 1.387(11) . ?
C504 C505 1.375(18) . ?
C504 C509 1.420(15) . ?
C504 N501 1.450(12) . ?
C505 C506 1.39(2) . ?
C505 C510 1.58(3) . ?
C506 C507 1.37(3) . ?
C506 Cu92 2.45(2) . ?
C507 C508 1.39(2) . ?
C507 Cu92 1.75(2) . ?
C508 C509 1.403(17) . ?
C509 C513 1.53(2) . ?
C510 C511 1.31(3) . ?
C510 C512 1.59(2) . ?
C513 C515 1.494(17) . ?
C513 C514 1.508(18) . ?
C516 C517 1.339(15) . ?
C516 C521 1.386(15) . ?
C516 N502 1.447(12) . ?
C517 C518 1.425(19) . ?
C517 C522 1.475(19) . ?
C518 C519 1.42(2) . ?
C519 C520 1.35(2) . ?
C520 C521 1.358(18) . ?
C521 C525 1.522(19) . ?
C522 C523 1.479(18) . ?
C522 C524 1.493(19) . ?
C525 C527 1.50(2) . ?
C525 C526 1.58(2) . ?
C601 N601 1.338(9) . ?
C601 N602 1.350(8) . ?
C601 Cu35 1.960(6) . ?
C602 C603 1.311(12) . ?
C602 N601 1.396(10) . ?
C603 N602 1.397(9) . ?
C604 C609 1.362(15) . ?
C604 C605 1.412(15) . ?
C604 N601 1.481(12) . ?
C605 C606 1.375(13) . ?
C605 C610 1.455(15) . ?
C606 C607 1.459(18) . ?
C607 C608 1.375(17) . ?
C608 C609 1.461(15) . ?
C609 C613 1.544(16) . ?
C610 C612 1.534(16) . ?
C610 C611 1.545(16) . ?
C613 C614 1.476(18) . ?
C613 C615 1.54(2) . ?
C616 C617 1.412(14) . ?
C616 C621 1.413(13) . ?
C616 N602 1.424(10) . ?
C617 C618 1.416(18) . ?
C617 C622 1.531(17) . ?
C618 C619 1.39(2) . ?
C619 C620 1.32(2) . ?
C620 C621 1.390(15) . ?
C621 C625 1.484(15) . ?
C622 C623 1.528(18) . ?
C622 C624 1.539(18) . ?
C625 C626 1.528(14) . ?
C625 C627 1.533(16) . ?
Cu1 Cu7 2.4900(10) . ?
Cu1 Cu2 2.5748(12) . ?
Cu1 Cu3 2.5838(12) . ?
Cu1 Cu6 2.6032(11) . ?
Cu1 Cu4 2.6284(12) . ?
Cu1 Cu5 2.6382(13) . ?
Cu2 Cu7 2.4510(12) . ?
Cu2 Cu18 2.4600(10) . ?
Cu2 Cu9 2.5493(11) . ?
Cu2 Cu8 2.5514(12) . ?
Cu2 Cu17 2.5573(11) . ?
Cu2 Cu6 2.5705(12) . ?
Cu2 Cu3 2.5829(11) . ?
Cu3 Cu7 2.4473(11) . ?
Cu3 Cu19 2.4590(10) . ?
Cu3 Cu10 2.5406(12) . ?
Cu3 Cu9 2.5530(12) . ?
Cu3 Cu11 2.5639(12) . ?
Cu3 Cu4 2.5763(13) . ?
Cu4 Cu20 2.4473(10) . ?
Cu4 Cu7 2.4512(11) . ?
Cu4 Cu11 2.5401(12) . ?
Cu4 Cu13 2.5590(13) . ?
Cu4 Cu12 2.5688(12) . ?
Cu4 Cu5 2.5888(12) . ?
Cu5 Cu7 2.4423(11) . ?
Cu5 Cu21 2.4445(10) . ?
Cu5 Cu15 2.5395(12) . ?
Cu5 Cu13 2.5538(12) . ?
Cu5 Cu14 2.5683(13) . ?
Cu5 Cu6 2.5794(12) . ?
Cu6 Cu7 2.4473(10) . ?
Cu6 Cu22 2.4620(10) . ?
Cu6 Cu17 2.5425(12) . ?
Cu6 Cu16 2.5474(11) . ?
Cu6 Cu15 2.5613(13) . ?
Cu7 Cu48 2.5199(10) . ?
Cu7 Cu19 2.5768(10) . ?
Cu7 Cu21 2.5782(12) . ?
Cu7 Cu20 2.5818(11) . ?
Cu7 Cu18 2.5840(11) . ?
Cu7 Cu22 2.5841(10) . ?
Cu8 Cu18 2.4363(11) . ?
Cu8 Cu38 2.4442(11) . ?
Cu8 Cu24 2.5453(12) . ?
Cu8 Cu37 2.5642(12) . ?
Cu8 Cu17 2.5648(12) . ?
Cu8 Cu9 2.5739(11) . ?
Cu8 Cu23 2.6240(12) . ?
Cu9 Cu25 2.5369(12) . ?
Cu9 Cu18 2.5496(11) . ?
Cu9 Cu19 2.5596(12) . ?
Cu9 Cu39 2.5622(11) . ?
Cu9 Cu24 2.5646(12) . ?
Cu9 Cu10 2.5811(11) . ?
Cu10 Cu19 2.4437(11) . ?
Cu10 Cu40 2.4500(11) . ?
Cu10 Cu25 2.5545(13) . ?
Cu10 Cu11 2.5639(13) . ?
Cu10 Cu27 2.5650(13) . ?
Cu10 Cu26 2.5830(12) . ?
Cu11 Cu27 2.5439(12) . ?
Cu11 Cu20 2.5451(11) . ?
Cu11 Cu41 2.5472(11) . ?
Cu11 Cu19 2.5532(10) . ?
Cu11 Cu28 2.5626(12) . ?
Cu11 Cu12 2.5775(13) . ?
Cu12 Cu42 2.4468(11) . ?
Cu12 Cu20 2.4642(10) . ?
Cu12 Cu28 2.5226(12) . ?
Cu12 Cu30 2.5397(14) . ?
Cu12 Cu13 2.5786(12) . ?
Cu12 Cu29 2.6031(12) . ?
Cu13 Cu31 2.5362(13) . ?
Cu13 Cu30 2.5365(12) . ?
Cu13 Cu20 2.5492(11) . ?
Cu13 Cu21 2.5535(10) . ?
Cu13 Cu43 2.5710(11) . ?
Cu13 Cu14 2.5799(12) . ?
Cu14 Cu44 2.4522(11) . ?
Cu14 Cu21 2.4636(11) . ?
Cu14 Cu33 2.5231(12) . ?
Cu14 Cu31 2.5242(12) . ?
Cu14 Cu15 2.5719(12) . ?
Cu14 Cu32 2.6038(14) . ?
Cu15 Cu34 2.5333(12) . ?
Cu15 Cu21 2.5477(10) . ?
Cu15 Cu22 2.5501(11) . ?
Cu15 Cu33 2.5566(13) . ?
Cu15 Cu45 2.5655(10) . ?
Cu15 Cu16 2.5701(12) . ?
Cu16 Cu22 2.4523(10) . ?
Cu16 Cu46 2.4591(11) . ?
Cu16 Cu36 2.5291(12) . ?
Cu16 Cu17 2.5605(12) . ?
Cu16 Cu34 2.5628(13) . ?
Cu16 Cu35 2.5939(12) . ?
Cu17 Cu22 2.5466(11) . ?
Cu17 Cu47 2.5515(10) . ?
Cu17 Cu18 2.5519(10) . ?
Cu17 Cu37 2.5576(12) . ?
Cu17 Cu36 2.5675(12) . ?
Cu18 Cu48 2.4657(11) . ?
Cu18 Cu49 2.4719(10) . ?
Cu18 Cu39 2.5692(10) . ?
Cu18 Cu22 2.5711(11) . ?
Cu18 Cu47 2.5714(10) . ?
Cu18 Cu19 2.5779(10) . ?
Cu18 Cu38 2.5979(11) . ?
Cu19 Cu48 2.4630(10) . ?
Cu19 Cu50 2.4678(10) . ?
Cu19 Cu20 2.5754(12) . ?
Cu19 Cu39 2.5755(11) . ?
Cu19 Cu40 2.5839(11) . ?
Cu19 Cu41 2.5843(11) . ?
Cu20 Cu51 2.4605(10) . ?
Cu20 Cu48 2.4844(10) . ?
Cu20 Cu21 2.5578(11) . ?
Cu20 Cu43 2.5707(12) . ?
Cu20 Cu41 2.5856(11) . ?
Cu20 Cu42 2.6095(11) . ?
Cu21 Cu52 2.4661(10) . ?
Cu21 Cu48 2.4767(10) . ?
Cu21 Cu43 2.5746(11) . ?
Cu21 Cu22 2.5756(11) . ?
Cu21 Cu45 2.5811(10) . ?
Cu21 Cu44 2.6016(12) . ?
Cu22 Cu53 2.4626(10) . ?
Cu22 Cu48 2.4675(10) . ?
Cu22 Cu45 2.5690(11) . ?
Cu22 Cu47 2.5823(10) . ?
Cu22 Cu46 2.5942(10) . ?
Cu23 Cu38 2.4434(12) . ?
Cu23 CuLX 2.472(2) 3 ?
Cu23 Cu95 2.497(7) . ?
Cu23 Cu37 2.6044(13) . ?
Cu23 CuKY 2.6151(17) . ?
Cu23 Cu24 2.6174(12) . ?
Cu23 CuLY 2.6265(19) . ?
Cu24 Cu95 2.420(7) . ?
Cu24 Cu38 2.4584(12) . ?
Cu24 Cu39 2.4704(12) . ?
Cu24 CuKX 2.4748(19) 3 ?
Cu24 Cu91 2.486(5) . ?
Cu24 Cu25 2.5685(12) . ?
Cu24 CuJY 2.6444(17) . ?
Cu24 CuKY 2.6594(18) . ?
Cu25 Cu91 2.434(6) . ?
Cu25 Cu39 2.4427(11) . ?
Cu25 CuJX 2.4746(19) 3 ?
Cu25 Cu94 2.48(3) . ?
Cu25 Cu40 2.4758(12) . ?
Cu25 Cu26 2.6005(12) . ?
Cu25 CuJY 2.6533(18) . ?
Cu25 CuIY 2.6630(18) . ?
Cu26 Cu40 2.4214(11) . ?
Cu26 CuIX 2.473(2) 3 ?
Cu26 Cu94 2.55(3) . ?
Cu26 Cu27 2.5997(14) . ?
Cu26 CuIY 2.6319(18) . ?
Cu26 CuHY 2.6321(19) . ?
Cu27 Cu41 2.4391(11) . ?
Cu27 CuHX 2.4696(18) 3 ?
Cu27 Cu40 2.4794(11) . ?
Cu27 Cu28 2.5662(14) . ?
Cu27 CuGY 2.6489(19) . ?
Cu27 CuHY 2.6603(18) . ?
Cu28 Cu42 2.4455(12) . ?
Cu28 Cu41 2.4642(10) . ?
Cu28 CuGX 2.4793(18) 3 ?
Cu28 Cu29 2.6349(14) . ?
Cu28 CuGY 2.6604(18) . ?
Cu28 CuFY 2.670(2) . ?
Cu29 Cu42 2.4679(10) . ?
Cu29 CuFX 2.4906(18) 3 ?
Cu29 Cu30 2.5824(12) . ?
Cu29 CuEY 2.668(2) . ?
Cu29 CuFY 2.6799(18) . ?
Cu30 Cu43 2.4440(10) . ?
Cu30 Cu42 2.4637(11) . ?
Cu30 CuEX 2.4911(17) 3 ?
Cu30 Cu31 2.5368(12) . ?
Cu30 CuEY 2.6672(19) . ?
Cu30 CuDY 2.676(2) . ?
Cu31 Cu43 2.4482(11) . ?
Cu31 Cu44 2.4574(11) . ?
Cu31 CuDX 2.4930(17) 3 ?
Cu31 Cu32 2.5903(13) . ?
Cu31 CuDY 2.6445(19) . ?
Cu31 CuCY 2.716(2) . ?
Cu32 Cu44 2.4644(11) . ?
Cu32 CuCX 2.4879(18) 3 ?
Cu32 Cu33 2.6081(13) . ?
Cu32 CuCY 2.6246(19) . ?
Cu32 CuBY 2.6877(19) . ?
Cu33 Cu44 2.4503(11) . ?
Cu33 Cu45 2.4693(11) . ?
Cu33 CuBX 2.4894(17) 3 ?
Cu33 Cu34 2.5379(12) . ?
Cu33 CuBY 2.674(2) . ?
Cu33 CuPY 2.6801(19) . ?
Cu34 Cu45 2.4379(10) . ?
Cu34 Cu46 2.4700(11) . ?
Cu34 CuPX 2.4917(17) 3 ?
Cu34 Cu35 2.5770(12) . ?
Cu34 CuPY 2.638(2) . ?
Cu34 CuOY 2.7172(18) . ?
Cu35 Cu46 2.4581(10) . ?
Cu35 CuOX 2.5011(18) 3 ?
Cu35 Cu36 2.6101(13) . ?
Cu35 CuOY 2.6422(19) . ?
Cu35 CuNY 2.6861(18) . ?
Cu36 Cu46 2.4286(12) . ?
Cu36 CuNX 2.4586(17) 3 ?
Cu36 Cu47 2.4594(10) . ?
Cu36 Cu37 2.5725(13) . ?
Cu36 CuNY 2.6385(19) . ?
Cu36 CuMY 2.6656(17) . ?
Cu37 Cu47 2.4232(11) . ?
Cu37 CuMX 2.4656(18) 3 ?
Cu37 Cu38 2.4748(11) . ?
Cu37 CuMY 2.6348(18) . ?
Cu37 CuLY 2.6750(17) . ?
Cu38 CuKY 2.4275(17) . ?
Cu38 CuLY 2.4648(16) . ?
Cu38 Cu9X 2.4723(17) 3 ?
Cu38 Cu49 2.4991(11) . ?
Cu38 CuLX 2.5068(18) 3 ?
Cu38 CuMX 2.5419(18) 3 ?
Cu38 Cu47 2.5822(11) . ?
Cu39 Cu49 2.4644(11) . ?
Cu39 Cu4X 2.4727(17) 3 ?
Cu39 Cu50 2.4829(11) . ?
Cu39 CuJY 2.5301(17) . ?
Cu39 Cu6Y 2.5707(16) . ?
Cu39 CuKX 2.5834(19) 3 ?
Cu40 CuHY 2.4248(16) . ?
Cu40 CuIY 2.4308(18) . ?
Cu40 Cu8X 2.4773(17) 3 ?
Cu40 Cu50 2.4896(10) . ?
Cu40 CuIX 2.5184(19) 3 ?
Cu40 Cu41 2.5828(12) . ?
Cu40 CuJX 2.5909(19) 3 ?
Cu41 Cu51 2.4722(11) . ?
Cu41 Cu3X 2.4776(16) 3 ?
Cu41 Cu50 2.4874(10) . ?
Cu41 CuGY 2.5071(16) . ?
Cu41 CuGX 2.5692(18) 3 ?
Cu41 Cu5Y 2.5992(16) . ?
Cu42 CuFY 2.4085(17) . ?
Cu42 CuEY 2.445(2) . ?
Cu42 Cu7X 2.4791(16) 3 ?
Cu42 CuFX 2.4945(18) 3 ?
Cu42 Cu51 2.5116(10) . ?
Cu42 CuEX 2.549(2) 3 ?
Cu42 Cu4Y 2.5921(16) . ?
Cu42 Cu43 2.5968(11) . ?
Cu43 Cu51 2.4735(10) . ?
Cu43 Cu52 2.4774(10) . ?
Cu43 Cu2X 2.4812(15) 3 ?
Cu43 CuDY 2.5199(19) . ?
Cu43 CuDX 2.5352(19) 3 ?
Cu43 Cu3Y 2.5823(17) . ?
Cu43 CuEX 2.5854(18) 3 ?
Cu44 CuCY 2.4562(19) . ?
Cu44 CuCX 2.4673(19) 3 ?
Cu44 Cu6X 2.4784(16) 3 ?
Cu44 CuBY 2.4791(19) . ?
Cu44 Cu52 2.5072(10) . ?
Cu44 CuBX 2.5616(17) 3 ?
Cu44 Cu2Y 2.5802(17) . ?
Cu44 CuDX 2.5875(17) 3 ?
Cu45 Cu52 2.4705(10) . ?
Cu45 Cu1X 2.4773(15) 3 ?
Cu45 Cu53 2.4861(10) . ?
Cu45 CuBX 2.5384(18) 3 ?
Cu45 CuPX 2.5459(16) 3 ?
Cu45 CuPY 2.5582(18) . ?
Cu45 Cu1Y 2.5877(18) . ?
Cu46 CuNY 2.4568(17) . ?
Cu46 CuOX 2.4575(17) 3 ?
Cu46 CuOY 2.4745(18) . ?
Cu46 CuAX 2.4768(16) 3 ?
Cu46 Cu53 2.5041(9) . ?
Cu46 CuPX 2.5329(19) 3 ?
Cu46 CuAY 2.5903(18) . ?
Cu47 Cu53 2.4707(11) . ?
Cu47 Cu5X 2.4811(16) 3 ?
Cu47 Cu49 2.4885(9) . ?
Cu47 CuNX 2.5318(17) 3 ?
Cu47 CuMY 2.5356(16) . ?
Cu47 CuMX 2.5942(18) 3 ?
Cu48 Cu54 2.4274(9) . ?
Cu48 Cu52 2.5438(11) . ?
Cu48 Cu53 2.5487(10) . ?
Cu48 Cu50 2.5501(10) . ?
Cu48 Cu51 2.5529(10) . ?
Cu48 Cu49 2.5543(10) . ?
Cu49 Cu7Y 2.4394(16) . ?
Cu49 Cu54 2.4483(10) . ?
Cu49 Cu8Y 2.4587(15) . ?
Cu49 Cu2W 2.4800(15) 3 ?
Cu49 Cu4W 2.5192(15) . ?
Cu49 Cu9X 2.5238(16) 3 ?
Cu49 Cu5X 2.5463(16) 3 ?
Cu50 Cu6Y 2.4178(16) . ?
Cu50 Cu5Y 2.4325(15) . ?
Cu50 Cu54 2.4411(10) . ?
Cu50 Cu1W 2.4823(15) 3 ?
Cu50 Cu3W 2.5407(16) . ?
Cu50 Cu8X 2.5482(16) 3 ?
Cu50 Cu4W 2.5523(15) . ?
Cu51 Cu4Y 2.4170(15) . ?
Cu51 Cu3Y 2.4517(17) . ?
Cu51 Cu54 2.4611(9) . ?
Cu51 Cu5W 2.4876(15) 3 ?
Cu51 Cu3W 2.5364(15) . ?
Cu51 Cu7X 2.5557(16) 3 ?
Cu52 Cu54 2.4502(10) . ?
Cu52 Cu2Y 2.4562(17) . ?
Cu52 Cu1Y 2.4768(17) . ?
Cu52 Cu4W 2.4868(15) 3 ?
Cu52 Cu6X 2.5184(17) 3 ?
Cu52 Cu2W 2.5218(15) . ?
Cu52 Cu1W 2.5521(15) . ?
Cu53 Cu54 2.4546(9) . ?
Cu53 Cu9Y 2.4630(15) . ?
Cu53 CuAY 2.4775(17) . ?
Cu53 Cu3W 2.4808(15) 3 ?
Cu53 CuAX 2.4995(16) 3 ?
Cu53 Cu5W 2.5267(15) . ?
Cu53 Cu1W 2.5431(16) . ?
Cu54 Cu3W 2.3638(14) . ?
Cu54 Cu4W 2.3670(15) . ?
Cu54 Cu2W 2.3936(16) . ?
Cu54 Cu5W 2.4112(15) . ?
Cu54 Cu1W 2.4156(16) . ?
Cu54 Cu54 2.4188(13) 3 ?
Cu1W Cu3W 1.386(2) 3 ?
Cu1W Cu4W 1.404(2) 3 ?
Cu1W Cu5W 2.518(2) . ?
Cu1W Cu2W 2.5293(19) . ?
Cu2W Cu4W 1.309(2) 3 ?
Cu2W Cu5W 1.435(2) 3 ?
Cu2W Cu3W 2.513(2) . ?
Cu3W Cu5W 1.303(2) 3 ?
Cu3W Cu4W 2.5375(19) . ?
Cu4W Cu5W 2.5287(19) . ?
Cu1Z Cu9Z 1.259(2) 3 ?
Cu1Z Cu8Z 1.394(2) 3 ?
Cu1Z CuFZ 2.556(2) . ?
Cu1Z Cu2Z 2.601(2) . ?
Cu2Z CuAZ 1.271(2) 3 ?
Cu2Z Cu9Z 1.412(2) 3 ?
Cu2Z Cu3Z 2.566(2) . ?
Cu3Z CuBZ 1.243(2) 3 ?
Cu3Z CuAZ 1.423(2) 3 ?
Cu3Z Cu4Z 2.553(2) . ?
Cu4Z CuCZ 1.264(2) 3 ?
Cu4Z CuBZ 1.438(2) 3 ?
Cu4Z Cu5Z 2.590(3) . ?
Cu5Z CuDZ 1.282(3) 3 ?
Cu5Z CuCZ 1.429(2) 3 ?
Cu5Z Cu6Z 2.549(3) . ?
Cu6Z CuEZ 1.301(3) 3 ?
Cu6Z CuDZ 1.348(3) 3 ?
Cu6Z Cu7Z 2.562(3) . ?
Cu7Z CuFZ 1.361(2) 3 ?
Cu7Z CuEZ 1.366(3) 3 ?
Cu7Z Cu8Z 2.563(3) . ?
Cu8Z CuFZ 1.329(2) 3 ?
Cu8Z Cu9Z 2.559(2) . ?
Cu9Z CuAZ 2.570(2) . ?
CuAZ CuBZ 2.567(3) . ?
CuBZ CuCZ 2.560(3) . ?
CuCZ CuDZ 2.557(3) . ?
CuDZ CuEZ 2.583(3) . ?
CuEZ CuFZ 2.573(2) . ?
Cu1Y CuBY 2.423(2) . ?
Cu1Y Cu6Y 2.479(2) 3 ?
Cu1Y CuPY 2.527(2) . ?
Cu1Y Cu2Y 2.559(2) . ?
Cu1Y CuAY 2.583(2) . ?
Cu2Y CuCY 2.428(2) . ?
Cu2Y Cu7Y 2.459(2) 3 ?
Cu2Y CuDY 2.516(2) . ?
Cu2Y Cu3Y 2.588(2) . ?
Cu3Y CuEY 2.421(2) . ?
Cu3Y Cu8Y 2.450(2) 3 ?
Cu3Y CuDY 2.530(2) . ?
Cu3Y Cu4Y 2.544(2) . ?
Cu4Y CuFY 2.425(2) . ?
Cu4Y Cu9Y 2.460(2) 3 ?
Cu4Y CuGY 2.543(2) . ?
Cu4Y Cu5Y 2.579(2) . ?
Cu5Y CuHY 2.431(2) . ?
Cu5Y CuAY 2.457(2) 3 ?
Cu5Y CuGY 2.535(2) . ?
Cu5Y Cu6Y 2.590(2) . ?
Cu6Y CuIY 2.426(2) . ?
Cu6Y CuJY 2.543(2) . ?
Cu6Y Cu7Y 2.578(2) . ?
Cu7Y CuKY 2.431(2) . ?
Cu7Y CuJY 2.531(2) . ?
Cu7Y Cu8Y 2.578(2) . ?
Cu8Y CuLY 2.437(2) . ?
Cu8Y CuMY 2.530(2) . ?
Cu8Y Cu9Y 2.574(2) . ?
Cu9Y CuNY 2.4331(19) . ?
Cu9Y CuMY 2.518(2) . ?
Cu9Y CuAY 2.564(2) . ?
CuAY CuOY 2.422(2) . ?
CuAY CuPY 2.529(2) . ?
CuBY CuPY 2.555(3) . ?
CuBY CuCY 2.594(2) . ?
CuCY CuDY 2.556(2) . ?
CuDY CuEY 2.550(2) . ?
CuEY CuFY 2.596(3) . ?
CuFY CuGY 2.567(3) . ?
CuGY CuHY 2.563(3) . ?
CuHY CuIY 2.593(2) . ?
CuIY CuJY 2.573(2) . ?
CuJY CuKY 2.579(2) . ?
CuKY CuLY 2.587(2) . ?
CuLY CuMY 2.564(2) . ?
CuMY CuNY 2.563(2) . ?
CuNY CuOY 2.587(3) . ?
CuOY CuPY 2.567(2) . ?
Cu1X Cu8X 2.120(2) 3 ?
Cu1X CuPX 2.4890(19) . ?
Cu1X CuBX 2.490(2) . ?
Cu1X CuAX 2.550(2) . ?
Cu1X Cu6X 2.560(2) . ?
Cu1X Cu4X 2.903(2) 3 ?
Cu1X Cu3X 2.926(2) 3 ?
Cu2X Cu9X 2.101(2) 3 ?
Cu2X CuDX 2.486(2) . ?
Cu2X CuEX 2.496(2) . ?
Cu2X Cu6X 2.541(2) . ?
Cu2X Cu7X 2.545(2) . ?
Cu2X Cu5X 2.876(2) 3 ?
Cu2X Cu4X 2.986(2) 3 ?
Cu3X CuAX 2.089(2) 3 ?
Cu3X CuGX 2.491(2) . ?
Cu3X CuHX 2.501(2) . ?
Cu3X Cu8X 2.527(2) . ?
Cu3X Cu7X 2.549(2) . ?
Cu3X Cu5X 2.980(2) 3 ?
Cu4X Cu6X 2.087(2) 3 ?
Cu4X CuKX 2.502(2) . ?
Cu4X CuJX 2.502(2) . ?
Cu4X Cu9X 2.535(2) . ?
Cu4X Cu8X 2.541(2) . ?
Cu5X Cu7X 2.119(2) 3 ?
Cu5X CuNX 2.492(2) . ?
Cu5X CuMX 2.497(2) . ?
Cu5X CuAX 2.544(2) . ?
Cu5X Cu9X 2.547(2) . ?
Cu6X CuCX 2.429(2) . ?
Cu6X CuDX 2.507(2) . ?
Cu6X CuBX 2.529(2) . ?
Cu7X CuFX 2.435(2) . ?
Cu7X CuEX 2.514(2) . ?
Cu7X CuGX 2.517(2) . ?
Cu8X CuIX 2.422(2) . ?
Cu8X CuJX 2.526(2) . ?
Cu8X CuHX 2.547(2) . ?
Cu9X CuLX 2.433(2) . ?
Cu9X CuKX 2.521(2) . ?
Cu9X CuMX 2.537(2) . ?
CuAX CuOX 2.441(2) . ?
CuAX CuPX 2.503(2) . ?
CuAX CuNX 2.535(2) . ?
CuBX CuCX 2.541(2) . ?
CuBX CuPX 2.554(2) . ?
CuCX CuDX 2.563(2) . ?
CuDX CuEX 2.552(2) . ?
CuEX CuFX 2.547(2) . ?
CuFX CuGX 2.542(3) . ?
CuGX CuHX 2.536(3) . ?
CuHX CuIX 2.514(3) . ?
CuIX CuJX 2.545(2) . ?
CuJX CuKX 2.566(2) . ?
CuKX CuLX 2.534(2) . ?
CuLX CuMX 2.551(3) . ?
CuMX CuNX 2.550(2) . ?
CuNX CuOX 2.512(3) . ?
CuOX CuPX 2.587(2) . ?

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
_geom_angle_publ_flag
N101 C101 N102 103.5(6) . . ?
N101 C101 Cu1 134.8(5) . . ?
N102 C101 Cu1 121.5(5) . . ?
C103 C102 N101 107.4(7) . . ?
C102 C103 N102 107.3(7) . . ?
C105 C104 C109 122.7(9) . . ?
C105 C104 N101 118.9(8) . . ?
C109 C104 N101 118.1(7) . . ?
C106 C105 C104 117.6(9) . . ?
C106 C105 C110 120.7(9) . . ?
C104 C105 C110 121.7(9) . . ?
C105 C106 C107 120.8(10) . . ?
C108 C107 C106 120.5(10) . . ?
C107 C108 C109 120.0(10) . . ?
C104 C109 C108 118.3(9) . . ?
C104 C109 C113 122.0(8) . . ?
C108 C109 C113 119.5(8) . . ?
C105 C110 C112 111.6(8) . . ?
C105 C110 C111 111.3(10) . . ?
C112 C110 C111 113.1(9) . . ?
C114 C113 C115 112.9(11) . . ?
C114 C113 C109 109.9(8) . . ?
C115 C113 C109 113.8(9) . . ?
C121 C116 C117 124.2(9) . . ?
C121 C116 N102 119.9(9) . . ?
C117 C116 N102 115.9(10) . . ?
C118 C117 C116 116.9(11) . . ?
C118 C117 C122 119.5(10) . . ?
C116 C117 C122 123.7(10) . . ?
C119 C118 C117 119.1(11) . . ?
C118 C119 C120 122.5(11) . . ?
C121 C120 C119 119.8(12) . . ?
C120 C121 C116 117.4(10) . . ?
C120 C121 C125 120.4(11) . . ?
C116 C121 C125 122.1(9) . . ?
C117 C122 C123 115.6(11) . . ?
C117 C122 C124 111.0(11) . . ?
C123 C122 C124 108.4(9) . . ?
C126 C125 C121 116.2(9) . . ?
C126 C125 C127 113.0(10) . . ?
C121 C125 C127 105.9(8) . . ?
N201 C201 N202 103.5(7) . . ?
N201 C201 Cu23 133.1(6) . . ?
N202 C201 Cu23 123.3(7) . . ?
C203 C202 N201 103.6(9) . . ?
N202 C203 C202 108.4(9) . . ?
C205 C204 C209 121.5(11) . . ?
C205 C204 N201 119.0(10) . . ?
C209 C204 N201 119.4(10) . . ?
C206 C205 C204 120.7(13) . . ?
C206 C205 C210 118.9(13) . . ?
C204 C205 C210 120.2(11) . . ?
C205 C206 C207 116.5(14) . . ?
C208 C207 C206 123.6(14) . . ?
C209 C208 C207 117.6(14) . . ?
C208 C209 C204 120.0(14) . . ?
C208 C209 C213 121.3(14) . . ?
C204 C209 C213 118.7(12) . . ?
C212 C210 C205 118.5(19) . . ?
C212 C210 C211 106.1(14) . . ?
C205 C210 C211 110.7(13) . . ?
C214 C213 C209 115.5(12) . . ?
C214 C213 C215 110.9(13) . . ?
C209 C213 C215 108.7(13) . . ?
C221 C216 C217 124.5(12) . . ?
C221 C216 N202 117.9(11) . . ?
C217 C216 N202 117.6(11) . . ?
C216 C217 C218 120.0(13) . . ?
C216 C217 C222 120.3(12) . . ?
C218 C217 C222 119.6(13) . . ?
C217 C218 C219 116.7(14) . . ?
C220 C219 C218 123.1(16) . . ?
C219 C220 C221 116.7(16) . . ?
C216 C221 C220 118.9(13) . . ?
C216 C221 C225 122.9(12) . . ?
C220 C221 C225 118.2(13) . . ?
C223 C222 C217 113.0(13) . . ?
C223 C222 C224 110.4(12) . . ?
C217 C222 C224 109.5(16) . . ?
C226 C225 C221 111.7(13) . . ?
C226 C225 C227 109.9(10) . . ?
C221 C225 C227 106.4(12) . . ?
N301 C301 N302 101.0(7) . . ?
N301 C301 Cu26 129.4(7) . . ?
N302 C301 Cu26 129.5(7) . . ?
C303 C302 N301 105.5(11) . . ?
C302 C303 N302 106.1(10) . . ?
C309 C304 C305 124.7(13) . . ?
C309 C304 N301 119.7(14) . . ?
C305 C304 N301 115.3(14) . . ?
C309 C304 Cu94 59.6(11) . . ?
C305 C304 Cu94 95.1(12) . . ?
N301 C304 Cu94 112.0(10) . . ?
C306 C305 C304 117.0(16) . . ?
C306 C305 C310 123.1(15) . . ?
C304 C305 C310 119.9(12) . . ?
C305 C306 C307 121.1(17) . . ?
C308 C307 C306 118.9(16) . . ?
C308 C307 Cu91 105.4(14) . . ?
C306 C307 Cu91 85.7(12) . . ?
C309 C308 C307 121.2(19) . . ?
C309 C308 Cu94 66.0(10) . . ?
C307 C308 Cu94 92.8(14) . . ?
C309 C308 Cu93 123.5(15) . 3 ?
C307 C308 Cu93 94.8(14) . 3 ?
Cu94 C308 Cu93 70.7(11) . 3 ?
C308 C309 C304 117.0(16) . . ?
C308 C309 C313 122.5(17) . . ?
C304 C309 C313 120.4(15) . . ?
C308 C309 Cu94 75.1(12) . . ?
C304 C309 Cu94 83.1(11) . . ?
C313 C309 Cu94 108.7(13) . . ?
C312 C310 C311 109.0(14) . . ?
C312 C310 C305 111.1(13) . . ?
C311 C310 C305 112.3(11) . . ?
C314 C313 C315 115.3(16) . . ?
C314 C313 C309 116.5(16) . . ?
C315 C313 C309 108.7(13) . . ?
C321 C316 C317 123.9(12) . . ?
C321 C316 N302 121.2(12) . . ?
C317 C316 N302 114.7(11) . . ?
C318 C317 C316 116.6(13) . . ?
C318 C317 C322 121.7(13) . . ?
C316 C317 C322 121.7(11) . . ?
C317 C318 C319 121.6(14) . . ?
C318 C319 C320 119.8(16) . . ?
C321 C320 C319 120.1(15) . . ?
C316 C321 C320 118.0(14) . . ?
C316 C321 C325 118.3(16) . . ?
C320 C321 C325 123.7(15) . . ?
C323 C322 C317 113.1(12) . . ?
C323 C322 C324 112.2(13) . . ?
C317 C322 C324 108.4(11) . . ?
C327 C325 C326 107.4(13) . . ?
C327 C325 C321 109.8(14) . . ?
C326 C325 C321 114.7(17) . . ?
N401 C401 N402 102.9(5) . . ?
N401 C401 Cu29 127.3(5) . . ?
N402 C401 Cu29 129.7(5) . . ?
C403 C402 N401 107.3(7) . . ?
C402 C403 N402 106.4(6) . . ?
C409 C404 C405 123.9(7) . . ?
C409 C404 N401 118.0(7) . . ?
C405 C404 N401 118.0(7) . . ?
C406 C405 C404 116.6(7) . . ?
C406 C405 C410 121.0(8) . . ?
C404 C405 C410 122.4(7) . . ?
C407 C406 C405 121.9(8) . . ?
C406 C407 C408 119.0(8) . . ?
C407 C408 C409 121.6(8) . . ?
C404 C409 C408 116.8(8) . . ?
C404 C409 C413 123.1(8) . . ?
C408 C409 C413 120.1(8) . . ?
C411 C410 C405 114.1(8) . . ?
C411 C410 C412 107.0(8) . . ?
C405 C410 C412 109.9(8) . . ?
C414 C413 C415 115.8(11) . . ?
C414 C413 C409 112.3(9) . . ?
C415 C413 C409 114.0(9) . . ?
C421 C416 C417 122.2(8) . . ?
C421 C416 N402 118.2(8) . . ?
C417 C416 N402 119.3(8) . . ?
C416 C417 C418 117.3(10) . . ?
C416 C417 C422 121.4(8) . . ?
C418 C417 C422 121.1(10) . . ?
C419 C418 C417 121.2(12) . . ?
C418 C419 C420 120.7(11) . . ?
C419 C420 C421 120.4(12) . . ?
C416 C421 C420 118.1(11) . . ?
C416 C421 C425 122.0(10) . . ?
C420 C421 C425 119.9(11) . . ?
C423 C422 C424 111.1(11) . . ?
C423 C422 C417 110.4(11) . . ?
C424 C422 C417 114.2(10) . . ?
C426 C425 C427 112.7(16) . . ?
C426 C425 C421 113.0(13) . . ?
C427 C425 C421 112.1(13) . . ?
N501 C501 N502 102.2(6) . . ?
N501 C501 Cu32 128.6(5) . . ?
N502 C501 Cu32 129.2(6) . . ?
C503 C502 N501 104.3(8) . . ?
C502 C503 N502 107.9(8) . . ?
C505 C504 C509 125.4(12) . . ?
C505 C504 N501 115.9(11) . . ?
C509 C504 N501 118.4(11) . . ?
C504 C505 C506 116.6(17) . . ?
C504 C505 C510 121.8(14) . . ?
C506 C505 C510 121.6(17) . . ?
C507 C506 C505 120(2) . . ?
C507 C506 Cu92 44.2(12) . . ?
C505 C506 Cu92 136.8(12) . . ?
C506 C507 C508 122.8(18) . . ?
C506 C507 Cu92 103(2) . . ?
C508 C507 Cu92 119.4(17) . . ?
C507 C508 C509 119.2(16) . . ?
C508 C509 C504 115.4(14) . . ?
C508 C509 C513 123.8(13) . . ?
C504 C509 C513 120.8(10) . . ?
C511 C510 C505 112.9(18) . . ?
C511 C510 C512 119.8(18) . . ?
C505 C510 C512 102.5(19) . . ?
C515 C513 C514 107.0(10) . . ?
C515 C513 C509 114.8(18) . . ?
C514 C513 C509 113.5(13) . . ?
C517 C516 C521 125.8(11) . . ?
C517 C516 N502 115.6(9) . . ?
C521 C516 N502 118.4(10) . . ?
C516 C517 C518 116.6(12) . . ?
C516 C517 C522 123.2(13) . . ?
C518 C517 C522 120.1(14) . . ?
C519 C518 C517 116.4(14) . . ?
C520 C519 C518 124.5(15) . . ?
C519 C520 C521 118.1(15) . . ?
C520 C521 C516 118.6(14) . . ?
C520 C521 C525 118.9(13) . . ?
C516 C521 C525 122.4(11) . . ?
C517 C522 C523 115.8(13) . . ?
C517 C522 C524 115.0(15) . . ?
C523 C522 C524 109.9(13) . . ?
C527 C525 C521 111.7(14) . . ?
C527 C525 C526 111.2(14) . . ?
C521 C525 C526 109.6(17) . . ?
N601 C601 N602 102.9(5) . . ?
N601 C601 Cu35 126.7(5) . . ?
N602 C601 Cu35 130.3(5) . . ?
C603 C602 N601 106.4(7) . . ?
C602 C603 N602 106.5(7) . . ?
C609 C604 C605 126.6(10) . . ?
C609 C604 N601 116.5(11) . . ?
C605 C604 N601 116.9(10) . . ?
C606 C605 C604 117.4(11) . . ?
C606 C605 C610 119.8(11) . . ?
C604 C605 C610 122.8(9) . . ?
C605 C606 C607 118.3(12) . . ?
C608 C607 C606 123.0(11) . . ?
C607 C608 C609 118.2(13) . . ?
C604 C609 C608 116.4(12) . . ?
C604 C609 C613 124.0(11) . . ?
C608 C609 C613 119.5(12) . . ?
C605 C610 C612 108.8(12) . . ?
C605 C610 C611 116.6(10) . . ?
C612 C610 C611 111.1(11) . . ?
C614 C613 C615 100.6(13) . . ?
C614 C613 C609 116.5(12) . . ?
C615 C613 C609 114.8(16) . . ?
C617 C616 C621 122.8(9) . . ?
C617 C616 N602 118.6(9) . . ?
C621 C616 N602 118.6(9) . . ?
C616 C617 C618 116.2(13) . . ?
C616 C617 C622 119.9(10) . . ?
C618 C617 C622 123.9(13) . . ?
C619 C618 C617 120.2(15) . . ?
C620 C619 C618 121.6(16) . . ?
C619 C620 C621 123.1(15) . . ?
C620 C621 C616 116.1(12) . . ?
C620 C621 C625 122.8(12) . . ?
C616 C621 C625 121.1(9) . . ?
C623 C622 C617 108.9(12) . . ?
C623 C622 C624 114.5(13) . . ?
C617 C622 C624 111.1(12) . . ?
C621 C625 C626 112.2(11) . . ?
C621 C625 C627 110.5(9) . . ?
C626 C625 C627 112.0(9) . . ?
C101 N101 C102 111.5(7) . . ?
C101 N101 C104 127.3(6) . . ?
C102 N101 C104 121.1(7) . . ?
C101 N102 C103 110.3(7) . . ?
C101 N102 C116 123.7(6) . . ?
C103 N102 C116 126.1(7) . . ?
C201 N201 C202 113.4(8) . . ?
C201 N201 C204 125.9(7) . . ?
C202 N201 C204 120.7(8) . . ?
C203 N202 C201 111.1(9) . . ?
C203 N202 C216 125.8(8) . . ?
C201 N202 C216 122.9(7) . . ?
C302 N301 C301 114.3(10) . . ?
C302 N301 C304 126.3(11) . . ?
C301 N301 C304 119.1(8) . . ?
C301 N302 C303 112.9(10) . . ?
C301 N302 C316 119.9(7) . . ?
C303 N302 C316 126.9(9) . . ?
C401 N401 C402 111.8(6) . . ?
C401 N401 C404 125.4(5) . . ?
C402 N401 C404 122.8(6) . . ?
C401 N402 C403 111.5(6) . . ?
C401 N402 C416 126.4(6) . . ?
C403 N402 C416 122.1(6) . . ?
C501 N501 C502 114.4(7) . . ?
C501 N501 C504 125.1(7) . . ?
C502 N501 C504 120.2(8) . . ?
C501 N502 C503 111.2(8) . . ?
C501 N502 C516 124.5(7) . . ?
C503 N502 C516 124.3(7) . . ?
C601 N601 C602 112.4(7) . . ?
C601 N601 C604 123.9(6) . . ?
C602 N601 C604 122.7(7) . . ?
C601 N602 C603 111.8(6) . . ?
C601 N602 C616 124.4(6) . . ?
C603 N602 C616 122.8(6) . . ?
C101 Cu1 Cu7 172.6(2) . . ?
C101 Cu1 Cu2 129.5(2) . . ?
Cu7 Cu1 Cu2 57.85(3) . . ?
C101 Cu1 Cu3 123.5(2) . . ?
Cu7 Cu1 Cu3 57.64(3) . . ?
Cu2 Cu1 Cu3 60.09(3) . . ?
C101 Cu1 Cu6 125.4(2) . . ?
Cu7 Cu1 Cu6 57.39(3) . . ?
Cu2 Cu1 Cu6 59.52(3) . . ?
Cu3 Cu1 Cu6 106.95(4) . . ?
C101 Cu1 Cu4 116.3(2) . . ?
Cu7 Cu1 Cu4 57.15(3) . . ?
Cu2 Cu1 Cu4 106.86(4) . . ?
Cu3 Cu1 Cu4 59.24(3) . . ?
Cu6 Cu1 Cu4 106.07(4) . . ?
C101 Cu1 Cu5 117.6(2) . . ?
Cu7 Cu1 Cu5 56.79(3) . . ?
Cu2 Cu1 Cu5 106.26(4) . . ?
Cu3 Cu1 Cu5 106.02(4) . . ?
Cu6 Cu1 Cu5 58.96(3) . . ?
Cu4 Cu1 Cu5 58.89(3) . . ?
Cu7 Cu2 Cu18 63.49(3) . . ?
Cu7 Cu2 Cu9 92.08(4) . . ?
Cu18 Cu2 Cu9 61.16(3) . . ?
Cu7 Cu2 Cu8 121.63(4) . . ?
Cu18 Cu2 Cu8 58.14(3) . . ?
Cu9 Cu2 Cu8 60.61(3) . . ?
Cu7 Cu2 Cu17 92.02(4) . . ?
Cu18 Cu2 Cu17 61.11(3) . . ?
Cu9 Cu2 Cu17 112.10(4) . . ?
Cu8 Cu2 Cu17 60.27(3) . . ?
Cu7 Cu2 Cu6 58.28(3) . . ?
Cu18 Cu2 Cu6 89.88(4) . . ?
Cu9 Cu2 Cu6 146.70(4) . . ?
Cu8 Cu2 Cu6 119.63(4) . . ?
Cu17 Cu2 Cu6 59.45(3) . . ?
Cu7 Cu2 Cu1 59.34(3) . . ?
Cu18 Cu2 Cu1 122.83(4) . . ?
Cu9 Cu2 Cu1 119.61(4) . . ?
Cu8 Cu2 Cu1 179.02(5) . . ?
Cu17 Cu2 Cu1 120.08(4) . . ?
Cu6 Cu2 Cu1 60.79(3) . . ?
Cu7 Cu2 Cu3 58.11(3) . . ?
Cu18 Cu2 Cu3 89.90(3) . . ?
Cu9 Cu2 Cu3 59.66(3) . . ?
Cu8 Cu2 Cu3 120.16(4) . . ?
Cu17 Cu2 Cu3 146.56(4) . . ?
Cu6 Cu2 Cu3 107.96(4) . . ?
Cu1 Cu2 Cu3 60.13(3) . . ?
Cu7 Cu3 Cu19 63.36(3) . . ?
Cu7 Cu3 Cu10 121.85(4) . . ?
Cu19 Cu3 Cu10 58.49(3) . . ?
Cu7 Cu3 Cu9 92.08(4) . . ?
Cu19 Cu3 Cu9 61.39(3) . . ?
Cu10 Cu3 Cu9 60.89(3) . . ?
Cu7 Cu3 Cu11 91.95(4) . . ?
Cu19 Cu3 Cu11 61.06(3) . . ?
Cu10 Cu3 Cu11 60.30(3) . . ?
Cu9 Cu3 Cu11 112.26(4) . . ?
Cu7 Cu3 Cu4 58.34(3) . . ?
Cu19 Cu3 Cu4 89.66(4) . . ?
Cu10 Cu3 Cu4 119.46(4) . . ?
Cu9 Cu3 Cu4 146.74(4) . . ?
Cu11 Cu3 Cu4 59.23(3) . . ?
Cu7 Cu3 Cu2 58.25(3) . . ?
Cu19 Cu3 Cu2 89.98(3) . . ?
Cu10 Cu3 Cu2 120.32(4) . . ?
Cu9 Cu3 Cu2 59.52(3) . . ?
Cu11 Cu3 Cu2 146.63(4) . . ?
Cu4 Cu3 Cu2 108.20(4) . . ?
Cu7 Cu3 Cu1 59.26(3) . . ?
Cu19 Cu3 Cu1 122.61(4) . . ?
Cu10 Cu3 Cu1 178.85(5) . . ?
Cu9 Cu3 Cu1 119.12(4) . . ?
Cu11 Cu3 Cu1 120.34(5) . . ?
Cu4 Cu3 Cu1 61.24(3) . . ?
Cu2 Cu3 Cu1 59.78(3) . . ?
Cu20 Cu4 Cu7 63.61(3) . . ?
Cu20 Cu4 Cu11 61.33(3) . . ?
Cu7 Cu4 Cu11 92.43(4) . . ?
Cu20 Cu4 Cu13 61.17(3) . . ?
Cu7 Cu4 Cu13 92.29(4) . . ?
Cu11 Cu4 Cu13 112.05(4) . . ?
Cu20 Cu4 Cu12 58.79(3) . . ?
Cu7 Cu4 Cu12 122.40(4) . . ?
Cu11 Cu4 Cu12 60.60(3) . . ?
Cu13 Cu4 Cu12 60.38(3) . . ?
Cu20 Cu4 Cu3 90.32(4) . . ?
Cu7 Cu4 Cu3 58.20(3) . . ?
Cu11 Cu4 Cu3 60.14(3) . . ?
Cu13 Cu4 Cu3 147.03(4) . . ?
Cu12 Cu4 Cu3 120.67(4) . . ?
Cu20 Cu4 Cu5 89.44(4) . . ?
Cu7 Cu4 Cu5 57.89(3) . . ?
Cu11 Cu4 Cu5 146.52(4) . . ?
Cu13 Cu4 Cu5 59.48(3) . . ?
Cu12 Cu4 Cu5 119.77(5) . . ?
Cu3 Cu4 Cu5 107.72(4) . . ?
Cu20 Cu4 Cu1 122.20(4) . . ?
Cu7 Cu4 Cu1 58.58(3) . . ?
Cu11 Cu4 Cu1 119.53(5) . . ?
Cu13 Cu4 Cu1 120.08(4) . . ?
Cu12 Cu4 Cu1 179.00(4) . . ?
Cu3 Cu4 Cu1 59.52(3) . . ?
Cu5 Cu4 Cu1 60.75(3) . . ?
Cu7 Cu5 Cu21 63.68(3) . . ?
Cu7 Cu5 Cu15 92.51(4) . . ?
Cu21 Cu5 Cu15 61.45(3) . . ?
Cu7 Cu5 Cu13 92.62(4) . . ?
Cu21 Cu5 Cu13 61.40(3) . . ?
Cu15 Cu5 Cu13 112.22(4) . . ?
Cu7 Cu5 Cu14 122.49(4) . . ?
Cu21 Cu5 Cu14 58.81(3) . . ?
Cu15 Cu5 Cu14 60.46(3) . . ?
Cu13 Cu5 Cu14 60.49(3) . . ?
Cu7 Cu5 Cu6 58.26(3) . . ?
Cu21 Cu5 Cu6 90.37(3) . . ?
Cu15 Cu5 Cu6 60.04(3) . . ?
Cu13 Cu5 Cu6 147.41(4) . . ?
Cu14 Cu5 Cu6 120.44(4) . . ?
Cu7 Cu5 Cu4 58.23(3) . . ?
Cu21 Cu5 Cu4 89.83(3) . . ?
Cu15 Cu5 Cu4 147.03(4) . . ?
Cu13 Cu5 Cu4 59.68(3) . . ?
Cu14 Cu5 Cu4 120.08(4) . . ?
Cu6 Cu5 Cu4 107.96(4) . . ?
Cu7 Cu5 Cu1 58.54(3) . . ?
Cu21 Cu5 Cu1 122.23(4) . . ?
Cu15 Cu5 Cu1 119.76(4) . . ?
Cu13 Cu5 Cu1 119.90(4) . . ?
Cu14 Cu5 Cu1 178.96(4) . . ?
Cu6 Cu5 Cu1 59.84(3) . . ?
Cu4 Cu5 Cu1 60.37(3) . . ?
Cu7 Cu6 Cu22 63.52(3) . . ?
Cu7 Cu6 Cu17 92.47(4) . . ?
Cu22 Cu6 Cu17 61.15(3) . . ?
Cu7 Cu6 Cu16 122.11(4) . . ?
Cu22 Cu6 Cu16 58.59(3) . . ?
Cu17 Cu6 Cu16 60.41(3) . . ?
Cu7 Cu6 Cu15 91.86(4) . . ?
Cu22 Cu6 Cu15 60.98(3) . . ?
Cu17 Cu6 Cu15 111.80(4) . . ?
Cu16 Cu6 Cu15 60.41(3) . . ?
Cu7 Cu6 Cu2 58.42(3) . . ?
Cu22 Cu6 Cu2 90.13(4) . . ?
Cu17 Cu6 Cu2 60.02(3) . . ?
Cu16 Cu6 Cu2 120.35(4) . . ?
Cu15 Cu6 Cu2 146.69(4) . . ?
Cu7 Cu6 Cu5 58.07(3) . . ?
Cu22 Cu6 Cu5 89.54(4) . . ?
Cu17 Cu6 Cu5 146.61(4) . . ?
Cu16 Cu6 Cu5 119.54(4) . . ?
Cu15 Cu6 Cu5 59.21(3) . . ?
Cu2 Cu6 Cu5 108.16(4) . . ?
Cu7 Cu6 Cu1 58.98(3) . . ?
Cu22 Cu6 Cu1 122.50(4) . . ?
Cu17 Cu6 Cu1 119.56(4) . . ?
Cu16 Cu6 Cu1 178.85(5) . . ?
Cu15 Cu6 Cu1 120.28(4) . . ?
Cu2 Cu6 Cu1 59.69(3) . . ?
Cu5 Cu6 Cu1 61.20(3) . . ?
Cu5 Cu7 Cu3 117.09(4) . . ?
Cu5 Cu7 Cu6 63.68(3) . . ?
Cu3 Cu7 Cu6 116.77(4) . . ?
Cu5 Cu7 Cu2 116.93(4) . . ?
Cu3 Cu7 Cu2 63.65(3) . . ?
Cu6 Cu7 Cu2 63.31(3) . . ?
Cu5 Cu7 Cu4 63.88(3) . . ?
Cu3 Cu7 Cu4 63.46(4) . . ?
Cu6 Cu7 Cu4 117.16(4) . . ?
Cu2 Cu7 Cu4 116.97(4) . . ?
Cu5 Cu7 Cu1 64.66(3) . . ?
Cu3 Cu7 Cu1 63.10(3) . . ?
Cu6 Cu7 Cu1 63.63(3) . . ?
Cu2 Cu7 Cu1 62.81(3) . . ?
Cu4 Cu7 Cu1 64.27(3) . . ?
Cu5 Cu7 Cu48 116.32(4) . . ?
Cu3 Cu7 Cu48 116.32(4) . . ?
Cu6 Cu7 Cu48 116.32(4) . . ?
Cu2 Cu7 Cu48 116.18(4) . . ?
Cu4 Cu7 Cu48 116.39(4) . . ?
Cu1 Cu7 Cu48 178.95(5) . . ?
Cu5 Cu7 Cu19 148.11(4) . . ?
Cu3 Cu7 Cu19 58.54(3) . . ?
Cu6 Cu7 Cu19 148.19(4) . . ?
Cu2 Cu7 Cu19 90.30(4) . . ?
Cu4 Cu7 Cu19 89.82(4) . . ?
Cu1 Cu7 Cu19 121.64(4) . . ?
Cu48 Cu7 Cu19 57.78(3) . . ?
Cu5 Cu7 Cu21 58.20(3) . . ?
Cu3 Cu7 Cu21 148.05(4) . . ?
Cu6 Cu7 Cu21 90.33(4) . . ?
Cu2 Cu7 Cu21 148.30(4) . . ?
Cu4 Cu7 Cu21 89.93(4) . . ?
Cu1 Cu7 Cu21 122.86(4) . . ?
Cu48 Cu7 Cu21 58.12(3) . . ?
Cu19 Cu7 Cu21 107.20(4) . . ?
Cu5 Cu7 Cu20 89.71(4) . . ?
Cu3 Cu7 Cu20 90.19(4) . . ?
Cu6 Cu7 Cu20 148.12(5) . . ?
Cu2 Cu7 Cu20 148.57(4) . . ?
Cu4 Cu7 Cu20 58.12(3) . . ?
Cu1 Cu7 Cu20 122.39(4) . . ?
Cu48 Cu7 Cu20 58.27(3) . . ?
Cu19 Cu7 Cu20 59.90(3) . . ?
Cu21 Cu7 Cu20 59.43(3) . . ?
Cu5 Cu7 Cu18 147.96(4) . . ?
Cu3 Cu7 Cu18 90.16(4) . . ?
Cu6 Cu7 Cu18 89.85(4) . . ?
Cu2 Cu7 Cu18 58.42(3) . . ?
Cu4 Cu7 Cu18 148.15(4) . . ?
Cu1 Cu7 Cu18 121.23(4) . . ?
Cu48 Cu7 Cu18 57.76(3) . . ?
Cu19 Cu7 Cu18 59.94(3) . . ?
Cu21 Cu7 Cu18 107.48(3) . . ?
Cu20 Cu7 Cu18 107.76(3) . . ?
Cu5 Cu7 Cu22 89.87(4) . . ?
Cu3 Cu7 Cu22 148.26(4) . . ?
Cu6 Cu7 Cu22 58.52(3) . . ?
Cu2 Cu7 Cu22 90.06(4) . . ?
Cu4 Cu7 Cu22 148.26(5) . . ?
Cu1 Cu7 Cu22 122.15(4) . . ?
Cu48 Cu7 Cu22 57.80(3) . . ?
Cu19 Cu7 Cu22 107.35(3) . . ?
Cu21 Cu7 Cu22 59.86(3) . . ?
Cu20 Cu7 Cu22 107.35(4) . . ?
Cu18 Cu7 Cu22 59.67(3) . . ?
Cu18 Cu8 Cu38 64.32(3) . . ?
Cu18 Cu8 Cu24 90.54(4) . . ?
Cu38 Cu8 Cu24 59.00(3) . . ?
Cu18 Cu8 Cu2 59.05(3) . . ?
Cu38 Cu8 Cu2 123.37(4) . . ?
Cu24 Cu8 Cu2 119.76(4) . . ?
Cu18 Cu8 Cu37 90.39(4) . . ?
Cu38 Cu8 Cu37 59.17(3) . . ?
Cu24 Cu8 Cu37 109.93(4) . . ?
Cu2 Cu8 Cu37 119.77(4) . . ?
Cu18 Cu8 Cu17 61.30(3) . . ?
Cu38 Cu8 Cu17 93.49(4) . . ?
Cu24 Cu8 Cu17 148.27(4) . . ?
Cu2 Cu8 Cu17 59.98(3) . . ?
Cu37 Cu8 Cu17 59.82(3) . . ?
Cu18 Cu8 Cu9 61.10(3) . . ?
Cu38 Cu8 Cu9 93.31(4) . . ?
Cu24 Cu8 Cu9 60.13(3) . . ?
Cu2 Cu8 Cu9 59.65(3) . . ?
Cu37 Cu8 Cu9 148.05(4) . . ?
Cu17 Cu8 Cu9 111.04(4) . . ?
Cu18 Cu8 Cu23 121.83(4) . . ?
Cu38 Cu8 Cu23 57.51(3) . . ?
Cu24 Cu8 Cu23 60.82(3) . . ?
Cu2 Cu8 Cu23 179.06(5) . . ?
Cu37 Cu8 Cu23 60.25(3) . . ?
Cu17 Cu8 Cu23 120.00(4) . . ?
Cu9 Cu8 Cu23 120.90(4) . . ?
Cu25 Cu9 Cu2 175.05(5) . . ?
Cu25 Cu9 Cu18 117.58(4) . . ?
Cu2 Cu9 Cu18 57.69(3) . . ?
Cu25 Cu9 Cu3 119.15(4) . . ?
Cu2 Cu9 Cu3 60.82(3) . . ?
Cu18 Cu9 Cu3 88.60(4) . . ?
Cu25 Cu9 Cu19 87.58(4) . . ?
Cu2 Cu9 Cu19 88.52(4) . . ?
Cu18 Cu9 Cu19 60.60(3) . . ?
Cu3 Cu9 Cu19 57.50(3) . . ?
Cu25 Cu9 Cu39 57.24(3) . . ?
Cu2 Cu9 Cu39 118.03(4) . . ?
Cu18 Cu9 Cu39 60.34(3) . . ?
Cu3 Cu9 Cu39 117.87(4) . . ?
Cu19 Cu9 Cu39 60.38(3) . . ?
Cu25 Cu9 Cu24 60.46(3) . . ?
Cu2 Cu9 Cu24 119.09(4) . . ?
Cu18 Cu9 Cu24 87.60(4) . . ?
Cu3 Cu9 Cu24 175.24(5) . . ?
Cu19 Cu9 Cu24 117.98(4) . . ?
Cu39 Cu9 Cu24 57.61(3) . . ?
Cu25 Cu9 Cu8 119.72(4) . . ?
Cu2 Cu9 Cu8 59.73(3) . . ?
Cu18 Cu9 Cu8 56.78(3) . . ?
Cu3 Cu9 Cu8 120.45(4) . . ?
Cu19 Cu9 Cu8 117.37(4) . . ?
Cu39 Cu9 Cu8 87.37(3) . . ?
Cu24 Cu9 Cu8 59.38(3) . . ?
Cu25 Cu9 Cu10 59.87(3) . . ?
Cu2 Cu9 Cu10 120.05(4) . . ?
Cu18 Cu9 Cu10 117.36(4) . . ?
Cu3 Cu9 Cu10 59.32(3) . . ?
Cu19 Cu9 Cu10 56.76(3) . . ?
Cu39 Cu9 Cu10 87.52(3) . . ?
Cu24 Cu9 Cu10 120.25(4) . . ?
Cu8 Cu9 Cu10 173.76(5) . . ?
Cu19 Cu10 Cu40 63.74(3) . . ?
Cu19 Cu10 Cu3 59.09(3) . . ?
Cu40 Cu10 Cu3 122.83(4) . . ?
Cu19 Cu10 Cu25 89.74(4) . . ?
Cu40 Cu10 Cu25 59.26(3) . . ?
Cu3 Cu10 Cu25 118.96(4) . . ?
Cu19 Cu10 Cu11 61.25(3) . . ?
Cu40 Cu10 Cu11 92.72(4) . . ?
Cu3 Cu10 Cu11 60.30(3) . . ?
Cu25 Cu10 Cu11 147.52(4) . . ?
Cu19 Cu10 Cu27 90.36(4) . . ?
Cu40 Cu10 Cu27 59.21(3) . . ?
Cu3 Cu10 Cu27 119.75(5) . . ?
Cu25 Cu10 Cu27 110.38(4) . . ?
Cu11 Cu10 Cu27 59.47(3) . . ?
Cu19 Cu10 Cu9 61.18(3) . . ?
Cu40 Cu10 Cu9 93.05(4) . . ?
Cu3 Cu10 Cu9 59.79(3) . . ?
Cu25 Cu10 Cu9 59.20(3) . . ?
Cu11 Cu10 Cu9 111.34(4) . . ?
Cu27 Cu10 Cu9 148.04(4) . . ?
Cu19 Cu10 Cu26 121.18(4) . . ?
Cu40 Cu10 Cu26 57.44(3) . . ?
Cu3 Cu10 Cu26 179.57(5) . . ?
Cu25 Cu10 Cu26 60.82(3) . . ?
Cu11 Cu10 Cu26 120.10(4) . . ?
Cu27 Cu10 Cu26 60.66(4) . . ?
Cu9 Cu10 Cu26 119.97(4) . . ?
Cu4 Cu11 Cu27 175.70(4) . . ?
Cu4 Cu11 Cu20 57.54(3) . . ?
Cu27 Cu11 Cu20 118.28(4) . . ?
Cu4 Cu11 Cu41 118.56(4) . . ?
Cu27 Cu11 Cu41 57.25(3) . . ?
Cu20 Cu11 Cu41 61.03(3) . . ?
Cu4 Cu11 Cu19 88.40(3) . . ?
Cu27 Cu11 Cu19 88.41(4) . . ?
Cu20 Cu11 Cu19 60.68(3) . . ?
Cu41 Cu11 Cu19 60.89(3) . . ?
Cu4 Cu11 Cu28 119.00(5) . . ?
Cu27 Cu11 Cu28 60.34(4) . . ?
Cu20 Cu11 Cu28 87.92(4) . . ?
Cu41 Cu11 Cu28 57.66(3) . . ?
Cu19 Cu11 Cu28 118.53(4) . . ?
Cu4 Cu11 Cu10 119.96(4) . . ?
Cu27 Cu11 Cu10 60.29(4) . . ?
Cu20 Cu11 Cu10 117.73(4) . . ?
Cu41 Cu11 Cu10 87.75(4) . . ?
Cu19 Cu11 Cu10 57.05(3) . . ?
Cu28 Cu11 Cu10 120.55(4) . . ?
Cu4 Cu11 Cu3 60.63(3) . . ?
Cu27 Cu11 Cu3 119.66(5) . . ?
Cu20 Cu11 Cu3 88.45(4) . . ?
Cu41 Cu11 Cu3 118.33(4) . . ?
Cu19 Cu11 Cu3 57.44(3) . . ?
Cu28 Cu11 Cu3 175.66(4) . . ?
Cu10 Cu11 Cu3 59.40(3) . . ?
Cu4 Cu11 Cu12 60.25(3) . . ?
Cu27 Cu11 Cu12 119.06(4) . . ?
Cu20 Cu11 Cu12 57.50(3) . . ?
Cu41 Cu11 Cu12 87.76(4) . . ?
Cu19 Cu11 Cu12 118.17(4) . . ?
Cu28 Cu11 Cu12 58.78(3) . . ?
Cu10 Cu11 Cu12 174.75(4) . . ?
Cu3 Cu11 Cu12 120.81(4) . . ?
Cu42 Cu12 Cu20 64.19(3) . . ?
Cu42 Cu12 Cu28 58.93(3) . . ?
Cu20 Cu12 Cu28 90.62(4) . . ?
Cu42 Cu12 Cu30 59.18(3) . . ?
Cu20 Cu12 Cu30 89.72(4) . . ?
Cu28 Cu12 Cu30 110.14(4) . . ?
Cu42 Cu12 Cu4 122.34(4) . . ?
Cu20 Cu12 Cu4 58.15(3) . . ?
Cu28 Cu12 Cu4 119.44(5) . . ?
Cu30 Cu12 Cu4 118.97(4) . . ?
Cu42 Cu12 Cu11 92.81(4) . . ?
Cu20 Cu12 Cu11 60.59(3) . . ?
Cu28 Cu12 Cu11 60.31(3) . . ?
Cu30 Cu12 Cu11 147.06(4) . . ?
Cu4 Cu12 Cu11 59.15(3) . . ?
Cu42 Cu12 Cu13 93.15(4) . . ?
Cu20 Cu12 Cu13 60.68(3) . . ?
Cu28 Cu12 Cu13 147.78(4) . . ?
Cu30 Cu12 Cu13 59.41(3) . . ?
Cu4 Cu12 Cu13 59.62(3) . . ?
Cu11 Cu12 Cu13 110.19(4) . . ?
Cu42 Cu12 Cu29 58.41(3) . . ?
Cu20 Cu12 Cu29 122.58(4) . . ?
Cu28 Cu12 Cu29 61.84(4) . . ?
Cu30 Cu12 Cu29 60.27(4) . . ?
Cu4 Cu12 Cu29 178.68(5) . . ?
Cu11 Cu12 Cu29 122.11(4) . . ?
Cu13 Cu12 Cu29 119.55(5) . . ?
Cu31 Cu13 Cu30 60.01(4) . . ?
Cu31 Cu13 Cu20 117.54(4) . . ?
Cu30 Cu13 Cu20 87.91(4) . . ?
Cu31 Cu13 Cu21 87.57(4) . . ?
Cu30 Cu13 Cu21 117.48(4) . . ?
Cu20 Cu13 Cu21 60.17(3) . . ?
Cu31 Cu13 Cu5 119.09(4) . . ?
Cu30 Cu13 Cu5 174.53(4) . . ?
Cu20 Cu13 Cu5 88.01(4) . . ?
Cu21 Cu13 Cu5 57.19(3) . . ?
Cu31 Cu13 Cu4 174.55(4) . . ?
Cu30 Cu13 Cu4 119.47(4) . . ?
Cu20 Cu13 Cu4 57.25(3) . . ?
Cu21 Cu13 Cu4 88.12(4) . . ?
Cu5 Cu13 Cu4 60.84(3) . . ?
Cu31 Cu13 Cu43 57.28(3) . . ?
Cu30 Cu13 Cu43 57.17(3) . . ?
Cu20 Cu13 Cu43 60.27(3) . . ?
Cu21 Cu13 Cu43 60.32(3) . . ?
Cu5 Cu13 Cu43 117.51(4) . . ?
Cu4 Cu13 Cu43 117.52(4) . . ?
Cu31 Cu13 Cu12 119.46(4) . . ?
Cu30 Cu13 Cu12 59.53(3) . . ?
Cu20 Cu13 Cu12 57.44(3) . . ?
Cu21 Cu13 Cu12 117.58(4) . . ?
Cu5 Cu13 Cu12 120.75(5) . . ?
Cu4 Cu13 Cu12 60.00(3) . . ?
Cu43 Cu13 Cu12 87.31(3) . . ?
Cu31 Cu13 Cu14 59.12(3) . . ?
Cu30 Cu13 Cu14 119.05(5) . . ?
Cu20 Cu13 Cu14 117.50(4) . . ?
Cu21 Cu13 Cu14 57.36(3) . . ?
Cu5 Cu13 Cu14 60.04(3) . . ?
Cu4 Cu13 Cu14 120.79(4) . . ?
Cu43 Cu13 Cu14 87.35(4) . . ?
Cu12 Cu13 Cu14 174.13(4) . . ?
Cu44 Cu14 Cu21 63.91(3) . . ?
Cu44 Cu14 Cu33 58.99(3) . . ?
Cu21 Cu14 Cu33 90.41(4) . . ?
Cu44 Cu14 Cu31 59.16(3) . . ?
Cu21 Cu14 Cu31 89.83(4) . . ?
Cu33 Cu14 Cu31 110.04(4) . . ?
Cu44 Cu14 Cu5 121.99(4) . . ?
Cu21 Cu14 Cu5 58.09(3) . . ?
Cu33 Cu14 Cu5 119.39(4) . . ?
Cu31 Cu14 Cu5 118.99(4) . . ?
Cu44 Cu14 Cu15 92.88(4) . . ?
Cu21 Cu14 Cu15 60.74(3) . . ?
Cu33 Cu14 Cu15 60.23(3) . . ?
Cu31 Cu14 Cu15 147.31(4) . . ?
Cu5 Cu14 Cu15 59.21(3) . . ?
Cu44 Cu14 Cu13 93.02(4) . . ?
Cu21 Cu14 Cu13 60.78(3) . . ?
Cu33 Cu14 Cu13 147.70(4) . . ?
Cu31 Cu14 Cu13 59.58(3) . . ?
Cu5 Cu14 Cu13 59.48(3) . . ?
Cu15 Cu14 Cu13 110.31(4) . . ?
Cu44 Cu14 Cu32 58.25(3) . . ?
Cu21 Cu14 Cu32 122.15(4) . . ?
Cu33 Cu14 Cu32 61.13(4) . . ?
Cu31 Cu14 Cu32 60.66(4) . . ?
Cu5 Cu14 Cu32 179.47(5) . . ?
Cu15 Cu14 Cu32 121.31(4) . . ?
Cu13 Cu14 Cu32 120.15(4) . . ?
Cu34 Cu15 Cu5 175.10(4) . . ?
Cu34 Cu15 Cu21 117.75(4) . . ?
Cu5 Cu15 Cu21 57.44(3) . . ?
Cu34 Cu15 Cu22 87.99(3) . . ?
Cu5 Cu15 Cu22 88.50(4) . . ?
Cu21 Cu15 Cu22 60.69(3) . . ?
Cu34 Cu15 Cu33 59.82(3) . . ?
Cu5 Cu15 Cu33 119.21(4) . . ?
Cu21 Cu15 Cu33 87.79(4) . . ?
Cu22 Cu15 Cu33 117.92(4) . . ?
Cu34 Cu15 Cu6 119.76(4) . . ?
Cu5 Cu15 Cu6 60.75(3) . . ?
Cu21 Cu15 Cu6 88.50(4) . . ?
Cu22 Cu15 Cu6 57.59(3) . . ?
Cu33 Cu15 Cu6 175.29(4) . . ?
Cu34 Cu15 Cu45 57.12(3) . . ?
Cu5 Cu15 Cu45 118.07(4) . . ?
Cu21 Cu15 Cu45 60.63(3) . . ?
Cu22 Cu15 Cu45 60.29(3) . . ?
Cu33 Cu15 Cu45 57.64(3) . . ?
Cu6 Cu15 Cu45 117.88(4) . . ?
Cu34 Cu15 Cu16 60.28(3) . . ?
Cu5 Cu15 Cu16 120.21(5) . . ?
Cu21 Cu15 Cu16 117.92(4) . . ?
Cu22 Cu15 Cu16 57.23(3) . . ?
Cu33 Cu15 Cu16 120.03(4) . . ?
Cu6 Cu15 Cu16 59.53(3) . . ?
Cu45 Cu15 Cu16 87.68(3) . . ?
Cu34 Cu15 Cu14 118.69(5) . . ?
Cu5 Cu15 Cu14 60.32(3) . . ?
Cu21 Cu15 Cu14 57.53(3) . . ?
Cu22 Cu15 Cu14 118.19(4) . . ?
Cu33 Cu15 Cu14 58.94(3) . . ?
Cu6 Cu15 Cu14 121.01(4) . . ?
Cu45 Cu15 Cu14 87.70(4) . . ?
Cu16 Cu15 Cu14 174.82(4) . . ?
Cu22 Cu16 Cu46 63.77(3) . . ?
Cu22 Cu16 Cu36 90.19(3) . . ?
Cu46 Cu16 Cu36 58.25(3) . . ?
Cu22 Cu16 Cu6 58.96(3) . . ?
Cu46 Cu16 Cu6 122.73(4) . . ?
Cu36 Cu16 Cu6 120.24(4) . . ?
Cu22 Cu16 Cu17 61.02(3) . . ?
Cu46 Cu16 Cu17 92.88(4) . . ?
Cu36 Cu16 Cu17 60.59(3) . . ?
Cu6 Cu16 Cu17 59.70(3) . . ?
Cu22 Cu16 Cu34 89.48(4) . . ?
Cu46 Cu16 Cu34 58.88(3) . . ?
Cu36 Cu16 Cu34 109.10(4) . . ?
Cu6 Cu16 Cu34 119.16(4) . . ?
Cu17 Cu16 Cu34 147.12(4) . . ?
Cu22 Cu16 Cu15 60.97(3) . . ?
Cu46 Cu16 Cu15 92.77(4) . . ?
Cu36 Cu16 Cu15 147.16(4) . . ?
Cu6 Cu16 Cu15 60.06(3) . . ?
Cu17 Cu16 Cu15 110.92(4) . . ?
Cu34 Cu16 Cu15 59.15(3) . . ?
Cu22 Cu16 Cu35 121.89(4) . . ?
Cu46 Cu16 Cu35 58.14(3) . . ?
Cu36 Cu16 Cu35 61.24(3) . . ?
Cu6 Cu16 Cu35 178.47(5) . . ?
Cu17 Cu16 Cu35 121.76(4) . . ?
Cu34 Cu16 Cu35 59.96(3) . . ?
Cu15 Cu16 Cu35 119.00(5) . . ?
Cu6 Cu17 Cu22 57.87(3) . . ?
Cu6 Cu17 Cu47 118.73(4) . . ?
Cu22 Cu17 Cu47 60.86(3) . . ?
Cu6 Cu17 Cu18 88.48(4) . . ?
Cu22 Cu17 Cu18 60.57(3) . . ?
Cu47 Cu17 Cu18 60.51(3) . . ?
Cu6 Cu17 Cu2 60.54(3) . . ?
Cu22 Cu17 Cu2 88.57(4) . . ?
Cu47 Cu17 Cu2 118.08(4) . . ?
Cu18 Cu17 Cu2 57.57(3) . . ?
Cu6 Cu17 Cu37 175.23(4) . . ?
Cu22 Cu17 Cu37 117.49(4) . . ?
Cu47 Cu17 Cu37 56.63(3) . . ?
Cu18 Cu17 Cu37 87.99(3) . . ?
Cu2 Cu17 Cu37 119.80(4) . . ?
Cu6 Cu17 Cu16 59.89(3) . . ?
Cu22 Cu17 Cu16 57.39(3) . . ?
Cu47 Cu17 Cu16 88.27(4) . . ?
Cu18 Cu17 Cu16 117.95(4) . . ?
Cu2 Cu17 Cu16 120.36(4) . . ?
Cu37 Cu17 Cu16 119.30(4) . . ?
Cu6 Cu17 Cu8 120.20(4) . . ?
Cu22 Cu17 Cu8 117.42(4) . . ?
Cu47 Cu17 Cu8 86.98(3) . . ?
Cu18 Cu17 Cu8 56.87(3) . . ?
Cu2 Cu17 Cu8 59.75(3) . . ?
Cu37 Cu17 Cu8 60.08(3) . . ?
Cu16 Cu17 Cu8 174.37(4) . . ?
Cu6 Cu17 Cu36 118.94(4) . . ?
Cu22 Cu17 Cu36 87.25(4) . . ?
Cu47 Cu17 Cu36 57.43(3) . . ?
Cu18 Cu17 Cu36 117.90(4) . . ?
Cu2 Cu17 Cu36 175.07(4) . . ?
Cu37 Cu17 Cu36 60.26(3) . . ?
Cu16 Cu17 Cu36 59.10(3) . . ?
Cu8 Cu17 Cu36 120.24(4) . . ?
Cu8 Cu18 Cu2 62.81(3) . . ?
Cu8 Cu18 Cu48 179.27(4) . . ?
Cu2 Cu18 Cu48 117.90(4) . . ?
Cu8 Cu18 Cu49 116.99(4) . . ?
Cu2 Cu18 Cu49 179.69(5) . . ?
Cu48 Cu18 Cu49 62.31(3) . . ?
Cu8 Cu18 Cu9 62.11(3) . . ?
Cu2 Cu18 Cu9 61.15(3) . . ?
Cu48 Cu18 Cu9 118.30(4) . . ?
Cu49 Cu18 Cu9 118.56(4) . . ?
Cu8 Cu18 Cu17 61.83(3) . . ?
Cu2 Cu18 Cu17 61.33(3) . . ?
Cu48 Cu18 Cu17 118.23(4) . . ?
Cu49 Cu18 Cu17 118.83(4) . . ?
Cu9 Cu18 Cu17 112.27(4) . . ?
Cu8 Cu18 Cu39 90.22(4) . . ?
Cu2 Cu18 Cu39 121.22(4) . . ?
Cu48 Cu18 Cu39 89.52(3) . . ?
Cu49 Cu18 Cu39 58.49(3) . . ?
Cu9 Cu18 Cu39 60.07(3) . . ?
Cu17 Cu18 Cu39 148.21(4) . . ?
Cu8 Cu18 Cu22 121.43(4) . . ?
Cu2 Cu18 Cu22 90.16(3) . . ?
Cu48 Cu18 Cu22 58.62(3) . . ?
Cu49 Cu18 Cu22 90.15(3) . . ?
Cu9 Cu18 Cu22 146.90(4) . . ?
Cu17 Cu18 Cu22 59.61(3) . . ?
Cu39 Cu18 Cu22 144.30(4) . . ?
Cu8 Cu18 Cu47 89.32(4) . . ?
Cu2 Cu18 Cu47 121.06(4) . . ?
Cu48 Cu18 Cu47 90.12(3) . . ?
Cu49 Cu18 Cu47 59.09(3) . . ?
Cu9 Cu18 Cu47 147.60(4) . . ?
Cu17 Cu18 Cu47 59.74(3) . . ?
Cu39 Cu18 Cu47 108.60(3) . . ?
Cu22 Cu18 Cu47 60.28(3) . . ?
Cu8 Cu18 Cu19 121.99(4) . . ?
Cu2 Cu18 Cu19 90.08(3) . . ?
Cu48 Cu18 Cu19 58.41(3) . . ?
Cu49 Cu18 Cu19 89.85(3) . . ?
Cu9 Cu18 Cu19 59.89(3) . . ?
Cu17 Cu18 Cu19 146.82(4) . . ?
Cu39 Cu18 Cu19 60.05(3) . . ?
Cu22 Cu18 Cu19 107.71(4) . . ?
Cu47 Cu18 Cu19 144.70(4) . . ?
Cu8 Cu18 Cu7 120.89(4) . . ?
Cu2 Cu18 Cu7 58.08(3) . . ?
Cu48 Cu18 Cu7 59.82(3) . . ?
Cu49 Cu18 Cu7 122.12(4) . . ?
Cu9 Cu18 Cu7 89.06(3) . . ?
Cu17 Cu18 Cu7 89.13(3) . . ?
Cu39 Cu18 Cu7 119.94(4) . . ?
Cu22 Cu18 Cu7 60.17(3) . . ?
Cu47 Cu18 Cu7 120.44(4) . . ?
Cu19 Cu18 Cu7 59.89(3) . . ?
Cu8 Cu18 Cu38 57.98(3) . . ?
Cu2 Cu18 Cu38 120.79(4) . . ?
Cu48 Cu18 Cu38 121.31(4) . . ?
Cu49 Cu18 Cu38 59.00(3) . . ?
Cu9 Cu18 Cu38 90.33(4) . . ?
Cu17 Cu18 Cu38 90.23(3) . . ?
Cu39 Cu18 Cu38 60.47(3) . . ?
Cu22 Cu18 Cu38 120.22(4) . . ?
Cu47 Cu18 Cu38 59.93(3) . . ?
Cu19 Cu18 Cu38 120.52(4) . . ?
Cu7 Cu18 Cu38 178.87(4) . . ?
Cu10 Cu19 Cu3 62.42(3) . . ?
Cu10 Cu19 Cu48 179.52(4) . . ?
Cu3 Cu19 Cu48 118.05(4) . . ?
Cu10 Cu19 Cu50 117.25(4) . . ?
Cu3 Cu19 Cu50 179.67(5) . . ?
Cu48 Cu19 Cu50 62.29(3) . . ?
Cu10 Cu19 Cu11 61.69(3) . . ?
Cu3 Cu19 Cu11 61.50(3) . . ?
Cu48 Cu19 Cu11 118.54(4) . . ?
Cu50 Cu19 Cu11 118.38(4) . . ?
Cu10 Cu19 Cu9 62.06(3) . . ?
Cu3 Cu19 Cu9 61.12(3) . . ?
Cu48 Cu19 Cu9 118.02(4) . . ?
Cu50 Cu19 Cu9 118.80(4) . . ?
Cu11 Cu19 Cu9 112.40(4) . . ?
Cu10 Cu19 Cu20 121.19(4) . . ?
Cu3 Cu19 Cu20 90.08(4) . . ?
Cu48 Cu19 Cu20 59.04(3) . . ?
Cu50 Cu19 Cu20 90.10(4) . . ?
Cu11 Cu19 Cu20 59.50(3) . . ?
Cu9 Cu19 Cu20 146.79(4) . . ?
Cu10 Cu19 Cu39 90.23(4) . . ?
Cu3 Cu19 Cu39 120.98(4) . . ?
Cu48 Cu19 Cu39 89.43(3) . . ?
Cu50 Cu19 Cu39 58.94(3) . . ?
Cu11 Cu19 Cu39 147.99(4) . . ?
Cu9 Cu19 Cu39 59.86(3) . . ?
Cu20 Cu19 Cu39 144.67(4) . . ?
Cu10 Cu19 Cu7 120.52(4) . . ?
Cu3 Cu19 Cu7 58.10(3) . . ?
Cu48 Cu19 Cu7 59.95(3) . . ?
Cu50 Cu19 Cu7 122.23(4) . . ?
Cu11 Cu19 Cu7 89.26(3) . . ?
Cu9 Cu19 Cu7 89.00(3) . . ?
Cu20 Cu19 Cu7 60.15(3) . . ?
Cu39 Cu19 Cu7 119.97(4) . . ?
Cu10 Cu19 Cu18 121.56(4) . . ?
Cu3 Cu19 Cu18 90.04(3) . . ?
Cu48 Cu19 Cu18 58.51(3) . . ?
Cu50 Cu19 Cu18 90.17(3) . . ?
Cu11 Cu19 Cu18 147.13(4) . . ?
Cu9 Cu19 Cu18 59.51(3) . . ?
Cu20 Cu19 Cu18 108.14(4) . . ?
Cu39 Cu19 Cu18 59.81(3) . . ?
Cu7 Cu19 Cu18 60.17(3) . . ?
Cu10 Cu19 Cu40 58.25(3) . . ?
Cu3 Cu19 Cu40 120.67(4) . . ?
Cu48 Cu19 Cu40 121.28(4) . . ?
Cu50 Cu19 Cu40 59.00(3) . . ?
Cu11 Cu19 Cu40 89.90(3) . . ?
Cu9 Cu19 Cu40 90.47(4) . . ?
Cu20 Cu19 Cu40 120.11(4) . . ?
Cu39 Cu19 Cu40 60.63(3) . . ?
Cu7 Cu19 Cu40 178.75(4) . . ?
Cu18 Cu19 Cu40 120.44(4) . . ?
Cu10 Cu19 Cu41 89.54(4) . . ?
Cu3 Cu19 Cu41 120.94(4) . . ?
Cu48 Cu19 Cu41 90.26(4) . . ?
Cu50 Cu19 Cu41 58.94(3) . . ?
Cu11 Cu19 Cu41 59.44(3) . . ?
Cu9 Cu19 Cu41 147.77(4) . . ?
Cu20 Cu19 Cu41 60.15(3) . . ?
Cu39 Cu19 Cu41 108.90(4) . . ?
Cu7 Cu19 Cu41 120.28(4) . . ?
Cu18 Cu19 Cu41 144.95(4) . . ?
Cu40 Cu19 Cu41 59.97(3) . . ?
Cu4 Cu20 Cu51 179.24(5) . . ?
Cu4 Cu20 Cu12 63.07(3) . . ?
Cu51 Cu20 Cu12 116.88(4) . . ?
Cu4 Cu20 Cu48 117.88(4) . . ?
Cu51 Cu20 Cu48 62.16(3) . . ?
Cu12 Cu20 Cu48 178.97(4) . . ?
Cu4 Cu20 Cu11 61.13(3) . . ?
Cu51 Cu20 Cu11 118.14(4) . . ?
Cu12 Cu20 Cu11 61.91(3) . . ?
Cu48 Cu20 Cu11 118.04(4) . . ?
Cu4 Cu20 Cu13 61.57(3) . . ?
Cu51 Cu20 Cu13 119.13(4) . . ?
Cu12 Cu20 Cu13 61.88(3) . . ?
Cu48 Cu20 Cu13 118.81(4) . . ?
Cu11 Cu20 Cu13 112.21(4) . . ?
Cu4 Cu20 Cu21 90.50(4) . . ?
Cu51 Cu20 Cu21 90.14(3) . . ?
Cu12 Cu20 Cu21 121.85(4) . . ?
Cu48 Cu20 Cu21 58.82(3) . . ?
Cu11 Cu20 Cu21 147.25(4) . . ?
Cu13 Cu20 Cu21 60.00(3) . . ?
Cu4 Cu20 Cu43 121.86(4) . . ?
Cu51 Cu20 Cu43 58.85(3) . . ?
Cu12 Cu20 Cu43 89.81(4) . . ?
Cu48 Cu20 Cu43 89.95(3) . . ?
Cu11 Cu20 Cu43 147.65(4) . . ?
Cu13 Cu20 Cu43 60.28(3) . . ?
Cu21 Cu20 Cu43 60.27(3) . . ?
Cu4 Cu20 Cu19 89.94(4) . . ?
Cu51 Cu20 Cu19 89.48(3) . . ?
Cu12 Cu20 Cu19 121.70(4) . . ?
Cu48 Cu20 Cu19 58.23(3) . . ?
Cu11 Cu20 Cu19 59.81(3) . . ?
Cu13 Cu20 Cu19 147.13(4) . . ?
Cu21 Cu20 Cu19 107.86(4) . . ?
Cu43 Cu20 Cu19 144.16(4) . . ?
Cu4 Cu20 Cu7 58.27(3) . . ?
Cu51 Cu20 Cu7 121.78(4) . . ?
Cu12 Cu20 Cu7 121.33(4) . . ?
Cu48 Cu20 Cu7 59.62(3) . . ?
Cu11 Cu20 Cu7 89.33(4) . . ?
Cu13 Cu20 Cu7 89.53(3) . . ?
Cu21 Cu20 Cu7 60.21(3) . . ?
Cu43 Cu20 Cu7 120.48(4) . . ?
Cu19 Cu20 Cu7 59.95(3) . . ?
Cu4 Cu20 Cu41 120.65(4) . . ?
Cu51 Cu20 Cu41 58.61(3) . . ?
Cu12 Cu20 Cu41 89.37(3) . . ?
Cu48 Cu20 Cu41 89.75(3) . . ?
Cu11 Cu20 Cu41 59.53(3) . . ?
Cu13 Cu20 Cu41 147.52(4) . . ?
Cu21 Cu20 Cu41 144.64(4) . . ?
Cu43 Cu20 Cu41 108.30(4) . . ?
Cu19 Cu20 Cu41 60.10(3) . . ?
Cu7 Cu20 Cu41 120.04(4) . . ?
Cu4 Cu20 Cu42 120.65(4) . . ?
Cu51 Cu20 Cu42 59.30(3) . . ?
Cu12 Cu20 Cu42 57.58(3) . . ?
Cu48 Cu20 Cu42 121.47(4) . . ?
Cu11 Cu20 Cu42 89.84(4) . . ?
Cu13 Cu20 Cu42 90.09(4) . . ?
Cu21 Cu20 Cu42 120.43(4) . . ?
Cu43 Cu20 Cu42 60.17(3) . . ?
Cu19 Cu20 Cu42 120.17(4) . . ?
Cu7 Cu20 Cu42 178.88(4) . . ?
Cu41 Cu20 Cu42 60.08(3) . . ?
Cu5 Cu21 Cu14 63.11(3) . . ?
Cu5 Cu21 Cu52 179.58(5) . . ?
Cu14 Cu21 Cu52 117.07(4) . . ?
Cu5 Cu21 Cu48 117.88(4) . . ?
Cu14 Cu21 Cu48 178.90(5) . . ?
Cu52 Cu21 Cu48 61.95(3) . . ?
Cu5 Cu21 Cu15 61.11(3) . . ?
Cu14 Cu21 Cu15 61.73(3) . . ?
Cu52 Cu21 Cu15 118.59(4) . . ?
Cu48 Cu21 Cu15 118.13(4) . . ?
Cu5 Cu21 Cu13 61.41(3) . . ?
Cu14 Cu21 Cu13 61.86(3) . . ?
Cu52 Cu21 Cu13 119.01(4) . . ?
Cu48 Cu21 Cu13 118.94(4) . . ?
Cu15 Cu21 Cu13 111.96(4) . . ?
Cu5 Cu21 Cu20 90.23(4) . . ?
Cu14 Cu21 Cu20 121.67(4) . . ?
Cu52 Cu21 Cu20 89.98(3) . . ?
Cu48 Cu21 Cu20 59.11(3) . . ?
Cu15 Cu21 Cu20 147.12(4) . . ?
Cu13 Cu21 Cu20 59.83(3) . . ?
Cu5 Cu21 Cu43 121.59(4) . . ?
Cu14 Cu21 Cu43 89.80(4) . . ?
Cu52 Cu21 Cu43 58.83(3) . . ?
Cu48 Cu21 Cu43 90.03(3) . . ?
Cu15 Cu21 Cu43 147.63(4) . . ?
Cu13 Cu21 Cu43 60.18(3) . . ?
Cu20 Cu21 Cu43 60.11(3) . . ?
Cu5 Cu21 Cu22 90.02(4) . . ?
Cu14 Cu21 Cu22 121.40(4) . . ?
Cu52 Cu21 Cu22 89.57(3) . . ?
Cu48 Cu21 Cu22 58.43(3) . . ?
Cu15 Cu21 Cu22 59.70(3) . . ?
Cu13 Cu21 Cu22 147.26(4) . . ?
Cu20 Cu21 Cu22 108.34(4) . . ?
Cu43 Cu21 Cu22 144.41(4) . . ?
Cu5 Cu21 Cu7 58.12(3) . . ?
Cu14 Cu21 Cu7 121.22(4) . . ?
Cu52 Cu21 Cu7 121.71(4) . . ?
Cu48 Cu21 Cu7 59.76(3) . . ?
Cu15 Cu21 Cu7 89.21(4) . . ?
Cu13 Cu21 Cu7 89.52(4) . . ?
Cu20 Cu21 Cu7 60.36(3) . . ?
Cu43 Cu21 Cu7 120.47(4) . . ?
Cu22 Cu21 Cu7 60.18(3) . . ?
Cu5 Cu21 Cu45 121.13(4) . . ?
Cu14 Cu21 Cu45 89.71(4) . . ?
Cu52 Cu21 Cu45 58.56(3) . . ?
Cu48 Cu21 Cu45 89.31(3) . . ?
Cu15 Cu21 Cu45 60.03(3) . . ?
Cu13 Cu21 Cu45 147.74(4) . . ?
Cu20 Cu21 Cu45 144.43(4) . . ?
Cu43 Cu21 Cu45 108.30(4) . . ?
Cu22 Cu21 Cu45 59.76(3) . . ?
Cu7 Cu21 Cu45 119.94(4) . . ?
Cu5 Cu21 Cu44 120.94(4) . . ?
Cu14 Cu21 Cu44 57.83(3) . . ?
Cu52 Cu21 Cu44 59.23(3) . . ?
Cu48 Cu21 Cu44 121.18(4) . . ?
Cu15 Cu21 Cu44 90.01(4) . . ?
Cu13 Cu21 Cu44 90.21(4) . . ?
Cu20 Cu21 Cu44 120.27(4) . . ?
Cu43 Cu21 Cu44 60.16(3) . . ?
Cu22 Cu21 Cu44 119.86(4) . . ?
Cu7 Cu21 Cu44 179.00(4) . . ?
Cu45 Cu21 Cu44 60.10(3) . . ?
Cu16 Cu22 Cu6 62.45(3) . . ?
Cu16 Cu22 Cu53 117.54(4) . . ?
Cu6 Cu22 Cu53 179.19(5) . . ?
Cu16 Cu22 Cu48 179.77(5) . . ?
Cu6 Cu22 Cu48 117.76(4) . . ?
Cu53 Cu22 Cu48 62.26(3) . . ?
Cu16 Cu22 Cu17 61.59(3) . . ?
Cu6 Cu22 Cu17 60.98(3) . . ?
Cu53 Cu22 Cu17 118.25(4) . . ?
Cu48 Cu22 Cu17 118.37(4) . . ?
Cu16 Cu22 Cu15 61.80(3) . . ?
Cu6 Cu22 Cu15 61.43(3) . . ?
Cu53 Cu22 Cu15 119.33(4) . . ?
Cu48 Cu22 Cu15 118.38(4) . . ?
Cu17 Cu22 Cu15 112.04(4) . . ?
Cu16 Cu22 Cu45 90.19(4) . . ?
Cu6 Cu22 Cu45 121.59(4) . . ?
Cu53 Cu22 Cu45 59.18(3) . . ?
Cu48 Cu22 Cu45 89.79(3) . . ?
Cu17 Cu22 Cu45 147.79(4) . . ?
Cu15 Cu22 Cu45 60.15(3) . . ?
Cu16 Cu22 Cu18 121.40(4) . . ?
Cu6 Cu22 Cu18 89.82(4) . . ?
Cu53 Cu22 Cu18 89.53(3) . . ?
Cu48 Cu22 Cu18 58.55(3) . . ?
Cu17 Cu22 Cu18 59.82(3) . . ?
Cu15 Cu22 Cu18 146.84(4) . . ?
Cu45 Cu22 Cu18 144.42(4) . . ?
Cu16 Cu22 Cu21 121.40(4) . . ?
Cu6 Cu22 Cu21 90.07(3) . . ?
Cu53 Cu22 Cu21 90.59(3) . . ?
Cu48 Cu22 Cu21 58.78(3) . . ?
Cu17 Cu22 Cu21 146.80(4) . . ?
Cu15 Cu22 Cu21 59.61(3) . . ?
Cu45 Cu22 Cu21 60.23(3) . . ?
Cu18 Cu22 Cu21 107.95(4) . . ?
Cu16 Cu22 Cu47 89.96(3) . . ?
Cu6 Cu22 Cu47 120.64(4) . . ?
Cu53 Cu22 Cu47 58.59(3) . . ?
Cu48 Cu22 Cu47 89.83(3) . . ?
Cu17 Cu22 Cu47 59.66(3) . . ?
Cu15 Cu22 Cu47 147.99(4) . . ?
Cu45 Cu22 Cu47 108.79(3) . . ?
Cu18 Cu22 Cu47 59.86(3) . . ?
Cu21 Cu22 Cu47 144.91(4) . . ?
Cu16 Cu22 Cu7 120.41(4) . . ?
Cu6 Cu22 Cu7 57.96(3) . . ?
Cu53 Cu22 Cu7 122.05(4) . . ?
Cu48 Cu22 Cu7 59.79(3) . . ?
Cu17 Cu22 Cu7 89.24(4) . . ?
Cu15 Cu22 Cu7 89.02(3) . . ?
Cu45 Cu22 Cu7 120.18(4) . . ?
Cu18 Cu22 Cu7 60.16(3) . . ?
Cu21 Cu22 Cu7 59.96(3) . . ?
Cu47 Cu22 Cu7 120.01(4) . . ?
Cu16 Cu22 Cu46 58.25(3) . . ?
Cu6 Cu22 Cu46 120.69(4) . . ?
Cu53 Cu22 Cu46 59.30(3) . . ?
Cu48 Cu22 Cu46 121.55(4) . . ?
Cu17 Cu22 Cu46 90.09(3) . . ?
Cu15 Cu22 Cu46 90.14(3) . . ?
Cu45 Cu22 Cu46 60.19(3) . . ?
Cu18 Cu22 Cu46 120.41(4) . . ?
Cu21 Cu22 Cu46 120.42(4) . . ?
Cu47 Cu22 Cu46 60.55(3) . . ?
Cu7 Cu22 Cu46 178.65(4) . . ?
C201 Cu23 Cu38 171.1(3) . . ?
C201 Cu23 CuLX 117.5(2) . 3 ?
Cu38 Cu23 CuLX 61.32(5) . 3 ?
C201 Cu23 Cu95 99.6(3) . . ?
Cu38 Cu23 Cu95 87.29(16) . . ?
C201 Cu23 Cu37 113.4(3) . . ?
Cu38 Cu23 Cu37 58.61(3) . . ?
CuLX Cu23 Cu37 91.92(6) 3 . ?
Cu95 Cu23 Cu37 144.02(17) . . ?
C201 Cu23 CuKY 126.5(3) . . ?
Cu38 Cu23 CuKY 57.24(4) . . ?
Cu37 Cu23 CuKY 107.98(5) . . ?
C201 Cu23 Cu24 130.7(3) . . ?
Cu38 Cu23 Cu24 58.00(3) . . ?
CuLX Cu23 Cu24 87.98(5) 3 . ?
Cu95 Cu23 Cu24 56.41(16) . . ?
Cu37 Cu23 Cu24 106.49(4) . . ?
CuKY Cu23 Cu24 61.10(4) . . ?
C201 Cu23 Cu8 123.3(2) . . ?
Cu38 Cu23 Cu8 57.54(3) . . ?
CuLX Cu23 Cu8 118.81(6) 3 . ?
Cu95 Cu23 Cu8 114.52(17) . . ?
Cu37 Cu23 Cu8 58.74(3) . . ?
CuKY Cu23 Cu8 106.50(5) . . ?
Cu24 Cu23 Cu8 58.10(3) . . ?
C201 Cu23 CuLY 115.6(2) . . ?
Cu38 Cu23 CuLY 58.04(4) . . ?
Cu37 Cu23 CuLY 61.51(5) . . ?
CuKY Cu23 CuLY 59.15(5) . . ?
Cu24 Cu23 CuLY 108.21(5) . . ?
Cu8 Cu23 CuLY 107.36(5) . . ?
Cu95 Cu24 Cu38 88.70(17) . . ?
Cu95 Cu24 Cu39 120.24(18) . . ?
Cu38 Cu24 Cu39 63.73(3) . . ?
Cu38 Cu24 CuKX 64.56(5) . 3 ?
Cu39 Cu24 CuKX 62.99(5) . 3 ?
Cu38 Cu24 Cu91 122.88(13) . . ?
Cu39 Cu24 Cu91 88.54(12) . . ?
Cu95 Cu24 Cu8 120.35(17) . . ?
Cu38 Cu24 Cu8 58.45(3) . . ?
Cu39 Cu24 Cu8 90.01(4) . . ?
CuKX Cu24 Cu8 123.00(6) 3 . ?
Cu91 Cu24 Cu8 177.13(13) . . ?
Cu95 Cu24 Cu9 178.05(18) . . ?
Cu38 Cu24 Cu9 93.20(4) . . ?
Cu39 Cu24 Cu9 61.14(3) . . ?
CuKX Cu24 Cu9 124.03(6) 3 . ?
Cu91 Cu24 Cu9 116.64(13) . . ?
Cu8 Cu24 Cu9 60.49(3) . . ?
Cu95 Cu24 Cu25 120.01(17) . . ?
Cu38 Cu24 Cu25 121.69(4) . . ?
Cu39 Cu24 Cu25 57.95(3) . . ?
CuKX Cu24 Cu25 88.61(5) 3 . ?
Cu91 Cu24 Cu25 57.54(13) . . ?
Cu8 Cu24 Cu25 119.61(4) . . ?
Cu9 Cu24 Cu25 59.24(3) . . ?
Cu95 Cu24 Cu23 59.28(17) . . ?
Cu38 Cu24 Cu23 57.45(3) . . ?
Cu39 Cu24 Cu23 121.17(4) . . ?
CuKX Cu24 Cu23 90.03(5) 3 . ?
Cu91 Cu24 Cu23 121.78(13) . . ?
Cu8 Cu24 Cu23 61.08(3) . . ?
Cu9 Cu24 Cu23 121.52(4) . . ?
Cu25 Cu24 Cu23 178.63(5) . . ?
Cu38 Cu24 CuJY 89.80(5) . . ?
Cu39 Cu24 CuJY 59.18(4) . . ?
Cu8 Cu24 CuJY 144.37(5) . . ?
Cu9 Cu24 CuJY 110.73(5) . . ?
Cu25 Cu24 CuJY 61.17(4) . . ?
Cu23 Cu24 CuJY 117.53(5) . . ?
Cu38 Cu24 CuKY 56.47(4) . . ?
Cu39 Cu24 CuKY 87.95(5) . . ?
Cu8 Cu24 CuKY 107.50(5) . . ?
Cu9 Cu24 CuKY 145.19(5) . . ?
Cu25 Cu24 CuKY 119.27(5) . . ?
Cu23 Cu24 CuKY 59.41(4) . . ?
CuJY Cu24 CuKY 58.19(5) . . ?
Cu91 Cu25 Cu39 90.38(12) . . ?
Cu39 Cu25 CuJX 64.31(5) . 3 ?
Cu39 Cu25 Cu94 118.7(6) . . ?
Cu91 Cu25 Cu40 122.32(13) . . ?
Cu39 Cu25 Cu40 63.94(3) . . ?
CuJX Cu25 Cu40 63.12(5) 3 . ?
Cu94 Cu25 Cu40 88.3(7) . . ?
Cu91 Cu25 Cu9 119.69(13) . . ?
Cu39 Cu25 Cu9 61.90(3) . . ?
CuJX Cu25 Cu9 126.20(5) 3 . ?
Cu94 Cu25 Cu9 178.2(7) . . ?
Cu40 Cu25 Cu9 93.52(4) . . ?
Cu91 Cu25 Cu10 178.87(13) . . ?
Cu39 Cu25 Cu10 90.75(4) . . ?
CuJX Cu25 Cu10 121.37(6) 3 . ?
Cu94 Cu25 Cu10 120.5(6) . . ?
Cu40 Cu25 Cu10 58.27(3) . . ?
Cu9 Cu25 Cu10 60.92(3) . . ?
Cu91 Cu25 Cu24 59.53(12) . . ?
Cu39 Cu25 Cu24 59.01(3) . . ?
CuJX Cu25 Cu24 91.33(5) 3 . ?
Cu94 Cu25 Cu24 118.4(6) . . ?
Cu40 Cu25 Cu24 122.95(4) . . ?
Cu9 Cu25 Cu24 60.31(3) . . ?
Cu10 Cu25 Cu24 121.15(4) . . ?
Cu91 Cu25 Cu26 119.20(13) . . ?
Cu39 Cu25 Cu26 120.84(5) . . ?
CuJX Cu25 Cu26 87.39(5) 3 . ?
Cu94 Cu25 Cu26 60.3(6) . . ?
Cu40 Cu25 Cu26 56.91(3) . . ?
Cu9 Cu25 Cu26 121.00(5) . . ?
Cu10 Cu25 Cu26 60.13(3) . . ?
Cu24 Cu25 Cu26 178.58(5) . . ?
Cu39 Cu25 CuJY 59.36(4) . . ?
Cu40 Cu25 CuJY 90.50(5) . . ?
Cu9 Cu25 CuJY 111.33(5) . . ?
Cu10 Cu25 CuJY 145.20(5) . . ?
Cu24 Cu25 CuJY 60.83(4) . . ?
Cu26 Cu25 CuJY 117.80(5) . . ?
Cu39 Cu25 CuIY 87.14(5) . . ?
Cu40 Cu25 CuIY 56.32(4) . . ?
Cu9 Cu25 CuIY 145.16(5) . . ?
Cu10 Cu25 CuIY 107.30(5) . . ?
Cu24 Cu25 CuIY 118.66(5) . . ?
Cu26 Cu25 CuIY 59.99(4) . . ?
CuJY Cu25 CuIY 57.90(5) . . ?
C301 Cu26 Cu40 175.1(3) . . ?
C301 Cu26 CuIX 113.4(3) . 3 ?
Cu40 Cu26 CuIX 61.92(5) . 3 ?
C301 Cu26 Cu94 88.6(6) . . ?
Cu40 Cu26 Cu94 87.7(5) . . ?
C301 Cu26 Cu10 126.2(3) . . ?
Cu40 Cu26 Cu10 58.52(3) . . ?
CuIX Cu26 Cu10 120.43(5) 3 . ?
Cu94 Cu26 Cu10 116.4(7) . . ?
C301 Cu26 Cu27 123.7(3) . . ?
Cu40 Cu26 Cu27 59.05(3) . . ?
CuIX Cu26 Cu27 89.83(6) 3 . ?
Cu94 Cu26 Cu27 144.2(6) . . ?
Cu10 Cu26 Cu27 59.33(4) . . ?
C301 Cu26 Cu25 121.2(3) . . ?
Cu40 Cu26 Cu25 58.95(3) . . ?
CuIX Cu26 Cu25 91.22(5) 3 . ?
Cu94 Cu26 Cu25 57.4(7) . . ?
Cu10 Cu26 Cu25 59.05(3) . . ?
Cu27 Cu26 Cu25 107.86(4) . . ?
C301 Cu26 CuIY 118.1(3) . . ?
Cu40 Cu26 CuIY 57.32(4) . . ?
Cu10 Cu26 CuIY 107.39(5) . . ?
Cu27 Cu26 CuIY 108.40(5) . . ?
Cu25 Cu26 CuIY 61.18(4) . . ?
C301 Cu26 CuHY 119.8(3) . . ?
Cu40 Cu26 CuHY 57.17(4) . . ?
Cu10 Cu26 CuHY 107.36(5) . . ?
Cu27 Cu26 CuHY 61.12(5) . . ?
Cu25 Cu26 CuHY 108.20(5) . . ?
CuIY Cu26 CuHY 59.03(5) . . ?
Cu41 Cu27 CuHX 64.04(5) . 3 ?
Cu41 Cu27 Cu40 63.35(3) . . ?
CuHX Cu27 Cu40 63.63(5) 3 . ?
Cu41 Cu27 Cu11 61.44(3) . . ?
CuHX Cu27 Cu11 125.46(5) 3 . ?
Cu40 Cu27 Cu11 92.51(4) . . ?
Cu41 Cu27 Cu10 90.09(4) . . ?
CuHX Cu27 Cu10 121.71(5) 3 . ?
Cu40 Cu27 Cu10 58.08(3) . . ?
Cu11 Cu27 Cu10 60.24(3) . . ?
Cu41 Cu27 Cu28 58.92(3) . . ?
CuHX Cu27 Cu28 90.82(6) 3 . ?
Cu40 Cu27 Cu28 122.27(4) . . ?
Cu11 Cu27 Cu28 60.19(4) . . ?
Cu10 Cu27 Cu28 120.36(4) . . ?
Cu41 Cu27 Cu26 120.22(4) . . ?
CuHX Cu27 Cu26 88.13(6) 3 . ?
Cu40 Cu27 Cu26 56.89(3) . . ?
Cu11 Cu27 Cu26 120.22(5) . . ?
Cu10 Cu27 Cu26 60.01(4) . . ?
Cu28 Cu27 Cu26 178.89(5) . . ?
Cu41 Cu27 CuGY 58.87(4) . . ?
Cu40 Cu27 CuGY 89.61(5) . . ?
Cu11 Cu27 CuGY 111.01(5) . . ?
Cu10 Cu27 CuGY 144.02(5) . . ?
Cu28 Cu27 CuGY 61.32(5) . . ?
Cu26 Cu27 CuGY 117.71(5) . . ?
Cu41 Cu27 CuHY 86.86(5) . . ?
Cu40 Cu27 CuHY 56.17(4) . . ?
Cu11 Cu27 CuHY 144.16(5) . . ?
Cu10 Cu27 CuHY 107.05(5) . . ?
Cu28 Cu27 CuHY 118.97(6) . . ?
Cu26 Cu27 CuHY 60.04(5) . . ?
CuGY Cu27 CuHY 57.72(6) . . ?
Cu42 Cu28 Cu41 63.97(3) . . ?
Cu42 Cu28 CuGX 64.06(5) . 3 ?
Cu41 Cu28 CuGX 62.62(4) . 3 ?
Cu42 Cu28 Cu12 58.99(3) . . ?
Cu41 Cu28 Cu12 90.84(4) . . ?
CuGX Cu28 Cu12 123.03(6) 3 . ?
Cu42 Cu28 Cu11 93.21(4) . . ?
Cu41 Cu28 Cu11 60.85(3) . . ?
CuGX Cu28 Cu11 123.41(5) 3 . ?
Cu12 Cu28 Cu11 60.90(3) . . ?
Cu42 Cu28 Cu27 121.93(4) . . ?
Cu41 Cu28 Cu27 57.97(3) . . ?
CuGX Cu28 Cu27 88.48(6) 3 . ?
Cu12 Cu28 Cu27 120.31(4) . . ?
Cu11 Cu28 Cu27 59.47(3) . . ?
Cu42 Cu28 Cu29 57.98(3) . . ?
Cu41 Cu28 Cu29 121.95(4) . . ?
CuGX Cu28 Cu29 90.64(6) 3 . ?
Cu12 Cu28 Cu29 60.58(4) . . ?
Cu11 Cu28 Cu29 121.44(4) . . ?
Cu27 Cu28 Cu29 179.01(5) . . ?
Cu42 Cu28 CuGY 89.24(5) . . ?
Cu41 Cu28 CuGY 58.43(4) . . ?
Cu12 Cu28 CuGY 144.38(5) . . ?
Cu11 Cu28 CuGY 110.06(5) . . ?
Cu27 Cu28 CuGY 60.87(5) . . ?
Cu29 Cu28 CuGY 118.18(6) . . ?
Cu42 Cu28 CuFY 55.97(4) . . ?
Cu41 Cu28 CuFY 87.09(4) . . ?
Cu12 Cu28 CuFY 107.74(6) . . ?
Cu11 Cu28 CuFY 144.18(5) . . ?
Cu27 Cu28 CuFY 118.38(5) . . ?
Cu29 Cu28 CuFY 60.68(5) . . ?
CuGY Cu28 CuFY 57.58(6) . . ?
C401 Cu29 Cu42 159.9(2) . . ?
C401 Cu29 CuFX 100.5(2) . 3 ?
Cu42 Cu29 CuFX 60.41(4) . 3 ?
C401 Cu29 Cu30 120.7(2) . . ?
Cu42 Cu29 Cu30 58.34(3) . . ?
CuFX Cu29 Cu30 91.23(5) 3 . ?
C401 Cu29 Cu12 141.4(2) . . ?
Cu42 Cu29 Cu12 57.62(3) . . ?
CuFX Cu29 Cu12 117.97(5) 3 . ?
Cu30 Cu29 Cu12 58.65(3) . . ?
C401 Cu29 Cu28 132.8(2) . . ?
Cu42 Cu29 Cu28 57.16(3) . . ?
CuFX Cu29 Cu28 87.19(6) 3 . ?
Cu30 Cu29 Cu28 105.40(4) . . ?
Cu12 Cu29 Cu28 57.58(3) . . ?
C401 Cu29 CuEY 104.2(2) . . ?
Cu42 Cu29 CuEY 56.69(4) . . ?
Cu30 Cu29 CuEY 61.04(5) . . ?
Cu12 Cu29 CuEY 106.32(5) . . ?
Cu28 Cu29 CuEY 106.40(5) . . ?
C401 Cu29 CuFY 110.88(19) . . ?
Cu42 Cu29 CuFY 55.61(4) . . ?
Cu30 Cu29 CuFY 106.42(5) . . ?
Cu12 Cu29 CuFY 105.11(5) . . ?
Cu28 Cu29 CuFY 60.30(5) . . ?
CuEY Cu29 CuFY 58.08(6) . . ?
Cu43 Cu30 Cu42 63.89(3) . . ?
Cu43 Cu30 CuEX 63.18(4) . 3 ?
Cu42 Cu30 CuEX 61.93(5) . 3 ?
Cu43 Cu30 Cu13 62.13(3) . . ?
Cu42 Cu30 Cu13 93.79(4) . . ?
CuEX Cu30 Cu13 125.30(5) 3 . ?
Cu43 Cu30 Cu31 58.85(3) . . ?
Cu42 Cu30 Cu31 122.74(4) . . ?
CuEX Cu30 Cu31 91.44(5) 3 . ?
Cu13 Cu30 Cu31 59.99(4) . . ?
Cu43 Cu30 Cu12 90.99(4) . . ?
Cu42 Cu30 Cu12 58.53(3) . . ?
CuEX Cu30 Cu12 120.45(5) 3 . ?
Cu13 Cu30 Cu12 61.06(4) . . ?
Cu31 Cu30 Cu12 120.96(4) . . ?
Cu43 Cu30 Cu29 122.36(4) . . ?
Cu42 Cu30 Cu29 58.50(3) . . ?
CuEX Cu30 Cu29 87.78(5) 3 . ?
Cu13 Cu30 Cu29 122.01(5) . . ?
Cu31 Cu30 Cu29 177.88(5) . . ?
Cu12 Cu30 Cu29 61.08(4) . . ?
Cu43 Cu30 CuEY 86.65(4) . . ?
Cu42 Cu30 CuEY 56.74(5) . . ?
Cu13 Cu30 CuEY 145.33(5) . . ?
Cu31 Cu30 CuEY 117.85(6) . . ?
Cu12 Cu30 CuEY 108.21(6) . . ?
Cu29 Cu30 CuEY 61.06(5) . . ?
Cu43 Cu30 CuDY 58.76(4) . . ?
Cu42 Cu30 CuDY 89.99(5) . . ?
Cu13 Cu30 CuDY 111.02(5) . . ?
Cu31 Cu30 CuDY 60.90(5) . . ?
Cu12 Cu30 CuDY 144.87(5) . . ?
Cu29 Cu30 CuDY 117.91(5) . . ?
CuEY Cu30 CuDY 57.00(6) . . ?
Cu43 Cu31 Cu44 63.85(3) . . ?
Cu43 Cu31 CuDX 61.73(5) . 3 ?
Cu44 Cu31 CuDX 63.02(4) . 3 ?
Cu43 Cu31 Cu14 91.34(4) . . ?
Cu44 Cu31 Cu14 58.96(3) . . ?
CuDX Cu31 Cu14 121.97(5) 3 . ?
Cu43 Cu31 Cu13 62.07(3) . . ?
Cu44 Cu31 Cu13 93.98(4) . . ?
CuDX Cu31 Cu13 123.76(5) 3 . ?
Cu14 Cu31 Cu13 61.30(4) . . ?
Cu43 Cu31 Cu30 58.68(3) . . ?
Cu44 Cu31 Cu30 122.54(4) . . ?
CuDX Cu31 Cu30 88.91(5) 3 . ?
Cu14 Cu31 Cu30 121.22(5) . . ?
Cu13 Cu31 Cu30 60.00(4) . . ?
Cu43 Cu31 Cu32 122.20(4) . . ?
Cu44 Cu31 Cu32 58.38(3) . . ?
CuDX Cu31 Cu32 89.70(5) 3 . ?
Cu14 Cu31 Cu32 61.19(4) . . ?
Cu13 Cu31 Cu32 122.41(5) . . ?
Cu30 Cu31 Cu32 177.58(5) . . ?
Cu43 Cu31 CuDY 59.16(4) . . ?
Cu44 Cu31 CuDY 88.79(5) . . ?
Cu14 Cu31 CuDY 144.70(5) . . ?
Cu13 Cu31 CuDY 112.06(5) . . ?
Cu30 Cu31 CuDY 62.15(5) . . ?
Cu32 Cu31 CuDY 116.07(6) . . ?
Cu43 Cu31 CuCY 87.87(5) . . ?
Cu44 Cu31 CuCY 56.43(4) . . ?
Cu14 Cu31 CuCY 107.42(5) . . ?
Cu13 Cu31 CuCY 146.06(5) . . ?
Cu30 Cu31 CuCY 119.06(5) . . ?
Cu32 Cu31 CuCY 59.24(5) . . ?
CuDY Cu31 CuCY 56.94(6) . . ?
C501 Cu32 Cu44 160.6(2) . . ?
C501 Cu32 CuCX 101.2(2) . 3 ?
Cu44 Cu32 CuCX 59.76(5) . 3 ?
C501 Cu32 Cu31 122.7(2) . . ?
Cu44 Cu32 Cu31 58.11(3) . . ?
CuCX Cu32 Cu31 89.54(5) 3 . ?
C501 Cu32 Cu14 141.1(2) . . ?
Cu44 Cu32 Cu14 57.79(3) . . ?
CuCX Cu32 Cu14 117.55(5) 3 . ?
Cu31 Cu32 Cu14 58.15(3) . . ?
C501 Cu32 Cu33 130.7(2) . . ?
Cu44 Cu32 Cu33 57.69(3) . . ?
CuCX Cu32 Cu33 88.61(5) 3 . ?
Cu31 Cu32 Cu33 105.41(4) . . ?
Cu14 Cu32 Cu33 57.91(3) . . ?
C501 Cu32 CuCY 104.2(2) . . ?
Cu44 Cu32 CuCY 57.61(4) . . ?
Cu31 Cu32 CuCY 62.76(5) . . ?
Cu14 Cu32 CuCY 107.81(5) . . ?
Cu33 Cu32 CuCY 107.05(5) . . ?
C501 Cu32 CuBY 108.8(2) . . ?
Cu44 Cu32 CuBY 57.33(4) . . ?
Cu31 Cu32 CuBY 108.18(5) . . ?
Cu14 Cu32 CuBY 106.49(5) . . ?
Cu33 Cu32 CuBY 60.64(5) . . ?
CuCY Cu32 CuBY 58.45(6) . . ?
Cu44 Cu33 Cu45 63.68(3) . . ?
Cu44 Cu33 CuBX 62.47(4) . 3 ?
Cu45 Cu33 CuBX 61.58(4) . 3 ?
Cu44 Cu33 Cu14 59.06(3) . . ?
Cu45 Cu33 Cu14 90.94(4) . . ?
CuBX Cu33 Cu14 121.52(5) 3 . ?
Cu44 Cu33 Cu34 121.93(4) . . ?
Cu45 Cu33 Cu34 58.25(3) . . ?
CuBX Cu33 Cu34 89.14(5) 3 . ?
Cu14 Cu33 Cu34 120.40(5) . . ?
Cu44 Cu33 Cu15 93.30(4) . . ?
Cu45 Cu33 Cu15 61.36(3) . . ?
CuBX Cu33 Cu15 122.92(5) 3 . ?
Cu14 Cu33 Cu15 60.83(3) . . ?
Cu34 Cu33 Cu15 59.64(3) . . ?
Cu44 Cu33 Cu32 58.21(3) . . ?
Cu45 Cu33 Cu32 121.88(4) . . ?
CuBX Cu33 Cu32 89.77(5) 3 . ?
Cu14 Cu33 Cu32 60.96(4) . . ?
Cu34 Cu33 Cu32 178.59(5) . . ?
Cu15 Cu33 Cu32 121.74(4) . . ?
Cu44 Cu33 CuBY 57.67(4) . . ?
Cu45 Cu33 CuBY 87.51(5) . . ?
Cu14 Cu33 CuBY 109.30(5) . . ?
Cu34 Cu33 CuBY 117.61(5) . . ?
Cu15 Cu33 CuBY 145.67(5) . . ?
Cu32 Cu33 CuBY 61.15(5) . . ?
Cu44 Cu33 CuPY 90.31(5) . . ?
Cu45 Cu33 CuPY 59.41(4) . . ?
Cu14 Cu33 CuPY 145.71(5) . . ?
Cu34 Cu33 CuPY 60.67(5) . . ?
Cu15 Cu33 CuPY 110.82(5) . . ?
Cu32 Cu33 CuPY 118.06(6) . . ?
CuBY Cu33 CuPY 57.00(6) . . ?
Cu45 Cu34 Cu46 63.68(3) . . ?
Cu45 Cu34 CuPX 62.18(4) . 3 ?
Cu46 Cu34 CuPX 61.39(5) . 3 ?
Cu45 Cu34 Cu15 62.10(3) . . ?
Cu46 Cu34 Cu15 93.41(4) . . ?
CuPX Cu34 Cu15 124.28(5) 3 . ?
Cu45 Cu34 Cu33 59.47(3) . . ?
Cu46 Cu34 Cu33 123.14(4) . . ?
CuPX Cu34 Cu33 91.24(5) 3 . ?
Cu15 Cu34 Cu33 60.55(3) . . ?
Cu45 Cu34 Cu16 90.66(4) . . ?
Cu46 Cu34 Cu16 58.47(3) . . ?
CuPX Cu34 Cu16 119.86(5) 3 . ?
Cu15 Cu34 Cu16 60.57(3) . . ?
Cu33 Cu34 Cu16 121.05(4) . . ?
Cu45 Cu34 Cu35 121.91(4) . . ?
Cu46 Cu34 Cu35 58.25(3) . . ?
CuPX Cu34 Cu35 88.47(5) 3 . ?
Cu15 Cu34 Cu35 121.07(5) . . ?
Cu33 Cu34 Cu35 178.12(5) . . ?
Cu16 Cu34 Cu35 60.62(3) . . ?
Cu45 Cu34 CuPY 60.37(4) . . ?
Cu46 Cu34 CuPY 90.00(5) . . ?
Cu15 Cu34 CuPY 112.95(5) . . ?
Cu33 Cu34 CuPY 62.33(5) . . ?
Cu16 Cu34 CuPY 145.46(5) . . ?
Cu35 Cu34 CuPY 116.92(5) . . ?
Cu45 Cu34 CuOY 88.08(4) . . ?
Cu46 Cu34 CuOY 56.74(4) . . ?
Cu15 Cu34 CuOY 146.07(5) . . ?
Cu33 Cu34 CuOY 119.55(5) . . ?
Cu16 Cu34 CuOY 107.35(5) . . ?
Cu35 Cu34 CuOY 59.81(5) . . ?
CuPY Cu34 CuOY 57.27(6) . . ?
C601 Cu35 Cu46 160.0(2) . . ?
C601 Cu35 CuOX 108.8(2) . 3 ?
Cu46 Cu35 CuOX 59.40(4) . 3 ?
C601 Cu35 Cu34 108.9(2) . . ?
Cu46 Cu35 Cu34 58.70(3) . . ?
CuOX Cu35 Cu34 91.56(5) 3 . ?
C601 Cu35 Cu16 132.0(2) . . ?
Cu46 Cu35 Cu16 58.18(3) . . ?
CuOX Cu35 Cu16 117.44(5) 3 . ?
Cu34 Cu35 Cu16 59.42(3) . . ?
C601 Cu35 Cu36 141.6(2) . . ?
Cu46 Cu35 Cu36 57.17(3) . . ?
CuOX Cu35 Cu36 85.12(5) 3 . ?
Cu34 Cu35 Cu36 106.20(4) . . ?
Cu16 Cu35 Cu36 58.15(3) . . ?
C601 Cu35 CuOY 103.1(2) . . ?
Cu46 Cu35 CuOY 57.91(4) . . ?
Cu34 Cu35 CuOY 62.73(5) . . ?
Cu16 Cu35 CuOY 108.70(5) . . ?
Cu36 Cu35 CuOY 106.40(5) . . ?
C601 Cu35 CuNY 121.0(2) . . ?
Cu46 Cu35 CuNY 56.85(4) . . ?
Cu34 Cu35 CuNY 107.92(5) . . ?
Cu16 Cu35 CuNY 106.27(5) . . ?
Cu36 Cu35 CuNY 59.74(5) . . ?
CuOY Cu35 CuNY 58.09(6) . . ?
Cu46 Cu36 CuNX 64.77(5) . 3 ?
Cu46 Cu36 Cu47 64.54(3) . . ?
CuNX Cu36 Cu47 61.97(4) 3 . ?
Cu46 Cu36 Cu16 59.43(3) . . ?
CuNX Cu36 Cu16 124.14(6) 3 . ?
Cu47 Cu36 Cu16 91.05(4) . . ?
Cu46 Cu36 Cu17 93.43(4) . . ?
CuNX Cu36 Cu17 122.83(5) 3 . ?
Cu47 Cu36 Cu17 60.96(3) . . ?
Cu16 Cu36 Cu17 60.31(3) . . ?
Cu46 Cu36 Cu37 122.06(4) . . ?
CuNX Cu36 Cu37 87.15(5) 3 . ?
Cu47 Cu36 Cu37 57.52(3) . . ?
Cu16 Cu36 Cu37 119.93(4) . . ?
Cu17 Cu36 Cu37 59.68(3) . . ?
Cu46 Cu36 Cu35 58.26(3) . . ?
CuNX Cu36 Cu35 92.64(5) 3 . ?
Cu47 Cu36 Cu35 122.80(4) . . ?
Cu16 Cu36 Cu35 60.60(3) . . ?
Cu17 Cu36 Cu35 120.85(4) . . ?
Cu37 Cu36 Cu35 179.44(5) . . ?
Cu46 Cu36 CuNY 57.83(5) . . ?
Cu47 Cu36 CuNY 88.82(4) . . ?
Cu16 Cu36 CuNY 109.66(6) . . ?
Cu17 Cu36 CuNY 146.31(5) . . ?
Cu37 Cu36 CuNY 118.14(5) . . ?
Cu35 Cu36 CuNY 61.56(5) . . ?
Cu46 Cu36 CuMY 90.39(5) . . ?
Cu47 Cu36 CuMY 59.14(4) . . ?
Cu16 Cu36 CuMY 145.73(5) . . ?
Cu17 Cu36 CuMY 110.55(5) . . ?
Cu37 Cu36 CuMY 60.37(5) . . ?
Cu35 Cu36 CuMY 119.32(5) . . ?
CuNY Cu36 CuMY 57.80(6) . . ?
Cu47 Cu37 CuMX 64.09(5) . 3 ?
Cu47 Cu37 Cu38 63.62(3) . . ?
CuMX Cu37 Cu38 61.93(4) 3 . ?
Cu47 Cu37 Cu17 61.56(3) . . ?
CuMX Cu37 Cu17 125.65(6) 3 . ?
Cu38 Cu37 Cu17 92.94(4) . . ?
Cu47 Cu37 Cu8 89.77(4) . . ?
CuMX Cu37 Cu8 119.92(5) 3 . ?
Cu38 Cu37 Cu8 58.00(3) . . ?
Cu17 Cu37 Cu8 60.10(3) . . ?
Cu47 Cu37 Cu36 58.89(3) . . ?
CuMX Cu37 Cu36 92.31(5) 3 . ?
Cu38 Cu37 Cu36 122.52(4) . . ?
Cu17 Cu37 Cu36 60.06(3) . . ?
Cu8 Cu37 Cu36 120.06(4) . . ?
Cu47 Cu37 Cu23 121.04(4) . . ?
CuMX Cu37 Cu23 86.67(5) 3 . ?
Cu38 Cu37 Cu23 57.44(3) . . ?
Cu17 Cu37 Cu23 121.04(4) . . ?
Cu8 Cu37 Cu23 61.01(3) . . ?
Cu36 Cu37 Cu23 178.83(5) . . ?
Cu47 Cu37 CuMY 60.00(4) . . ?
Cu38 Cu37 CuMY 90.44(4) . . ?
Cu17 Cu37 CuMY 111.86(5) . . ?
Cu8 Cu37 CuMY 144.82(5) . . ?
Cu36 Cu37 CuMY 61.56(5) . . ?
Cu23 Cu37 CuMY 117.32(5) . . ?
Cu47 Cu37 CuLY 87.97(5) . . ?
Cu38 Cu37 CuLY 57.03(4) . . ?
Cu17 Cu37 CuLY 145.58(5) . . ?
Cu8 Cu37 CuLY 107.68(5) . . ?
Cu36 Cu37 CuLY 119.25(5) . . ?
Cu23 Cu37 CuLY 59.65(5) . . ?
CuMY Cu37 CuLY 57.75(5) . . ?
CuKY Cu38 Cu23 64.94(5) . . ?
CuKY Cu38 Cu8 119.01(5) . . ?
Cu23 Cu38 Cu8 64.94(4) . . ?
CuKY Cu38 Cu24 65.95(5) . . ?
Cu23 Cu38 Cu24 64.55(4) . . ?
Cu8 Cu38 Cu24 62.55(3) . . ?
CuKY Cu38 CuLY 63.84(6) . . ?
Cu23 Cu38 CuLY 64.70(5) . . ?
Cu8 Cu38 CuLY 119.03(5) . . ?
Cu24 Cu38 CuLY 119.28(6) . . ?
Cu23 Cu38 Cu9X 118.38(5) . 3 ?
Cu8 Cu38 Cu9X 176.38(5) . 3 ?
Cu24 Cu38 Cu9X 117.00(5) . 3 ?
CuKY Cu38 Cu37 118.91(5) . . ?
Cu23 Cu38 Cu37 63.95(4) . . ?
Cu8 Cu38 Cu37 62.83(3) . . ?
Cu24 Cu38 Cu37 116.01(4) . . ?
CuLY Cu38 Cu37 65.58(4) . . ?
Cu9X Cu38 Cu37 119.50(5) 3 . ?
CuKY Cu38 Cu49 114.82(5) . . ?
Cu23 Cu38 Cu49 179.24(5) . . ?
Cu8 Cu38 Cu49 115.67(4) . . ?
Cu24 Cu38 Cu49 116.09(4) . . ?
CuLY Cu38 Cu49 114.53(5) . . ?
Cu9X Cu38 Cu49 61.02(4) 3 . ?
Cu37 Cu38 Cu49 115.83(4) . . ?
Cu23 Cu38 CuLX 59.90(5) . 3 ?
Cu8 Cu38 CuLX 124.77(6) . 3 ?
Cu24 Cu38 CuLX 90.83(5) . 3 ?
Cu37 Cu38 CuLX 94.23(5) . 3 ?
Cu49 Cu38 CuLX 119.51(5) . 3 ?
Cu23 Cu38 CuMX 88.55(5) . 3 ?
Cu8 Cu38 CuMX 121.68(5) . 3 ?
Cu24 Cu38 CuMX 148.79(6) . 3 ?
Cu37 Cu38 CuMX 58.86(4) . 3 ?
Cu49 Cu38 CuMX 90.72(5) . 3 ?
CuKY Cu38 Cu47 147.68(5) . . ?
Cu23 Cu38 Cu47 121.14(4) . . ?
Cu8 Cu38 Cu47 88.89(4) . . ?
Cu24 Cu38 Cu47 146.36(4) . . ?
CuLY Cu38 Cu47 89.22(5) . . ?
Cu9X Cu38 Cu47 90.33(5) 3 . ?
Cu37 Cu38 Cu47 57.21(3) . . ?
Cu49 Cu38 Cu47 58.62(3) . . ?
CuLX Cu38 Cu47 121.42(6) 3 . ?
CuMX Cu38 Cu47 60.83(5) 3 . ?
CuKY Cu38 Cu18 148.26(5) . . ?
Cu23 Cu38 Cu18 122.63(4) . . ?
Cu8 Cu38 Cu18 57.69(3) . . ?
Cu24 Cu38 Cu18 88.83(4) . . ?
CuLY Cu38 Cu18 147.72(5) . . ?
Cu9X Cu38 Cu18 118.98(5) 3 . ?
Cu37 Cu38 Cu18 88.76(4) . . ?
Cu49 Cu38 Cu18 57.98(3) . . ?
CuLX Cu38 Cu18 176.82(6) 3 . ?
CuMX Cu38 Cu18 120.35(5) 3 . ?
Cu47 Cu38 Cu18 59.52(3) . . ?
Cu25 Cu39 Cu49 179.18(4) . . ?
Cu25 Cu39 Cu24 63.04(3) . . ?
Cu49 Cu39 Cu24 116.94(4) . . ?
Cu25 Cu39 Cu4X 117.24(5) . 3 ?
Cu49 Cu39 Cu4X 63.55(4) . 3 ?
Cu24 Cu39 Cu4X 117.83(5) . 3 ?
Cu25 Cu39 Cu50 117.18(4) . . ?
Cu49 Cu39 Cu50 62.84(3) . . ?
Cu24 Cu39 Cu50 179.21(4) . . ?
Cu4X Cu39 Cu50 62.82(4) 3 . ?
Cu25 Cu39 CuJY 64.47(5) . . ?
Cu49 Cu39 CuJY 116.31(5) . . ?
Cu24 Cu39 CuJY 63.84(5) . . ?
Cu50 Cu39 CuJY 116.95(5) . . ?
Cu25 Cu39 Cu9 60.86(3) . . ?
Cu49 Cu39 Cu9 118.36(4) . . ?
Cu24 Cu39 Cu9 61.24(3) . . ?
Cu4X Cu39 Cu9 178.05(6) 3 . ?
Cu50 Cu39 Cu9 118.12(4) . . ?
CuJY Cu39 Cu9 114.64(5) . . ?
Cu25 Cu39 Cu18 120.43(4) . . ?
Cu49 Cu39 Cu18 58.78(3) . . ?
Cu24 Cu39 Cu18 89.22(4) . . ?
Cu4X Cu39 Cu18 122.33(5) 3 . ?
Cu50 Cu39 Cu18 90.04(3) . . ?
CuJY Cu39 Cu18 147.78(5) . . ?
Cu9 Cu39 Cu18 59.59(3) . . ?
Cu25 Cu39 Cu6Y 92.54(5) . . ?
Cu49 Cu39 Cu6Y 88.14(4) . . ?
Cu24 Cu39 Cu6Y 123.65(5) . . ?
Cu50 Cu39 Cu6Y 57.14(4) . . ?
CuJY Cu39 Cu6Y 59.81(5) . . ?
Cu9 Cu39 Cu6Y 148.71(5) . . ?
Cu18 Cu39 Cu6Y 142.65(5) . . ?
Cu25 Cu39 Cu19 89.27(4) . . ?
Cu49 Cu39 Cu19 90.08(4) . . ?
Cu24 Cu39 Cu19 120.99(4) . . ?
Cu4X Cu39 Cu19 121.18(5) 3 . ?
Cu50 Cu39 Cu19 58.36(3) . . ?
CuJY Cu39 Cu19 148.51(5) . . ?
Cu9 Cu39 Cu19 59.76(3) . . ?
Cu18 Cu39 Cu19 60.14(3) . . ?
Cu6Y Cu39 Cu19 107.41(5) . . ?
Cu25 Cu39 CuKX 88.97(5) . 3 ?
Cu49 Cu39 CuKX 91.69(5) . 3 ?
Cu24 Cu39 CuKX 58.59(5) . 3 ?
Cu50 Cu39 CuKX 122.07(5) . 3 ?
Cu9 Cu39 CuKX 119.74(5) . 3 ?
Cu18 Cu39 CuKX 121.37(5) . 3 ?
Cu19 Cu39 CuKX 178.14(6) . 3 ?
Cu25 Cu39 Cu38 120.94(4) . . ?
Cu49 Cu39 Cu38 59.03(3) . . ?
Cu24 Cu39 Cu38 57.91(3) . . ?
Cu4X Cu39 Cu38 90.86(5) 3 . ?
Cu50 Cu39 Cu38 121.87(4) . . ?
CuJY Cu39 Cu38 89.21(5) . . ?
Cu9 Cu39 Cu38 89.95(3) . . ?
Cu18 Cu39 Cu38 60.31(3) . . ?
Cu6Y Cu39 Cu38 119.47(5) . . ?
Cu19 Cu39 Cu38 120.45(4) . . ?
CuKX Cu39 Cu38 61.07(5) 3 . ?
Cu26 Cu40 CuHY 65.79(5) . . ?
Cu26 Cu40 CuIY 65.70(5) . . ?
CuHY Cu40 CuIY 64.57(6) . . ?
Cu26 Cu40 Cu10 64.04(4) . . ?
CuHY Cu40 Cu10 119.09(5) . . ?
CuIY Cu40 Cu10 118.88(6) . . ?
Cu26 Cu40 Cu25 64.14(4) . . ?
CuHY Cu40 Cu25 119.74(6) . . ?
CuIY Cu40 Cu25 65.73(5) . . ?
Cu10 Cu40 Cu25 62.47(4) . . ?
Cu26 Cu40 Cu8X 118.04(5) . 3 ?
Cu10 Cu40 Cu8X 177.91(6) . 3 ?
Cu25 Cu40 Cu8X 118.05(5) . 3 ?
Cu26 Cu40 Cu27 64.06(4) . . ?
CuHY Cu40 Cu27 65.69(5) . . ?
CuIY Cu40 Cu27 119.57(5) . . ?
Cu10 Cu40 Cu27 62.71(3) . . ?
Cu25 Cu40 Cu27 116.05(4) . . ?
Cu8X Cu40 Cu27 117.96(5) 3 . ?
Cu26 Cu40 Cu50 179.66(5) . . ?
CuHY Cu40 Cu50 114.18(5) . . ?
CuIY Cu40 Cu50 113.97(5) . . ?
Cu10 Cu40 Cu50 116.18(4) . . ?
Cu25 Cu40 Cu50 115.69(4) . . ?
Cu8X Cu40 Cu50 61.73(4) 3 . ?
Cu27 Cu40 Cu50 116.26(4) . . ?
Cu26 Cu40 CuIX 60.05(5) . 3 ?
Cu10 Cu40 CuIX 124.08(5) . 3 ?
Cu25 Cu40 CuIX 93.13(6) . 3 ?
Cu27 Cu40 CuIX 91.59(5) . 3 ?
Cu50 Cu40 CuIX 119.73(5) . 3 ?
Cu26 Cu40 Cu41 121.62(4) . . ?
CuHY Cu40 Cu41 88.92(5) . . ?
CuIY Cu40 Cu41 147.70(6) . . ?
Cu10 Cu40 Cu41 89.43(4) . . ?
Cu25 Cu40 Cu41 146.52(4) . . ?
Cu8X Cu40 Cu41 89.40(5) 3 . ?
Cu27 Cu40 Cu41 57.57(3) . . ?
Cu50 Cu40 Cu41 58.70(3) . . ?
CuIX Cu40 Cu41 118.80(6) 3 . ?
Cu26 Cu40 Cu19 122.05(4) . . ?
CuHY Cu40 Cu19 147.98(6) . . ?
CuIY Cu40 Cu19 147.21(5) . . ?
Cu10 Cu40 Cu19 58.01(3) . . ?
Cu25 Cu40 Cu19 88.36(4) . . ?
Cu8X Cu40 Cu19 119.90(5) 3 . ?
Cu27 Cu40 Cu19 89.13(4) . . ?
Cu50 Cu40 Cu19 58.17(3) . . ?
CuIX Cu40 Cu19 177.86(6) 3 . ?
Cu41 Cu40 Cu19 60.02(3) . . ?
Cu26 Cu40 CuJX 88.74(5) . 3 ?
Cu10 Cu40 CuJX 120.87(6) . 3 ?
Cu25 Cu40 CuJX 58.42(5) . 3 ?
Cu27 Cu40 CuJX 148.58(5) . 3 ?
Cu50 Cu40 CuJX 90.92(5) . 3 ?
Cu41 Cu40 CuJX 145.51(5) . 3 ?
Cu19 Cu40 CuJX 120.02(5) . 3 ?
Cu27 Cu41 Cu28 63.11(4) . . ?
Cu27 Cu41 Cu51 178.83(5) . . ?
Cu28 Cu41 Cu51 116.93(4) . . ?
Cu27 Cu41 Cu3X 117.46(5) . 3 ?
Cu28 Cu41 Cu3X 118.08(5) . 3 ?
Cu51 Cu41 Cu3X 63.62(4) . 3 ?
Cu27 Cu41 Cu50 117.86(4) . . ?
Cu28 Cu41 Cu50 178.57(5) . . ?
Cu51 Cu41 Cu50 62.07(3) . . ?
Cu3X Cu41 Cu50 62.61(4) 3 . ?
Cu27 Cu41 CuGY 64.74(5) . . ?
Cu28 Cu41 CuGY 64.70(4) . . ?
Cu51 Cu41 CuGY 116.39(5) . . ?
Cu50 Cu41 CuGY 116.57(5) . . ?
Cu27 Cu41 Cu11 61.31(3) . . ?
Cu28 Cu41 Cu11 61.48(3) . . ?
Cu51 Cu41 Cu11 117.61(4) . . ?
Cu3X Cu41 Cu11 178.77(6) 3 . ?
Cu50 Cu41 Cu11 117.86(4) . . ?
CuGY Cu41 Cu11 115.74(5) . . ?
Cu27 Cu41 CuGX 89.29(5) . 3 ?
Cu28 Cu41 CuGX 58.98(4) . 3 ?
Cu51 Cu41 CuGX 91.70(5) . 3 ?
Cu50 Cu41 CuGX 121.73(5) . 3 ?
Cu11 Cu41 CuGX 120.39(5) . 3 ?
Cu27 Cu41 Cu40 59.09(3) . . ?
Cu28 Cu41 Cu40 122.20(4) . . ?
Cu51 Cu41 Cu40 120.85(4) . . ?
Cu3X Cu41 Cu40 89.29(5) 3 . ?
Cu50 Cu41 Cu40 58.78(3) . . ?
CuGY Cu41 Cu40 90.52(5) . . ?
Cu11 Cu41 Cu40 90.05(4) . . ?
CuGX Cu41 Cu40 119.13(5) 3 . ?
Cu27 Cu41 Cu19 90.00(4) . . ?
Cu28 Cu41 Cu19 121.12(4) . . ?
Cu51 Cu41 Cu19 89.01(3) . . ?
Cu3X Cu41 Cu19 120.80(5) 3 . ?
Cu50 Cu41 Cu19 58.19(3) . . ?
CuGY Cu41 Cu19 149.05(6) . . ?
Cu11 Cu41 Cu19 59.67(3) . . ?
CuGX Cu41 Cu19 179.10(6) 3 . ?
Cu40 Cu41 Cu19 60.01(3) . . ?
Cu27 Cu41 Cu20 120.75(4) . . ?
Cu28 Cu41 Cu20 89.16(4) . . ?
Cu51 Cu41 Cu20 58.17(3) . . ?
Cu3X Cu41 Cu20 121.79(5) 3 . ?
Cu50 Cu41 Cu20 89.43(3) . . ?
CuGY Cu41 Cu20 148.23(6) . . ?
Cu11 Cu41 Cu20 59.45(3) . . ?
CuGX Cu41 Cu20 121.11(5) 3 . ?
Cu40 Cu41 Cu20 119.76(4) . . ?
Cu19 Cu41 Cu20 59.76(3) . . ?
Cu27 Cu41 Cu5Y 93.02(5) . . ?
Cu28 Cu41 Cu5Y 124.18(5) . . ?
Cu51 Cu41 Cu5Y 87.88(4) . . ?
Cu50 Cu41 Cu5Y 57.09(4) . . ?
CuGY Cu41 Cu5Y 59.49(5) . . ?
Cu11 Cu41 Cu5Y 149.28(6) . . ?
Cu40 Cu41 Cu5Y 60.80(4) . . ?
Cu19 Cu41 Cu5Y 107.40(5) . . ?
Cu20 Cu41 Cu5Y 141.92(5) . . ?
CuFY Cu42 CuEY 64.67(7) . . ?
CuFY Cu42 Cu28 66.73(5) . . ?
CuEY Cu42 Cu28 120.51(5) . . ?
CuFY Cu42 Cu12 119.52(5) . . ?
CuEY Cu42 Cu12 119.18(5) . . ?
Cu28 Cu42 Cu12 62.08(3) . . ?
CuFY Cu42 Cu30 119.77(6) . . ?
CuEY Cu42 Cu30 65.83(5) . . ?
Cu28 Cu42 Cu30 115.43(4) . . ?
Cu12 Cu42 Cu30 62.29(4) . . ?
CuFY Cu42 Cu29 66.66(5) . . ?
CuEY Cu42 Cu29 65.78(5) . . ?
Cu28 Cu42 Cu29 64.86(4) . . ?
Cu12 Cu42 Cu29 63.96(3) . . ?
Cu30 Cu42 Cu29 63.15(3) . . ?
Cu28 Cu42 Cu7X 117.77(5) . 3 ?
Cu12 Cu42 Cu7X 177.04(6) . 3 ?
Cu30 Cu42 Cu7X 119.44(6) . 3 ?
Cu29 Cu42 Cu7X 118.84(5) . 3 ?
Cu28 Cu42 CuFX 91.40(5) . 3 ?
Cu12 Cu42 CuFX 124.14(5) . 3 ?
Cu30 Cu42 CuFX 93.99(6) . 3 ?
Cu29 Cu42 CuFX 60.25(4) . 3 ?
CuFY Cu42 Cu51 114.40(5) . . ?
CuEY Cu42 Cu51 113.83(5) . . ?
Cu28 Cu42 Cu51 116.15(4) . . ?
Cu12 Cu42 Cu51 115.62(4) . . ?
Cu30 Cu42 Cu51 115.55(4) . . ?
Cu29 Cu42 Cu51 178.70(5) . . ?
Cu7X Cu42 Cu51 61.60(4) 3 . ?
CuFX Cu42 Cu51 120.22(5) 3 . ?
Cu28 Cu42 CuEX 149.49(5) . 3 ?
Cu12 Cu42 CuEX 121.84(5) . 3 ?
Cu30 Cu42 CuEX 59.56(4) . 3 ?
Cu29 Cu42 CuEX 89.02(5) . 3 ?
Cu51 Cu42 CuEX 90.23(4) . 3 ?
CuFY Cu42 Cu4Y 57.89(5) . . ?
CuEY Cu42 Cu4Y 89.01(6) . . ?
Cu28 Cu42 Cu4Y 92.84(5) . . ?
Cu12 Cu42 Cu4Y 148.67(6) . . ?
Cu30 Cu42 Cu4Y 148.75(6) . . ?
Cu29 Cu42 Cu4Y 124.54(5) . . ?
Cu51 Cu42 Cu4Y 56.51(4) . . ?
CuFY Cu42 Cu43 146.89(6) . . ?
CuEY Cu42 Cu43 88.22(5) . . ?
Cu28 Cu42 Cu43 146.33(4) . . ?
Cu12 Cu42 Cu43 89.58(4) . . ?
Cu30 Cu42 Cu43 57.68(3) . . ?
Cu29 Cu42 Cu43 120.81(4) . . ?
Cu7X Cu42 Cu43 89.57(4) 3 . ?
CuFX Cu42 Cu43 120.89(6) 3 . ?
Cu51 Cu42 Cu43 57.89(3) . . ?
CuEX Cu42 Cu43 60.31(4) 3 . ?
Cu4Y Cu42 Cu43 105.78(4) . . ?
Cu30 Cu43 Cu31 62.47(3) . . ?
Cu30 Cu43 Cu51 117.72(4) . . ?
Cu31 Cu43 Cu51 178.26(5) . . ?
Cu30 Cu43 Cu52 178.55(5) . . ?
Cu31 Cu43 Cu52 117.41(4) . . ?
Cu51 Cu43 Cu52 62.35(3) . . ?
Cu30 Cu43 Cu2X 118.29(5) . 3 ?
Cu31 Cu43 Cu2X 119.40(5) . 3 ?
Cu51 Cu43 Cu2X 62.18(4) . 3 ?
Cu52 Cu43 Cu2X 63.10(4) . 3 ?
Cu30 Cu43 CuDY 65.22(5) . . ?
Cu31 Cu43 CuDY 64.30(5) . . ?
Cu51 Cu43 CuDY 117.42(5) . . ?
Cu52 Cu43 CuDY 116.12(5) . . ?
Cu30 Cu43 CuDX 90.05(5) . 3 ?
Cu31 Cu43 CuDX 60.00(4) . 3 ?
Cu51 Cu43 CuDX 121.58(5) . 3 ?
Cu52 Cu43 CuDX 91.08(5) . 3 ?
Cu30 Cu43 Cu20 89.45(4) . . ?
Cu31 Cu43 Cu20 120.07(4) . . ?
Cu51 Cu43 Cu20 58.35(3) . . ?
Cu52 Cu43 Cu20 89.43(3) . . ?
Cu2X Cu43 Cu20 120.53(5) 3 . ?
CuDY Cu43 Cu20 149.57(5) . . ?
CuDX Cu43 Cu20 179.35(5) 3 . ?
Cu30 Cu43 Cu13 60.70(3) . . ?
Cu31 Cu43 Cu13 60.64(3) . . ?
Cu51 Cu43 Cu13 117.79(4) . . ?
Cu52 Cu43 Cu13 117.90(4) . . ?
Cu2X Cu43 Cu13 178.94(5) 3 . ?
CuDY Cu43 Cu13 115.14(5) . . ?
CuDX Cu43 Cu13 120.61(5) 3 . ?
Cu20 Cu43 Cu13 59.44(3) . . ?
Cu30 Cu43 Cu21 120.20(4) . . ?
Cu31 Cu43 Cu21 89.01(4) . . ?
Cu51 Cu43 Cu21 89.46(3) . . ?
Cu52 Cu43 Cu21 58.40(3) . . ?
Cu2X Cu43 Cu21 121.49(5) 3 . ?
CuDY Cu43 Cu21 147.43(5) . . ?
CuDX Cu43 Cu21 121.01(5) 3 . ?
Cu20 Cu43 Cu21 59.62(3) . . ?
Cu13 Cu43 Cu21 59.50(3) . . ?
Cu30 Cu43 Cu3Y 92.90(4) . . ?
Cu31 Cu43 Cu3Y 123.75(5) . . ?
Cu51 Cu43 Cu3Y 57.97(4) . . ?
Cu52 Cu43 Cu3Y 88.32(4) . . ?
CuDY Cu43 Cu3Y 59.45(5) . . ?
Cu20 Cu43 Cu3Y 108.31(5) . . ?
Cu13 Cu43 Cu3Y 149.07(5) . . ?
Cu21 Cu43 Cu3Y 142.74(5) . . ?
Cu30 Cu43 CuEX 59.30(4) . 3 ?
Cu31 Cu43 CuEX 91.27(5) . 3 ?
Cu51 Cu43 CuEX 90.25(5) . 3 ?
Cu52 Cu43 CuEX 122.10(5) . 3 ?
Cu20 Cu43 CuEX 119.60(5) . 3 ?
Cu13 Cu43 CuEX 120.00(5) . 3 ?
Cu21 Cu43 CuEX 179.18(6) . 3 ?
Cu33 Cu44 Cu14 61.95(3) . . ?
Cu33 Cu44 CuCY 118.09(5) . . ?
Cu14 Cu44 CuCY 118.80(5) . . ?
Cu33 Cu44 Cu31 114.85(4) . . ?
Cu14 Cu44 Cu31 61.88(3) . . ?
CuCY Cu44 Cu31 67.10(5) . . ?
Cu33 Cu44 Cu32 64.10(3) . . ?
Cu14 Cu44 Cu32 63.96(4) . . ?
CuCY Cu44 Cu32 64.47(5) . . ?
Cu31 Cu44 Cu32 63.51(3) . . ?
Cu33 Cu44 CuCX 92.78(5) . 3 ?
Cu14 Cu44 CuCX 124.54(5) . 3 ?
Cu31 Cu44 CuCX 93.16(5) . 3 ?
Cu32 Cu44 CuCX 60.59(4) . 3 ?
Cu33 Cu44 Cu6X 119.68(5) . 3 ?
Cu14 Cu44 Cu6X 176.55(6) . 3 ?
Cu31 Cu44 Cu6X 118.39(5) . 3 ?
Cu32 Cu44 Cu6X 119.41(5) . 3 ?
Cu33 Cu44 CuBY 65.71(5) . . ?
Cu14 Cu44 CuBY 118.59(5) . . ?
CuCY Cu44 CuBY 63.42(6) . . ?
Cu31 Cu44 CuBY 120.00(6) . . ?
Cu32 Cu44 CuBY 65.87(5) . . ?
Cu33 Cu44 Cu52 116.38(4) . . ?
Cu14 Cu44 Cu52 115.95(4) . . ?
CuCY Cu44 Cu52 115.30(5) . . ?
Cu31 Cu44 Cu52 115.94(4) . . ?
Cu32 Cu44 Cu52 179.44(5) . . ?
CuCX Cu44 Cu52 119.51(5) 3 . ?
Cu6X Cu44 Cu52 60.68(4) 3 . ?
CuBY Cu44 Cu52 114.54(5) . . ?
Cu33 Cu44 CuBX 59.51(4) . 3 ?
Cu14 Cu44 CuBX 121.45(5) . 3 ?
Cu31 Cu44 CuBX 151.25(5) . 3 ?
Cu32 Cu44 CuBX 91.42(5) . 3 ?
Cu52 Cu44 CuBX 89.09(4) . 3 ?
Cu33 Cu44 Cu2Y 148.91(5) . . ?
Cu14 Cu44 Cu2Y 149.09(5) . . ?
CuCY Cu44 Cu2Y 57.59(5) . . ?
Cu31 Cu44 Cu2Y 92.45(5) . . ?
Cu32 Cu44 Cu2Y 122.05(5) . . ?
CuBY Cu44 Cu2Y 88.35(6) . . ?
Cu52 Cu44 Cu2Y 57.71(4) . . ?
Cu33 Cu44 CuDX 150.86(5) . 3 ?
Cu14 Cu44 CuDX 121.03(5) . 3 ?
Cu31 Cu44 CuDX 59.16(4) . 3 ?
Cu32 Cu44 CuDX 90.39(5) . 3 ?
Cu52 Cu44 CuDX 89.21(4) . 3 ?
Cu34 Cu45 Cu33 62.28(3) . . ?
Cu34 Cu45 Cu52 178.50(4) . . ?
Cu33 Cu45 Cu52 117.05(4) . . ?
Cu34 Cu45 Cu1X 119.33(5) . 3 ?
Cu33 Cu45 Cu1X 119.11(5) . 3 ?
Cu52 Cu45 Cu1X 62.16(4) . 3 ?
Cu34 Cu45 Cu53 117.83(4) . . ?
Cu33 Cu45 Cu53 178.71(5) . . ?
Cu52 Cu45 Cu53 62.80(3) . . ?
Cu1X Cu45 Cu53 62.06(4) 3 . ?
Cu34 Cu45 CuBX 90.28(5) . 3 ?
Cu33 Cu45 CuBX 59.60(4) . 3 ?
Cu52 Cu45 CuBX 90.44(5) . 3 ?
Cu53 Cu45 CuBX 121.58(5) . 3 ?
Cu34 Cu45 CuPX 59.95(4) . 3 ?
Cu33 Cu45 CuPX 91.56(5) . 3 ?
Cu52 Cu45 CuPX 121.55(5) . 3 ?
Cu53 Cu45 CuPX 89.55(4) . 3 ?
Cu34 Cu45 CuPY 63.69(5) . . ?
Cu33 Cu45 CuPY 64.40(5) . . ?
Cu52 Cu45 CuPY 117.41(5) . . ?
Cu53 Cu45 CuPY 116.86(5) . . ?
Cu34 Cu45 Cu15 60.77(3) . . ?
Cu33 Cu45 Cu15 61.00(3) . . ?
Cu52 Cu45 Cu15 117.73(4) . . ?
Cu1X Cu45 Cu15 179.87(6) 3 . ?
Cu53 Cu45 Cu15 117.83(4) . . ?
CuBX Cu45 Cu15 120.58(5) 3 . ?
CuPX Cu45 Cu15 120.72(5) 3 . ?
CuPY Cu45 Cu15 114.60(5) . . ?
Cu34 Cu45 Cu22 89.65(4) . . ?
Cu33 Cu45 Cu22 120.54(4) . . ?
Cu52 Cu45 Cu22 89.62(3) . . ?
Cu1X Cu45 Cu22 120.34(5) 3 . ?
Cu53 Cu45 Cu22 58.28(3) . . ?
CuBX Cu45 Cu22 179.78(6) 3 . ?
CuPX Cu45 Cu22 119.48(5) 3 . ?
CuPY Cu45 Cu22 147.81(5) . . ?
Cu15 Cu45 Cu22 59.56(3) . . ?
Cu34 Cu45 Cu21 120.11(4) . . ?
Cu33 Cu45 Cu21 88.94(4) . . ?
Cu52 Cu45 Cu21 58.39(3) . . ?
Cu1X Cu45 Cu21 120.55(4) 3 . ?
Cu53 Cu45 Cu21 89.94(3) . . ?
CuBX Cu45 Cu21 120.19(5) 3 . ?
CuPX Cu45 Cu21 179.43(6) 3 . ?
CuPY Cu45 Cu21 148.40(5) . . ?
Cu15 Cu45 Cu21 59.34(3) . . ?
Cu22 Cu45 Cu21 60.01(3) . . ?
Cu34 Cu45 Cu1Y 122.52(5) . . ?
Cu33 Cu45 Cu1Y 91.50(5) . . ?
Cu52 Cu45 Cu1Y 58.58(4) . . ?
Cu53 Cu45 Cu1Y 89.46(4) . . ?
CuPY Cu45 Cu1Y 58.83(5) . . ?
Cu15 Cu45 Cu1Y 148.28(5) . . ?
Cu22 Cu45 Cu1Y 143.72(5) . . ?
Cu21 Cu45 Cu1Y 108.39(5) . . ?
Cu36 Cu46 CuNY 65.38(5) . . ?
Cu36 Cu46 CuOX 90.09(5) . 3 ?
Cu36 Cu46 Cu35 64.56(3) . . ?
CuNY Cu46 Cu35 66.26(4) . . ?
CuOX Cu46 Cu35 61.17(4) 3 . ?
Cu36 Cu46 Cu16 62.32(3) . . ?
CuNY Cu46 Cu16 118.50(5) . . ?
CuOX Cu46 Cu16 124.67(5) 3 . ?
Cu35 Cu46 Cu16 63.67(3) . . ?
Cu36 Cu46 Cu34 115.72(4) . . ?
CuNY Cu46 Cu34 119.51(5) . . ?
CuOX Cu46 Cu34 95.23(5) 3 . ?
Cu35 Cu46 Cu34 63.06(3) . . ?
Cu16 Cu46 Cu34 62.65(3) . . ?
Cu36 Cu46 CuOY 118.13(5) . . ?
CuNY Cu46 CuOY 63.29(6) . . ?
Cu35 Cu46 CuOY 64.78(5) . . ?
Cu16 Cu46 CuOY 119.18(5) . . ?
Cu34 Cu46 CuOY 66.67(5) . . ?
Cu36 Cu46 CuAX 117.74(5) . 3 ?
Cu35 Cu46 CuAX 120.39(5) . 3 ?
Cu16 Cu46 CuAX 175.80(5) . 3 ?
Cu34 Cu46 CuAX 119.56(6) . 3 ?
Cu36 Cu46 Cu53 116.03(4) . . ?
CuNY Cu46 Cu53 114.74(5) . . ?
CuOX Cu46 Cu53 119.50(5) 3 . ?
Cu35 Cu46 Cu53 178.95(5) . . ?
Cu16 Cu46 Cu53 115.72(4) . . ?
Cu34 Cu46 Cu53 115.94(4) . . ?
CuOY Cu46 Cu53 115.25(5) . . ?
CuAX Cu46 Cu53 60.24(4) 3 . ?
Cu36 Cu46 CuPX 150.05(5) . 3 ?
Cu35 Cu46 CuPX 90.23(5) . 3 ?
Cu16 Cu46 CuPX 122.38(5) . 3 ?
Cu34 Cu46 CuPX 59.73(4) . 3 ?
Cu53 Cu46 CuPX 89.45(4) . 3 ?
Cu36 Cu46 Cu45 146.73(4) . . ?
CuNY Cu46 Cu45 147.86(6) . . ?
CuOX Cu46 Cu45 121.95(6) 3 . ?
Cu35 Cu46 Cu45 120.60(4) . . ?
Cu16 Cu46 Cu45 89.56(3) . . ?
Cu34 Cu46 Cu45 57.56(3) . . ?
CuOY Cu46 Cu45 90.25(5) . . ?
CuAX Cu46 Cu45 88.97(5) 3 . ?
Cu53 Cu46 Cu45 58.40(3) . . ?
CuPX Cu46 Cu45 59.60(4) 3 . ?
Cu36 Cu46 CuAY 149.10(5) . . ?
CuNY Cu46 CuAY 88.81(6) . . ?
Cu35 Cu46 CuAY 121.83(5) . . ?
Cu16 Cu46 CuAY 148.54(5) . . ?
Cu34 Cu46 CuAY 91.20(5) . . ?
CuOY Cu46 CuAY 57.09(5) . . ?
Cu53 Cu46 CuAY 58.17(4) . . ?
Cu45 Cu46 CuAY 60.37(4) . . ?
Cu37 Cu47 Cu36 63.59(3) . . ?
Cu37 Cu47 Cu53 179.55(4) . . ?
Cu36 Cu47 Cu53 116.14(4) . . ?
Cu37 Cu47 Cu5X 117.65(5) . 3 ?
Cu36 Cu47 Cu5X 118.56(5) . 3 ?
Cu53 Cu47 Cu5X 62.78(4) . 3 ?
Cu37 Cu47 Cu49 118.18(4) . . ?
Cu36 Cu47 Cu49 178.06(5) . . ?
Cu53 Cu47 Cu49 62.09(3) . . ?
Cu5X Cu47 Cu49 61.64(4) 3 . ?
Cu37 Cu47 CuNX 88.84(5) . 3 ?
Cu36 Cu47 CuNX 59.00(4) . 3 ?
Cu53 Cu47 CuNX 91.30(5) . 3 ?
Cu49 Cu47 CuNX 121.26(5) . 3 ?
Cu37 Cu47 CuMY 64.15(5) . . ?
Cu36 Cu47 CuMY 64.48(4) . . ?
Cu53 Cu47 CuMY 116.12(5) . . ?
Cu49 Cu47 CuMY 116.80(5) . . ?
Cu37 Cu47 Cu17 61.81(3) . . ?
Cu36 Cu47 Cu17 61.61(3) . . ?
Cu53 Cu47 Cu17 117.75(4) . . ?
Cu5X Cu47 Cu17 179.37(6) 3 . ?
Cu49 Cu47 Cu17 118.21(4) . . ?
CuNX Cu47 Cu17 120.52(5) 3 . ?
CuMY Cu47 Cu17 115.45(5) . . ?
Cu37 Cu47 Cu18 90.51(4) . . ?
Cu36 Cu47 Cu18 121.32(4) . . ?
Cu53 Cu47 Cu18 89.35(3) . . ?
Cu5X Cu47 Cu18 120.10(5) 3 . ?
Cu49 Cu47 Cu18 58.46(3) . . ?
CuNX Cu47 Cu18 179.01(6) 3 . ?
CuMY Cu47 Cu18 149.24(6) . . ?
Cu17 Cu47 Cu18 59.75(3) . . ?
Cu37 Cu47 Cu38 59.16(3) . . ?
Cu36 Cu47 Cu38 122.75(4) . . ?
Cu53 Cu47 Cu38 121.11(4) . . ?
Cu5X Cu47 Cu38 88.82(5) 3 . ?
Cu49 Cu47 Cu38 59.02(3) . . ?
CuNX Cu47 Cu38 118.47(5) 3 . ?
CuMY Cu47 Cu38 90.31(5) . . ?
Cu17 Cu47 Cu38 90.59(4) . . ?
Cu18 Cu47 Cu38 60.54(3) . . ?
Cu37 Cu47 Cu22 121.28(4) . . ?
Cu36 Cu47 Cu22 88.80(3) . . ?
Cu53 Cu47 Cu22 58.28(3) . . ?
Cu5X Cu47 Cu22 121.06(5) 3 . ?
Cu49 Cu47 Cu22 89.52(3) . . ?
CuNX Cu47 Cu22 121.14(5) 3 . ?
CuMY Cu47 Cu22 147.80(5) . . ?
Cu17 Cu47 Cu22 59.47(3) . . ?
Cu18 Cu47 Cu22 59.85(3) . . ?
Cu38 Cu47 Cu22 120.40(4) . . ?
Cu37 Cu47 CuMX 58.75(4) . 3 ?
Cu36 Cu47 CuMX 91.93(5) . 3 ?
Cu53 Cu47 CuMX 121.68(5) . 3 ?
Cu49 Cu47 CuMX 89.75(4) . 3 ?
Cu17 Cu47 CuMX 120.56(5) . 3 ?
Cu18 Cu47 CuMX 119.36(5) . 3 ?
Cu38 Cu47 CuMX 58.82(4) . 3 ?
Cu22 Cu47 CuMX 179.15(5) . 3 ?
Cu54 Cu48 Cu19 117.62(4) . . ?
Cu54 Cu48 Cu18 117.77(4) . . ?
Cu19 Cu48 Cu18 63.07(3) . . ?
Cu54 Cu48 Cu22 117.83(4) . . ?
Cu19 Cu48 Cu22 114.99(4) . . ?
Cu18 Cu48 Cu22 62.83(3) . . ?
Cu54 Cu48 Cu21 117.82(4) . . ?
Cu19 Cu48 Cu21 114.27(4) . . ?
Cu18 Cu48 Cu21 114.75(4) . . ?
Cu22 Cu48 Cu21 62.79(3) . . ?
Cu54 Cu48 Cu20 117.62(4) . . ?
Cu19 Cu48 Cu20 62.74(3) . . ?
Cu18 Cu48 Cu20 114.91(4) . . ?
Cu22 Cu48 Cu20 114.38(4) . . ?
Cu21 Cu48 Cu20 62.07(3) . . ?
Cu54 Cu48 Cu7 179.74(5) . . ?
Cu19 Cu48 Cu7 62.27(3) . . ?
Cu18 Cu48 Cu7 62.42(3) . . ?
Cu22 Cu48 Cu7 62.40(3) . . ?
Cu21 Cu48 Cu7 62.12(3) . . ?
Cu20 Cu48 Cu7 62.11(3) . . ?
Cu54 Cu48 Cu52 59.00(3) . . ?
Cu19 Cu48 Cu52 148.12(4) . . ?
Cu18 Cu48 Cu52 148.69(4) . . ?
Cu22 Cu48 Cu52 90.28(3) . . ?
Cu21 Cu48 Cu52 58.82(3) . . ?
Cu20 Cu48 Cu52 89.89(3) . . ?
Cu7 Cu48 Cu52 120.94(4) . . ?
Cu54 Cu48 Cu53 59.05(3) . . ?
Cu19 Cu48 Cu53 148.55(4) . . ?
Cu18 Cu48 Cu53 89.99(3) . . ?
Cu22 Cu48 Cu53 58.78(3) . . ?
Cu21 Cu48 Cu53 90.91(3) . . ?
Cu20 Cu48 Cu53 148.60(4) . . ?
Cu7 Cu48 Cu53 121.18(4) . . ?
Cu52 Cu48 Cu53 60.95(3) . . ?
Cu54 Cu48 Cu50 58.67(3) . . ?
Cu19 Cu48 Cu50 58.95(3) . . ?
Cu18 Cu48 Cu50 90.87(3) . . ?
Cu22 Cu48 Cu50 149.25(4) . . ?
Cu21 Cu48 Cu50 147.87(4) . . ?
Cu20 Cu48 Cu50 90.31(3) . . ?
Cu7 Cu48 Cu50 121.21(4) . . ?
Cu52 Cu48 Cu50 108.66(3) . . ?
Cu53 Cu48 Cu50 109.03(3) . . ?
Cu54 Cu48 Cu51 59.17(3) . . ?
Cu19 Cu48 Cu51 89.94(3) . . ?
Cu18 Cu48 Cu51 148.71(4) . . ?
Cu22 Cu48 Cu51 148.32(4) . . ?
Cu21 Cu48 Cu51 89.89(3) . . ?
Cu20 Cu48 Cu51 58.46(3) . . ?
Cu7 Cu48 Cu51 120.57(4) . . ?
Cu52 Cu48 Cu51 60.38(3) . . ?
Cu53 Cu48 Cu51 109.54(4) . . ?
Cu50 Cu48 Cu51 60.15(3) . . ?
Cu54 Cu48 Cu49 58.81(3) . . ?
Cu19 Cu48 Cu49 90.60(3) . . ?
Cu18 Cu48 Cu49 58.97(3) . . ?
Cu22 Cu48 Cu49 90.64(3) . . ?
Cu21 Cu48 Cu49 149.00(4) . . ?
Cu20 Cu48 Cu49 148.85(4) . . ?
Cu7 Cu48 Cu49 121.39(4) . . ?
Cu52 Cu48 Cu49 109.13(3) . . ?
Cu53 Cu48 Cu49 60.16(3) . . ?
Cu50 Cu48 Cu49 60.70(3) . . ?
Cu51 Cu48 Cu49 109.23(3) . . ?
Cu7Y Cu49 Cu54 116.84(5) . . ?
Cu7Y Cu49 Cu8Y 63.51(5) . . ?
Cu54 Cu49 Cu8Y 116.23(5) . . ?
Cu7Y Cu49 Cu39 64.37(4) . . ?
Cu54 Cu49 Cu39 116.96(4) . . ?
Cu8Y Cu49 Cu39 117.25(5) . . ?
Cu7Y Cu49 Cu18 116.57(5) . . ?
Cu54 Cu49 Cu18 116.74(4) . . ?
Cu8Y Cu49 Cu18 116.28(5) . . ?
Cu39 Cu49 Cu18 62.73(3) . . ?
Cu54 Cu49 Cu2W 62.48(4) . 3 ?
Cu39 Cu49 Cu2W 116.92(5) . 3 ?
Cu18 Cu49 Cu2W 179.00(5) . 3 ?
Cu7Y Cu49 Cu47 115.81(5) . . ?
Cu54 Cu49 Cu47 117.29(4) . . ?
Cu8Y Cu49 Cu47 63.37(4) . . ?
Cu39 Cu49 Cu47 114.89(4) . . ?
Cu18 Cu49 Cu47 62.45(3) . . ?
Cu2W Cu49 Cu47 118.39(4) 3 . ?
Cu7Y Cu49 Cu38 63.53(4) . . ?
Cu54 Cu49 Cu38 179.62(4) . . ?
Cu8Y Cu49 Cu38 63.80(4) . . ?
Cu39 Cu49 Cu38 63.23(3) . . ?
Cu18 Cu49 Cu38 63.01(3) . . ?
Cu2W Cu49 Cu38 117.77(5) 3 . ?
Cu47 Cu49 Cu38 62.36(3) . . ?
Cu54 Cu49 Cu4W 56.89(4) . . ?
Cu39 Cu49 Cu4W 91.83(4) . . ?
Cu18 Cu49 Cu4W 148.81(5) . . ?
Cu2W Cu49 Cu4W 30.34(5) 3 . ?
Cu47 Cu49 Cu4W 148.72(5) . . ?
Cu38 Cu49 Cu4W 123.48(5) . . ?
Cu54 Cu49 Cu9X 121.29(5) . 3 ?
Cu39 Cu49 Cu9X 89.52(5) . 3 ?
Cu18 Cu49 Cu9X 121.96(5) . 3 ?
Cu2W Cu49 Cu9X 58.81(5) 3 3 ?
Cu47 Cu49 Cu9X 91.32(4) . 3 ?
Cu38 Cu49 Cu9X 58.97(4) . 3 ?
Cu4W Cu49 Cu9X 72.01(5) . 3 ?
Cu54 Cu49 Cu5X 90.68(5) . 3 ?
Cu39 Cu49 Cu5X 147.59(5) . 3 ?
Cu18 Cu49 Cu5X 121.48(4) . 3 ?
Cu2W Cu49 Cu5X 59.36(5) 3 3 ?
Cu47 Cu49 Cu5X 59.03(4) . 3 ?
Cu38 Cu49 Cu5X 89.23(5) . 3 ?
Cu4W Cu49 Cu5X 89.71(5) . 3 ?
Cu7Y Cu49 Cu48 148.94(5) . . ?
Cu54 Cu49 Cu48 58.01(3) . . ?
Cu8Y Cu49 Cu48 147.55(5) . . ?
Cu39 Cu49 Cu48 89.89(3) . . ?
Cu18 Cu49 Cu48 58.73(3) . . ?
Cu2W Cu49 Cu48 120.49(5) 3 . ?
Cu47 Cu49 Cu48 90.01(3) . . ?
Cu38 Cu49 Cu48 121.74(4) . . ?
Cu4W Cu49 Cu48 106.81(4) . . ?
Cu9X Cu49 Cu48 178.67(5) 3 . ?
Cu5X Cu49 Cu48 120.52(5) 3 . ?
Cu6Y Cu50 Cu5Y 64.56(5) . . ?
Cu6Y Cu50 Cu54 115.85(5) . . ?
Cu5Y Cu50 Cu54 115.96(5) . . ?
Cu6Y Cu50 Cu19 116.20(5) . . ?
Cu5Y Cu50 Cu19 116.97(5) . . ?
Cu54 Cu50 Cu19 116.92(4) . . ?
Cu54 Cu50 Cu1W 63.08(4) . 3 ?
Cu19 Cu50 Cu1W 179.75(6) . 3 ?
Cu6Y Cu50 Cu39 63.26(4) . . ?
Cu5Y Cu50 Cu39 117.27(5) . . ?
Cu54 Cu50 Cu39 116.53(4) . . ?
Cu19 Cu50 Cu39 62.69(3) . . ?
Cu1W Cu50 Cu39 117.06(5) 3 . ?
Cu6Y Cu50 Cu41 117.01(5) . . ?
Cu5Y Cu50 Cu41 63.77(4) . . ?
Cu54 Cu50 Cu41 117.62(4) . . ?
Cu19 Cu50 Cu41 62.87(3) . . ?
Cu1W Cu50 Cu41 117.37(5) 3 . ?
Cu39 Cu50 Cu41 115.27(4) . . ?
Cu6Y Cu50 Cu40 64.21(4) . . ?
Cu5Y Cu50 Cu40 64.38(4) . . ?
Cu54 Cu50 Cu40 179.66(5) . . ?
Cu19 Cu50 Cu40 62.83(3) . . ?
Cu1W Cu50 Cu40 117.18(5) 3 . ?
Cu39 Cu50 Cu40 63.17(3) . . ?
Cu41 Cu50 Cu40 62.52(3) . . ?
Cu54 Cu50 Cu3W 56.61(4) . . ?
Cu19 Cu50 Cu3W 148.23(5) . . ?
Cu1W Cu50 Cu3W 32.00(5) 3 . ?
Cu39 Cu50 Cu3W 149.00(5) . . ?
Cu41 Cu50 Cu3W 91.51(4) . . ?
Cu40 Cu50 Cu3W 123.73(4) . . ?
Cu54 Cu50 Cu8X 121.35(5) . 3 ?
Cu19 Cu50 Cu8X 121.73(5) . 3 ?
Cu1W Cu50 Cu8X 58.28(5) 3 3 ?
Cu39 Cu50 Cu8X 90.47(5) . 3 ?
Cu41 Cu50 Cu8X 89.97(4) . 3 ?
Cu40 Cu50 Cu8X 58.90(4) . 3 ?
Cu3W Cu50 Cu8X 73.36(5) . 3 ?
Cu6Y Cu50 Cu48 147.09(5) . . ?
Cu5Y Cu50 Cu48 148.34(5) . . ?
Cu54 Cu50 Cu48 58.15(3) . . ?
Cu19 Cu50 Cu48 58.77(3) . . ?
Cu1W Cu50 Cu48 121.23(5) 3 . ?
Cu39 Cu50 Cu48 89.57(3) . . ?
Cu41 Cu50 Cu48 90.51(3) . . ?
Cu40 Cu50 Cu48 121.59(4) . . ?
Cu3W Cu50 Cu48 106.35(4) . . ?
Cu8X Cu50 Cu48 179.44(5) 3 . ?
Cu54 Cu50 Cu4W 56.54(4) . . ?
Cu19 Cu50 Cu4W 147.41(5) . . ?
Cu1W Cu50 Cu4W 32.35(5) 3 . ?
Cu39 Cu50 Cu4W 90.62(4) . . ?
Cu41 Cu50 Cu4W 149.69(5) . . ?
Cu40 Cu50 Cu4W 123.52(5) . . ?
Cu3W Cu50 Cu4W 59.77(5) . . ?
Cu48 Cu50 Cu4W 105.94(4) . . ?
Cu4Y Cu51 Cu3Y 62.99(6) . . ?
Cu4Y Cu51 Cu20 117.14(5) . . ?
Cu3Y Cu51 Cu20 116.50(5) . . ?
Cu4Y Cu51 Cu54 116.21(5) . . ?
Cu3Y Cu51 Cu54 115.55(5) . . ?
Cu20 Cu51 Cu54 117.26(4) . . ?
Cu4Y Cu51 Cu41 64.39(5) . . ?
Cu3Y Cu51 Cu41 116.84(5) . . ?
Cu20 Cu51 Cu41 63.23(3) . . ?
Cu54 Cu51 Cu41 117.43(4) . . ?
Cu4Y Cu51 Cu43 115.58(5) . . ?
Cu3Y Cu51 Cu43 63.24(4) . . ?
Cu20 Cu51 Cu43 62.80(3) . . ?
Cu54 Cu51 Cu43 117.23(4) . . ?
Cu41 Cu51 Cu43 115.36(4) . . ?
Cu20 Cu51 Cu5W 179.33(5) . 3 ?
Cu54 Cu51 Cu5W 62.34(4) . 3 ?
Cu41 Cu51 Cu5W 116.39(5) . 3 ?
Cu43 Cu51 Cu5W 117.84(5) . 3 ?
Cu4Y Cu51 Cu42 63.43(4) . . ?
Cu3Y Cu51 Cu42 63.90(4) . . ?
Cu20 Cu51 Cu42 63.30(3) . . ?
Cu54 Cu51 Cu42 179.42(5) . . ?
Cu41 Cu51 Cu42 62.90(3) . . ?
Cu43 Cu51 Cu42 62.78(3) . . ?
Cu5W Cu51 Cu42 117.10(5) 3 . ?
Cu20 Cu51 Cu3W 149.31(5) . . ?
Cu54 Cu51 Cu3W 56.43(4) . . ?
Cu41 Cu51 Cu3W 91.97(4) . . ?
Cu43 Cu51 Cu3W 147.86(5) . . ?
Cu5W Cu51 Cu3W 30.05(5) 3 . ?
Cu42 Cu51 Cu3W 123.20(4) . . ?
Cu4Y Cu51 Cu48 149.34(5) . . ?
Cu3Y Cu51 Cu48 147.62(5) . . ?
Cu20 Cu51 Cu48 59.38(3) . . ?
Cu54 Cu51 Cu48 57.88(3) . . ?
Cu41 Cu51 Cu48 90.79(3) . . ?
Cu43 Cu51 Cu48 90.61(3) . . ?
Cu5W Cu51 Cu48 120.21(4) 3 . ?
Cu42 Cu51 Cu48 122.68(4) . . ?
Cu3W Cu51 Cu48 106.40(4) . . ?
Cu20 Cu51 Cu7X 121.87(4) . 3 ?
Cu54 Cu51 Cu7X 120.87(4) . 3 ?
Cu41 Cu51 Cu7X 89.30(5) . 3 ?
Cu43 Cu51 Cu7X 90.64(5) . 3 ?
Cu5W Cu51 Cu7X 58.53(5) 3 3 ?
Cu42 Cu51 Cu7X 58.57(4) . 3 ?
Cu3W Cu51 Cu7X 72.18(5) . 3 ?
Cu48 Cu51 Cu7X 178.57(5) . 3 ?
Cu4Y Cu51 Cu50 90.81(5) . . ?
Cu3Y Cu51 Cu50 148.21(5) . . ?
Cu20 Cu51 Cu50 90.69(4) . . ?
Cu54 Cu51 Cu50 58.18(3) . . ?
Cu41 Cu51 Cu50 59.25(3) . . ?
Cu43 Cu51 Cu50 148.54(4) . . ?
Cu5W Cu51 Cu50 88.64(4) 3 . ?
Cu42 Cu51 Cu50 122.15(4) . . ?
Cu3W Cu51 Cu50 59.84(4) . . ?
Cu48 Cu51 Cu50 59.87(3) . . ?
Cu7X Cu51 Cu50 119.03(5) 3 . ?
Cu54 Cu52 Cu2Y 117.06(5) . . ?
Cu54 Cu52 Cu21 117.36(4) . . ?
Cu2Y Cu52 Cu21 116.15(5) . . ?
Cu54 Cu52 Cu45 117.20(4) . . ?
Cu2Y Cu52 Cu45 114.96(5) . . ?
Cu21 Cu52 Cu45 63.05(3) . . ?
Cu54 Cu52 Cu1Y 116.32(5) . . ?
Cu2Y Cu52 Cu1Y 62.50(5) . . ?
Cu21 Cu52 Cu1Y 116.01(5) . . ?
Cu45 Cu52 Cu1Y 63.07(4) . . ?
Cu54 Cu52 Cu43 117.50(4) . . ?
Cu2Y Cu52 Cu43 64.15(4) . . ?
Cu21 Cu52 Cu43 62.77(3) . . ?
Cu45 Cu52 Cu43 115.25(3) . . ?
Cu1Y Cu52 Cu43 116.20(5) . . ?
Cu54 Cu52 Cu4W 61.58(4) . 3 ?
Cu21 Cu52 Cu4W 178.78(5) . 3 ?
Cu45 Cu52 Cu4W 117.86(4) . 3 ?
Cu43 Cu52 Cu4W 116.98(5) . 3 ?
Cu54 Cu52 Cu44 179.55(5) . . ?
Cu2Y Cu52 Cu44 62.63(4) . . ?
Cu21 Cu52 Cu44 63.08(3) . . ?
Cu45 Cu52 Cu44 62.85(3) . . ?
Cu1Y Cu52 Cu44 63.28(4) . . ?
Cu43 Cu52 Cu44 62.72(3) . . ?
Cu4W Cu52 Cu44 117.98(5) 3 . ?
Cu54 Cu52 Cu6X 120.47(5) . 3 ?
Cu21 Cu52 Cu6X 122.16(5) . 3 ?
Cu45 Cu52 Cu6X 90.88(4) . 3 ?
Cu43 Cu52 Cu6X 89.59(4) . 3 ?
Cu4W Cu52 Cu6X 58.88(5) 3 3 ?
Cu44 Cu52 Cu6X 59.10(4) . 3 ?
Cu54 Cu52 Cu2W 57.53(4) . . ?
Cu21 Cu52 Cu2W 148.82(5) . . ?
Cu45 Cu52 Cu2W 148.13(5) . . ?
Cu43 Cu52 Cu2W 91.30(4) . . ?
Cu4W Cu52 Cu2W 30.28(5) 3 . ?
Cu44 Cu52 Cu2W 122.16(5) . . ?
Cu54 Cu52 Cu48 58.13(3) . . ?
Cu2Y Cu52 Cu48 149.72(5) . . ?
Cu21 Cu52 Cu48 59.23(3) . . ?
Cu45 Cu52 Cu48 90.31(3) . . ?
Cu1Y Cu52 Cu48 147.78(5) . . ?
Cu43 Cu52 Cu48 90.73(3) . . ?
Cu4W Cu52 Cu48 119.71(5) 3 . ?
Cu44 Cu52 Cu48 122.31(4) . . ?
Cu6X Cu52 Cu48 178.51(5) 3 . ?
Cu2W Cu52 Cu48 107.51(4) . . ?
Cu54 Cu52 Cu1W 57.71(4) . . ?
Cu21 Cu52 Cu1W 147.95(5) . . ?
Cu45 Cu52 Cu1W 90.14(4) . . ?
Cu43 Cu52 Cu1W 149.28(5) . . ?
Cu4W Cu52 Cu1W 32.32(5) 3 . ?
Cu44 Cu52 Cu1W 121.89(5) . . ?
Cu2W Cu52 Cu1W 59.80(5) . . ?
Cu48 Cu52 Cu1W 106.95(5) . . ?
Cu54 Cu53 Cu22 116.97(4) . . ?
Cu54 Cu53 Cu9Y 117.17(4) . . ?
Cu22 Cu53 Cu9Y 116.69(5) . . ?
Cu54 Cu53 Cu47 117.73(4) . . ?
Cu22 Cu53 Cu47 63.13(3) . . ?
Cu9Y Cu53 Cu47 64.27(4) . . ?
Cu54 Cu53 CuAY 116.75(5) . . ?
Cu22 Cu53 CuAY 115.51(5) . . ?
Cu9Y Cu53 CuAY 62.54(5) . . ?
Cu47 Cu53 CuAY 115.92(5) . . ?
Cu54 Cu53 Cu3W 61.47(4) . 3 ?
Cu22 Cu53 Cu3W 178.43(5) . 3 ?
Cu47 Cu53 Cu3W 117.54(5) . 3 ?
Cu54 Cu53 Cu45 116.45(4) . . ?
Cu22 Cu53 Cu45 62.54(3) . . ?
Cu9Y Cu53 Cu45 115.68(5) . . ?
Cu47 Cu53 Cu45 115.34(4) . . ?
CuAY Cu53 Cu45 63.29(4) . . ?
Cu3W Cu53 Cu45 117.74(5) 3 . ?
Cu54 Cu53 CuAX 120.72(5) . 3 ?
Cu22 Cu53 CuAX 122.30(5) . 3 ?
Cu47 Cu53 CuAX 90.15(5) . 3 ?
Cu3W Cu53 CuAX 59.26(5) 3 3 ?
Cu45 Cu53 CuAX 90.83(5) . 3 ?
Cu54 Cu53 Cu46 178.92(4) . . ?
Cu22 Cu53 Cu46 62.97(3) . . ?
Cu9Y Cu53 Cu46 63.49(4) . . ?
Cu47 Cu53 Cu46 63.28(3) . . ?
CuAY Cu53 Cu46 62.66(4) . . ?
Cu3W Cu53 Cu46 118.59(4) 3 . ?
Cu45 Cu53 Cu46 62.51(3) . . ?
CuAX Cu53 Cu46 59.34(4) 3 . ?
Cu54 Cu53 Cu5W 57.88(4) . . ?
Cu22 Cu53 Cu5W 149.57(5) . . ?
Cu47 Cu53 Cu5W 91.73(4) . . ?
Cu3W Cu53 Cu5W 30.15(5) 3 . ?
Cu45 Cu53 Cu5W 147.89(5) . . ?
Cu46 Cu53 Cu5W 122.78(4) . . ?
Cu54 Cu53 Cu1W 57.77(4) . . ?
Cu22 Cu53 Cu1W 147.37(5) . . ?
Cu47 Cu53 Cu1W 149.49(5) . . ?
Cu3W Cu53 Cu1W 31.99(5) 3 . ?
Cu45 Cu53 Cu1W 90.00(4) . . ?
Cu46 Cu53 Cu1W 121.62(5) . . ?
Cu5W Cu53 Cu1W 59.56(5) . . ?
Cu54 Cu53 Cu48 58.01(3) . . ?
Cu22 Cu53 Cu48 58.96(3) . . ?
Cu9Y Cu53 Cu48 149.53(5) . . ?
Cu47 Cu53 Cu48 90.54(3) . . ?
CuAY Cu53 Cu48 147.94(5) . . ?
Cu3W Cu53 Cu48 119.48(4) 3 . ?
Cu45 Cu53 Cu48 89.84(3) . . ?
CuAX Cu53 Cu48 178.73(5) 3 . ?
Cu46 Cu53 Cu48 121.93(4) . . ?
Cu5W Cu53 Cu48 107.75(4) . . ?
Cu1W Cu53 Cu48 107.07(4) . . ?
Cu3W Cu54 Cu4W 64.88(5) . . ?
Cu3W Cu54 Cu2W 63.77(5) . . ?
Cu4W Cu54 Cu2W 118.22(5) . . ?
Cu3W Cu54 Cu5W 118.13(5) . . ?
Cu4W Cu54 Cu5W 63.90(5) . . ?
Cu2W Cu54 Cu5W 116.69(6) . . ?
Cu3W Cu54 Cu1W 117.22(6) . . ?
Cu4W Cu54 Cu1W 117.05(5) . . ?
Cu2W Cu54 Cu1W 63.46(5) . . ?
Cu5W Cu54 Cu1W 62.89(5) . . ?
Cu3W Cu54 Cu54 63.65(4) . 3 ?
Cu4W Cu54 Cu54 63.75(5) . 3 ?
Cu2W Cu54 Cu54 64.16(4) . 3 ?
Cu5W Cu54 Cu54 64.05(4) . 3 ?
Cu1W Cu54 Cu54 64.38(4) . 3 ?
Cu3W Cu54 Cu48 116.53(5) . . ?
Cu4W Cu54 Cu48 116.34(5) . . ?
Cu2W Cu54 Cu48 115.85(5) . . ?
Cu5W Cu54 Cu48 115.83(5) . . ?
Cu1W Cu54 Cu48 115.46(5) . . ?
Cu54 Cu54 Cu48 179.82(6) 3 . ?
Cu3W Cu54 Cu50 63.82(4) . . ?
Cu4W Cu54 Cu50 64.10(4) . . ?
Cu2W Cu54 Cu50 116.85(5) . . ?
Cu5W Cu54 Cu50 117.61(5) . . ?
Cu1W Cu54 Cu50 178.63(5) . . ?
Cu54 Cu54 Cu50 116.99(4) 3 . ?
Cu48 Cu54 Cu50 63.17(3) . . ?
Cu3W Cu54 Cu49 117.36(5) . . ?
Cu4W Cu54 Cu49 63.06(4) . . ?
Cu2W Cu54 Cu49 178.70(5) . . ?
Cu5W Cu54 Cu49 63.54(4) . . ?
Cu1W Cu54 Cu49 115.99(5) . . ?
Cu54 Cu54 Cu49 116.80(5) 3 . ?
Cu48 Cu54 Cu49 63.18(3) . . ?
Cu50 Cu54 Cu49 63.67(3) . . ?
Cu3W Cu54 Cu52 115.88(5) . . ?
Cu4W Cu54 Cu52 179.04(5) . . ?
Cu2W Cu54 Cu52 62.74(4) . . ?
Cu5W Cu54 Cu52 115.84(5) . . ?
Cu1W Cu54 Cu52 63.26(4) . . ?
Cu54 Cu54 Cu52 117.04(5) 3 . ?
Cu48 Cu54 Cu52 62.87(3) . . ?
Cu50 Cu54 Cu52 115.57(3) . . ?
Cu49 Cu54 Cu52 115.98(4) . . ?
Cu3W Cu54 Cu53 179.32(5) . . ?
Cu4W Cu54 Cu53 115.70(5) . . ?
Cu2W Cu54 Cu53 115.98(5) . . ?
Cu5W Cu54 Cu53 62.56(4) . . ?
Cu1W Cu54 Cu53 62.95(4) . . ?
Cu54 Cu54 Cu53 116.89(4) 3 . ?
Cu48 Cu54 Cu53 62.94(3) . . ?
Cu50 Cu54 Cu53 116.00(4) . . ?
Cu49 Cu54 Cu53 62.89(3) . . ?
Cu52 Cu54 Cu53 63.55(3) . . ?
Cu3W Cu54 Cu51 63.39(4) . . ?
Cu4W Cu54 Cu51 117.34(5) . . ?
Cu2W Cu54 Cu51 63.72(4) . . ?
Cu5W Cu54 Cu51 178.48(5) . . ?
Cu1W Cu54 Cu51 116.59(5) . . ?
Cu54 Cu54 Cu51 117.16(5) 3 . ?
Cu48 Cu54 Cu51 62.96(3) . . ?
Cu50 Cu54 Cu51 62.88(3) . . ?
Cu49 Cu54 Cu51 116.02(4) . . ?
Cu52 Cu54 Cu51 62.91(3) . . ?
Cu53 Cu54 Cu51 115.93(3) . . ?
Cu3W Cu1W Cu4W 130.89(13) 3 3 ?
Cu3W Cu1W Cu54 77.99(9) 3 . ?
Cu4W Cu1W Cu54 77.94(8) 3 . ?
Cu3W Cu1W Cu50 76.32(8) 3 3 ?
Cu4W Cu1W Cu50 76.58(8) 3 3 ?
Cu54 Cu1W Cu50 115.55(6) . 3 ?
Cu3W Cu1W Cu5W 19.89(7) 3 . ?
Cu4W Cu1W Cu5W 122.60(10) 3 . ?
Cu54 Cu1W Cu5W 58.47(5) . . ?
Cu50 Cu1W Cu5W 89.64(6) 3 . ?
Cu3W Cu1W Cu2W 122.13(10) 3 . ?
Cu4W Cu1W Cu2W 20.43(7) 3 . ?
Cu54 Cu1W Cu2W 57.85(5) . . ?
Cu50 Cu1W Cu2W 90.07(6) 3 . ?
Cu5W Cu1W Cu2W 108.25(7) . . ?
Cu3W Cu1W Cu53 71.53(9) 3 . ?
Cu4W Cu1W Cu53 127.10(10) 3 . ?
Cu54 Cu1W Cu53 59.27(4) . . ?
Cu50 Cu1W Cu53 147.80(7) 3 . ?
Cu5W Cu1W Cu53 59.89(5) . . ?
Cu2W Cu1W Cu53 108.29(6) . . ?
Cu3W Cu1W Cu52 127.09(11) 3 . ?
Cu4W Cu1W Cu52 71.28(8) 3 . ?
Cu54 Cu1W Cu52 59.03(4) . . ?
Cu50 Cu1W Cu52 147.83(7) 3 . ?
Cu5W Cu1W Cu52 108.66(6) . . ?
Cu2W Cu1W Cu52 59.51(5) . . ?
Cu53 Cu1W Cu52 60.91(4) . . ?
Cu3W Cu1W Cu54 65.45(8) 3 3 ?
Cu4W Cu1W Cu54 65.47(8) 3 3 ?
Cu54 Cu1W Cu54 57.87(4) . 3 ?
Cu50 Cu1W Cu54 57.68(4) 3 3 ?
Cu5W Cu1W Cu54 60.37(5) . 3 ?
Cu2W Cu1W Cu54 60.09(5) . 3 ?
Cu53 Cu1W Cu54 108.45(6) . 3 ?
Cu52 Cu1W Cu54 108.16(5) . 3 ?
Cu4W Cu2W Cu5W 134.28(13) 3 3 ?
Cu4W Cu2W Cu54 80.32(9) 3 . ?
Cu5W Cu2W Cu54 79.71(9) 3 . ?
Cu4W Cu2W Cu49 76.49(9) 3 3 ?
Cu5W Cu2W Cu49 76.51(8) 3 3 ?
Cu54 Cu2W Cu49 116.55(6) . 3 ?
Cu4W Cu2W Cu3W 123.42(11) 3 . ?
Cu5W Cu2W Cu3W 22.23(7) 3 . ?
Cu54 Cu2W Cu3W 57.54(5) . . ?
Cu49 Cu2W Cu3W 89.60(6) 3 . ?
Cu4W Cu2W Cu52 73.38(8) 3 . ?
Cu5W Cu2W Cu52 127.31(10) 3 . ?
Cu54 Cu2W Cu52 59.73(4) . . ?
Cu49 Cu2W Cu52 149.83(6) 3 . ?
Cu3W Cu2W Cu52 108.27(6) . . ?
Cu4W Cu2W Cu1W 21.99(8) 3 . ?
Cu5W Cu2W Cu1W 125.32(10) 3 . ?
Cu54 Cu2W Cu1W 58.69(5) . . ?
Cu49 Cu2W Cu1W 91.08(6) 3 . ?
Cu3W Cu2W Cu1W 108.03(7) . . ?
Cu52 Cu2W Cu1W 60.70(5) . . ?
Cu4W Cu2W Cu54 66.72(8) 3 3 ?
Cu5W Cu2W Cu54 67.75(8) 3 3 ?
Cu54 Cu2W Cu54 58.40(4) . 3 ?
Cu49 Cu2W Cu54 58.16(4) 3 3 ?
Cu3W Cu2W Cu54 59.68(5) . 3 ?
Cu52 Cu2W Cu54 109.73(6) . 3 ?
Cu1W Cu2W Cu54 60.85(5) . 3 ?
Cu4W Cu2W Cu51 129.28(11) 3 . ?
Cu5W Cu2W Cu51 70.62(8) 3 . ?
Cu54 Cu2W Cu51 59.42(4) . . ?
Cu49 Cu2W Cu51 147.09(6) 3 . ?
Cu3W Cu2W Cu51 59.95(5) . . ?
Cu52 Cu2W Cu51 60.53(4) . . ?
Cu1W Cu2W Cu51 109.12(6) . . ?
Cu54 Cu2W Cu51 108.88(6) 3 . ?
Cu5W Cu3W Cu1W 138.91(14) 3 3 ?
Cu5W Cu3W Cu54 83.25(9) 3 . ?
Cu1W Cu3W Cu54 82.32(8) 3 . ?
Cu5W Cu3W Cu53 76.87(9) 3 3 ?
Cu1W Cu3W Cu53 76.49(8) 3 3 ?
Cu54 Cu3W Cu53 117.99(6) . 3 ?
Cu5W Cu3W Cu2W 24.62(7) 3 . ?
Cu1W Cu3W Cu2W 127.57(10) 3 . ?
Cu54 Cu3W Cu2W 58.69(5) . . ?
Cu53 Cu3W Cu2W 91.43(6) 3 . ?
Cu5W Cu3W Cu54 70.03(8) 3 3 ?
Cu1W Cu3W Cu54 69.51(8) 3 3 ?
Cu54 Cu3W Cu54 59.24(4) . 3 ?
Cu53 Cu3W Cu54 58.76(4) 3 3 ?
Cu2W Cu3W Cu54 61.01(5) . 3 ?
Cu5W Cu3W Cu51 72.91(8) 3 . ?
Cu1W Cu3W Cu51 129.27(10) 3 . ?
Cu54 Cu3W Cu51 60.17(4) . . ?
Cu53 Cu3W Cu51 149.73(7) 3 . ?
Cu2W Cu3W Cu51 61.01(5) . . ?
Cu54 Cu3W Cu51 110.82(5) 3 . ?
Cu5W Cu3W Cu4W 127.05(10) 3 . ?
Cu1W Cu3W Cu4W 24.72(7) 3 . ?
Cu54 Cu3W Cu4W 57.62(5) . . ?
Cu53 Cu3W Cu4W 90.70(6) 3 . ?
Cu2W Cu3W Cu4W 107.98(6) . . ?
Cu54 Cu3W Cu4W 59.94(5) 3 . ?
Cu51 Cu3W Cu4W 108.75(6) . . ?
Cu5W Cu3W Cu50 130.16(10) 3 . ?
Cu1W Cu3W Cu50 71.67(9) 3 . ?
Cu54 Cu3W Cu50 59.57(4) . . ?
Cu53 Cu3W Cu50 148.11(7) 3 . ?
Cu2W Cu3W Cu50 109.19(6) . . ?
Cu54 Cu3W Cu50 109.85(5) 3 . ?
Cu51 Cu3W Cu50 60.48(4) . . ?
Cu4W Cu3W Cu50 60.34(5) . . ?
Cu2W Cu4W Cu1W 137.57(15) 3 3 ?
Cu2W Cu4W Cu54 82.75(9) 3 . ?
Cu1W Cu4W Cu54 81.86(9) 3 . ?
Cu2W Cu4W Cu52 76.33(9) 3 3 ?
Cu1W Cu4W Cu52 76.40(8) 3 3 ?
Cu54 Cu4W Cu52 117.61(6) . 3 ?
Cu2W Cu4W Cu49 73.17(8) 3 . ?
Cu1W Cu4W Cu49 129.15(10) 3 . ?
Cu54 Cu4W Cu49 60.04(4) . . ?
Cu52 Cu4W Cu49 149.45(6) 3 . ?
Cu2W Cu4W Cu54 68.98(9) 3 3 ?
Cu1W Cu4W Cu54 69.16(9) 3 3 ?
Cu54 Cu4W Cu54 59.12(4) . 3 ?
Cu52 Cu4W Cu54 58.49(4) 3 3 ?
Cu49 Cu4W Cu54 110.45(6) . 3 ?
Cu2W Cu4W Cu5W 23.97(8) 3 . ?
Cu1W Cu4W Cu5W 127.13(11) 3 . ?
Cu54 Cu4W Cu5W 58.90(5) . . ?
Cu52 Cu4W Cu5W 91.03(6) 3 . ?
Cu49 Cu4W Cu5W 60.92(5) . . ?
Cu54 Cu4W Cu5W 60.87(5) 3 . ?
Cu2W Cu4W Cu3W 125.89(11) 3 . ?
Cu1W Cu4W Cu3W 24.38(7) 3 . ?
Cu54 Cu4W Cu3W 57.50(5) . . ?
Cu52 Cu4W Cu3W 90.35(6) 3 . ?
Cu49 Cu4W Cu3W 108.77(6) . . ?
Cu54 Cu4W Cu3W 59.73(5) 3 . ?
Cu5W Cu4W Cu3W 107.89(7) . . ?
Cu2W Cu4W Cu50 130.57(10) 3 . ?
Cu1W Cu4W Cu50 71.08(8) 3 . ?
Cu54 Cu4W Cu50 59.36(4) . . ?
Cu52 Cu4W Cu50 147.45(6) 3 . ?
Cu49 Cu4W Cu50 61.13(4) . . ?
Cu54 Cu4W Cu50 109.31(6) 3 . ?
Cu5W Cu4W Cu50 109.55(6) . . ?
Cu3W Cu4W Cu50 59.89(5) . . ?
Cu3W Cu5W Cu2W 133.15(14) 3 3 ?
Cu3W Cu5W Cu54 79.45(9) 3 . ?
Cu2W Cu5W Cu54 78.84(8) 3 . ?
Cu3W Cu5W Cu51 77.04(9) 3 3 ?
Cu2W Cu5W Cu51 76.40(8) 3 3 ?
Cu54 Cu5W Cu51 116.43(6) . 3 ?
Cu3W Cu5W Cu1W 21.21(7) 3 . ?
Cu2W Cu5W Cu1W 124.41(10) 3 . ?
Cu54 Cu5W Cu1W 58.64(5) . . ?
Cu51 Cu5W Cu1W 91.25(6) 3 . ?
Cu3W Cu5W Cu53 72.98(8) 3 . ?
Cu2W Cu5W Cu53 126.75(10) 3 . ?
Cu54 Cu5W Cu53 59.56(4) . . ?
Cu51 Cu5W Cu53 149.97(7) 3 . ?
Cu1W Cu5W Cu53 60.54(5) . . ?
Cu3W Cu5W Cu4W 122.68(10) 3 . ?
Cu2W Cu5W Cu4W 21.75(7) 3 . ?
Cu54 Cu5W Cu4W 57.20(4) . . ?
Cu51 Cu5W Cu4W 89.76(5) 3 . ?
Cu1W Cu5W Cu4W 107.85(7) . . ?
Cu53 Cu5W Cu4W 107.71(6) . . ?
Cu3W Cu5W Cu49 128.28(10) 3 . ?
Cu2W Cu5W Cu49 70.46(8) 3 . ?
Cu54 Cu5W Cu49 58.93(4) . . ?
Cu51 Cu5W Cu49 146.82(6) 3 . ?
Cu1W Cu5W Cu49 108.67(6) . . ?
Cu53 Cu5W Cu49 60.38(4) . . ?
Cu4W Cu5W Cu49 59.36(5) . . ?
Cu3W Cu5W Cu54 66.41(8) 3 3 ?
Cu2W Cu5W Cu54 66.84(8) 3 3 ?
Cu54 Cu5W Cu54 58.12(4) . 3 ?
Cu51 Cu5W Cu54 58.32(4) 3 3 ?
Cu1W Cu5W Cu54 60.92(5) . 3 ?
Cu53 Cu5W Cu54 109.41(6) . 3 ?
Cu4W Cu5W Cu54 59.54(5) . 3 ?
Cu49 Cu5W Cu54 108.12(5) . 3 ?
Cu9Z Cu1Z CuFZ 136.40(13) 3 . ?
Cu8Z Cu1Z CuFZ 19.65(8) 3 . ?
Cu9Z Cu1Z Cu2Z 13.94(10) 3 . ?
Cu8Z Cu1Z Cu2Z 163.37(13) 3 . ?
CuFZ Cu1Z Cu2Z 148.14(8) . . ?
CuAZ Cu2Z Cu3Z 18.78(9) 3 . ?
Cu9Z Cu2Z Cu3Z 134.35(12) 3 . ?
CuAZ Cu2Z Cu1Z 158.80(14) 3 . ?
Cu9Z Cu2Z Cu1Z 12.40(9) 3 . ?
Cu3Z Cu2Z Cu1Z 144.70(8) . . ?
CuBZ Cu3Z Cu4Z 19.11(9) 3 . ?
CuAZ Cu3Z Cu4Z 167.61(12) 3 . ?
CuBZ Cu3Z Cu2Z 165.23(13) 3 . ?
CuAZ Cu3Z Cu2Z 16.70(8) 3 . ?
Cu4Z Cu3Z Cu2Z 175.33(9) . . ?
CuCZ Cu4Z Cu3Z 131.63(12) 3 . ?
CuBZ Cu4Z Cu3Z 16.44(8) 3 . ?
CuCZ Cu4Z Cu5Z 16.89(9) 3 . ?
CuBZ Cu4Z Cu5Z 159.54(12) 3 . ?
Cu3Z Cu4Z Cu5Z 146.91(8) . . ?
CuDZ Cu5Z Cu6Z 14.63(8) 3 . ?
CuCZ Cu5Z Cu6Z 132.72(11) 3 . ?
CuDZ Cu5Z Cu4Z 155.92(12) 3 . ?
CuCZ Cu5Z Cu4Z 14.88(8) 3 . ?
Cu6Z Cu5Z Cu4Z 146.21(8) . . ?
CuEZ Cu6Z Cu5Z 168.31(13) 3 . ?
CuDZ Cu6Z Cu5Z 13.90(8) 3 . ?
CuEZ Cu6Z Cu7Z 16.56(8) 3 . ?
CuDZ Cu6Z Cu7Z 170.55(13) 3 . ?
Cu5Z Cu6Z Cu7Z 174.54(8) . . ?
CuFZ Cu7Z Cu6Z 130.91(12) 3 . ?
CuEZ Cu7Z Cu6Z 15.75(8) 3 . ?
CuFZ Cu7Z Cu8Z 17.43(8) 3 . ?
CuEZ Cu7Z Cu8Z 158.67(12) 3 . ?
Cu6Z Cu7Z Cu8Z 146.85(8) . . ?
CuFZ Cu8Z Cu9Z 131.00(12) 3 . ?
Cu1Z Cu8Z Cu9Z 14.46(8) 3 . ?
CuFZ Cu8Z Cu7Z 17.86(8) 3 . ?
Cu1Z Cu8Z Cu7Z 157.53(12) 3 . ?
Cu9Z Cu8Z Cu7Z 147.50(9) . . ?
Cu1Z Cu9Z Cu8Z 16.05(10) 3 . ?
Cu2Z Cu9Z Cu8Z 169.66(14) 3 . ?
Cu1Z Cu9Z CuAZ 169.22(15) 3 . ?
Cu2Z Cu9Z CuAZ 15.82(9) 3 . ?
Cu8Z Cu9Z CuAZ 173.90(9) . . ?
Cu2Z CuAZ CuBZ 159.12(13) 3 . ?
Cu3Z CuAZ CuBZ 14.63(8) 3 . ?
Cu2Z CuAZ Cu9Z 17.63(10) 3 . ?
Cu3Z CuAZ Cu9Z 133.32(12) 3 . ?
CuBZ CuAZ Cu9Z 146.32(9) . . ?
Cu3Z CuBZ CuCZ 132.55(13) 3 . ?
Cu4Z CuBZ CuCZ 17.40(8) 3 . ?
Cu3Z CuBZ CuAZ 16.82(9) 3 . ?
Cu4Z CuBZ CuAZ 161.22(12) 3 . ?
CuCZ CuBZ CuAZ 147.61(8) . . ?
Cu4Z CuCZ CuDZ 166.49(13) 3 . ?
Cu5Z CuCZ CuDZ 18.36(8) 3 . ?
Cu4Z CuCZ CuBZ 19.90(9) 3 . ?
Cu5Z CuCZ CuBZ 168.04(13) 3 . ?
CuDZ CuCZ CuBZ 173.15(8) . . ?
Cu5Z CuDZ CuCZ 20.54(8) 3 . ?
Cu6Z CuDZ CuCZ 138.07(11) 3 . ?
Cu5Z CuDZ CuEZ 164.02(12) 3 . ?
Cu6Z CuDZ CuEZ 12.55(8) 3 . ?
CuCZ CuDZ CuEZ 148.48(8) . . ?
Cu6Z CuEZ CuFZ 134.23(12) 3 . ?
Cu7Z CuEZ CuFZ 19.32(8) 3 . ?
Cu6Z CuEZ CuDZ 13.01(8) 3 . ?
Cu7Z CuEZ CuDZ 160.52(12) 3 . ?
CuFZ CuEZ CuDZ 144.97(8) . . ?
Cu8Z CuFZ Cu1Z 20.65(8) 3 . ?
Cu7Z CuFZ Cu1Z 165.34(12) 3 . ?
Cu8Z CuFZ CuEZ 164.06(12) 3 . ?
Cu7Z CuFZ CuEZ 19.39(9) 3 . ?
Cu1Z CuFZ CuEZ 174.94(8) . . ?
CuBY Cu1Y Cu52 117.74(7) . . ?
Cu52 Cu1Y Cu6Y 114.51(7) . 3 ?
CuBY Cu1Y CuPY 62.09(7) . . ?
Cu52 Cu1Y CuPY 118.34(8) . . ?
Cu6Y Cu1Y CuPY 117.38(8) 3 . ?
CuBY Cu1Y Cu2Y 90.06(7) . . ?
Cu52 Cu1Y Cu2Y 58.36(5) . . ?
Cu6Y Cu1Y Cu2Y 88.90(7) 3 . ?
CuPY Cu1Y Cu2Y 147.67(8) . . ?
CuBY Cu1Y CuAY 121.41(8) . . ?
Cu52 Cu1Y CuAY 90.23(6) . . ?
Cu6Y Cu1Y CuAY 90.27(7) 3 . ?
CuPY Cu1Y CuAY 59.32(6) . . ?
Cu2Y Cu1Y CuAY 144.53(8) . . ?
CuBY Cu1Y Cu45 90.49(7) . . ?
Cu52 Cu1Y Cu45 58.34(4) . . ?
Cu6Y Cu1Y Cu45 148.33(8) 3 . ?
CuPY Cu1Y Cu45 60.00(5) . . ?
Cu2Y Cu1Y Cu45 107.64(7) . . ?
CuAY Cu1Y Cu45 60.48(5) . . ?
CuBY Cu1Y Cu44 58.81(6) . . ?
Cu52 Cu1Y Cu44 58.93(4) . . ?
Cu6Y Cu1Y Cu44 147.33(8) 3 . ?
CuPY Cu1Y Cu44 90.15(6) . . ?
Cu2Y Cu1Y Cu44 59.82(5) . . ?
CuAY Cu1Y Cu44 120.33(7) . . ?
Cu45 Cu1Y Cu44 59.85(4) . . ?
CuCY Cu2Y Cu52 118.29(8) . . ?
Cu52 Cu2Y Cu7Y 116.49(7) . 3 ?
CuCY Cu2Y CuDY 62.22(7) . . ?
Cu52 Cu2Y CuDY 117.04(8) . . ?
Cu7Y Cu2Y CuDY 114.94(8) 3 . ?
CuCY Cu2Y Cu1Y 90.76(7) . . ?
Cu52 Cu2Y Cu1Y 59.15(5) . . ?
Cu7Y Cu2Y Cu1Y 91.54(7) 3 . ?
CuDY Cu2Y Cu1Y 148.12(8) . . ?
CuCY Cu2Y Cu44 58.64(6) . . ?
Cu52 Cu2Y Cu44 59.65(4) . . ?
Cu7Y Cu2Y Cu44 151.02(8) 3 . ?
CuDY Cu2Y Cu44 88.98(6) . . ?
Cu1Y Cu2Y Cu44 61.16(5) . . ?
CuCY Cu2Y Cu3Y 121.63(8) . . ?
Cu52 Cu2Y Cu3Y 88.65(6) . . ?
Cu7Y Cu2Y Cu3Y 88.15(7) 3 . ?
CuDY Cu2Y Cu3Y 59.42(6) . . ?
Cu1Y Cu2Y Cu3Y 143.54(8) . . ?
Cu44 Cu2Y Cu3Y 119.29(7) . . ?
CuCY Cu2Y Cu43 90.52(7) . . ?
Cu52 Cu2Y Cu43 58.32(4) . . ?
Cu7Y Cu2Y Cu43 146.22(8) 3 . ?
CuDY Cu2Y Cu43 58.72(6) . . ?
Cu1Y Cu2Y Cu43 108.60(7) . . ?
Cu44 Cu2Y Cu43 59.85(4) . . ?
Cu3Y Cu2Y Cu43 59.45(5) . . ?
CuEY Cu3Y Cu51 116.92(8) . . ?
Cu8Y Cu3Y Cu51 116.49(7) 3 . ?
CuEY Cu3Y CuDY 61.93(7) . . ?
Cu8Y Cu3Y CuDY 117.05(9) 3 . ?
Cu51 Cu3Y CuDY 117.84(7) . . ?
CuEY Cu3Y Cu4Y 90.68(7) . . ?
Cu8Y Cu3Y Cu4Y 88.71(7) 3 . ?
Cu51 Cu3Y Cu4Y 57.84(5) . . ?
CuDY Cu3Y Cu4Y 147.95(8) . . ?
CuEY Cu3Y Cu43 89.06(6) . . ?
Cu8Y Cu3Y Cu43 150.78(8) 3 . ?
Cu51 Cu3Y Cu43 58.79(4) . . ?
CuDY Cu3Y Cu43 59.05(5) . . ?
Cu4Y Cu3Y Cu43 107.66(7) . . ?
CuEY Cu3Y Cu2Y 120.82(8) . . ?
Cu8Y Cu3Y Cu2Y 91.62(7) 3 . ?
Cu51 Cu3Y Cu2Y 90.76(6) . . ?
CuDY Cu3Y Cu2Y 58.88(6) . . ?
Cu4Y Cu3Y Cu2Y 144.36(8) . . ?
Cu43 Cu3Y Cu2Y 60.89(5) . . ?
CuEY Cu3Y Cu42 57.76(6) . . ?
Cu8Y Cu3Y Cu42 146.46(8) 3 . ?
Cu51 Cu3Y Cu42 59.16(4) . . ?
CuDY Cu3Y Cu42 89.67(6) . . ?
Cu4Y Cu3Y Cu42 60.15(5) . . ?
Cu43 Cu3Y Cu42 59.80(4) . . ?
Cu2Y Cu3Y Cu42 120.68(7) . . ?
Cu51 Cu4Y CuFY 117.32(7) . . ?
Cu51 Cu4Y Cu9Y 118.78(7) . 3 ?
Cu51 Cu4Y CuGY 117.10(7) . . ?
CuFY Cu4Y CuGY 62.17(7) . . ?
Cu9Y Cu4Y CuGY 113.58(7) 3 . ?
Cu51 Cu4Y Cu3Y 59.17(5) . . ?
CuFY Cu4Y Cu3Y 90.56(8) . . ?
Cu9Y Cu4Y Cu3Y 92.00(7) 3 . ?
CuGY Cu4Y Cu3Y 148.24(8) . . ?
Cu51 Cu4Y Cu5Y 89.54(6) . . ?
CuFY Cu4Y Cu5Y 121.49(8) . . ?
Cu9Y Cu4Y Cu5Y 88.30(7) 3 . ?
CuGY Cu4Y Cu5Y 59.32(6) . . ?
Cu3Y Cu4Y Cu5Y 144.10(7) . . ?
Cu51 Cu4Y Cu42 60.07(4) . . ?
CuFY Cu4Y Cu42 57.26(5) . . ?
Cu9Y Cu4Y Cu42 150.76(9) 3 . ?
CuGY Cu4Y Cu42 88.70(6) . . ?
Cu3Y Cu4Y Cu42 61.52(5) . . ?
Cu5Y Cu4Y Cu42 120.22(7) . . ?
Cu51 Cu4Y Cu41 58.83(4) . . ?
CuFY Cu4Y Cu41 89.37(7) . . ?
Cu9Y Cu4Y Cu41 147.68(8) 3 . ?
CuGY Cu4Y Cu41 58.27(5) . . ?
Cu3Y Cu4Y Cu41 109.10(6) . . ?
Cu5Y Cu4Y Cu41 60.18(5) . . ?
Cu42 Cu4Y Cu41 60.04(4) . . ?
CuHY Cu5Y Cu50 116.06(7) . . ?
Cu50 Cu5Y CuAY 118.13(7) . 3 ?
CuHY Cu5Y CuGY 62.10(7) . . ?
Cu50 Cu5Y CuGY 117.59(7) . . ?
CuAY Cu5Y CuGY 115.78(7) 3 . ?
CuHY Cu5Y Cu4Y 121.72(8) . . ?
Cu50 Cu5Y Cu4Y 89.94(6) . . ?
CuAY Cu5Y Cu4Y 91.36(7) 3 . ?
CuGY Cu5Y Cu4Y 59.63(6) . . ?
CuHY Cu5Y Cu6Y 90.00(7) . . ?
Cu50 Cu5Y Cu6Y 57.45(5) . . ?
CuAY Cu5Y Cu6Y 90.59(7) 3 . ?
CuGY Cu5Y Cu6Y 147.26(8) . . ?
Cu4Y Cu5Y Cu6Y 143.41(7) . . ?
CuHY Cu5Y Cu41 88.41(6) . . ?
Cu50 Cu5Y Cu41 59.14(4) . . ?
CuAY Cu5Y Cu41 150.79(8) 3 . ?
CuGY Cu5Y Cu41 58.45(5) . . ?
Cu4Y Cu5Y Cu41 60.42(5) . . ?
Cu6Y Cu5Y Cu41 107.41(6) . . ?
CuHY Cu5Y Cu40 57.20(5) . . ?
Cu50 Cu5Y Cu40 58.87(4) . . ?
CuAY Cu5Y Cu40 147.90(8) 3 . ?
CuGY Cu5Y Cu40 89.02(6) . . ?
Cu4Y Cu5Y Cu40 119.71(7) . . ?
Cu6Y Cu5Y Cu40 60.06(5) . . ?
Cu41 Cu5Y Cu40 59.29(4) . . ?
Cu50 Cu6Y CuIY 116.83(7) . . ?
Cu50 Cu6Y Cu1Y 117.52(7) . 3 ?
Cu50 Cu6Y CuJY 118.90(7) . . ?
CuIY Cu6Y CuJY 62.33(6) . . ?
Cu1Y Cu6Y CuJY 115.23(8) 3 . ?
Cu50 Cu6Y Cu39 59.61(4) . . ?
CuIY Cu6Y Cu39 89.62(6) . . ?
Cu1Y Cu6Y Cu39 150.38(7) 3 . ?
CuJY Cu6Y Cu39 59.30(5) . . ?
Cu50 Cu6Y Cu7Y 91.52(6) . . ?
CuIY Cu6Y Cu7Y 121.57(8) . . ?
Cu1Y Cu6Y Cu7Y 90.64(7) 3 . ?
CuJY Cu6Y Cu7Y 59.24(6) . . ?
Cu39 Cu6Y Cu7Y 60.97(5) . . ?
Cu50 Cu6Y Cu5Y 57.99(5) . . ?
CuIY Cu6Y Cu5Y 90.06(7) . . ?
Cu1Y Cu6Y Cu5Y 89.24(7) 3 . ?
CuJY Cu6Y Cu5Y 148.35(8) . . ?
Cu39 Cu6Y Cu5Y 108.83(6) . . ?
Cu7Y Cu6Y Cu5Y 144.86(8) . . ?
Cu50 Cu6Y Cu40 59.23(4) . . ?
CuIY Cu6Y Cu40 57.60(5) . . ?
Cu1Y Cu6Y Cu40 147.11(7) 3 . ?
CuJY Cu6Y Cu40 90.04(6) . . ?
Cu39 Cu6Y Cu40 60.37(4) . . ?
Cu7Y Cu6Y Cu40 121.34(7) . . ?
Cu5Y Cu6Y Cu40 60.58(5) . . ?
CuKY Cu7Y Cu49 116.94(7) . . ?
Cu49 Cu7Y Cu2Y 117.36(7) . 3 ?
CuKY Cu7Y CuJY 62.59(6) . . ?
Cu49 Cu7Y CuJY 117.19(7) . . ?
Cu2Y Cu7Y CuJY 114.64(7) 3 . ?
CuKY Cu7Y Cu6Y 122.28(8) . . ?
Cu49 Cu7Y Cu6Y 88.52(6) . . ?
Cu2Y Cu7Y Cu6Y 88.92(7) 3 . ?
CuJY Cu7Y Cu6Y 59.71(6) . . ?
CuKY Cu7Y Cu8Y 90.21(7) . . ?
Cu49 Cu7Y Cu8Y 58.61(5) . . ?
Cu2Y Cu7Y Cu8Y 91.66(7) 3 . ?
CuJY Cu7Y Cu8Y 148.11(8) . . ?
Cu6Y Cu7Y Cu8Y 142.91(8) . . ?
CuKY Cu7Y Cu38 57.58(5) . . ?
Cu49 Cu7Y Cu38 59.36(4) . . ?
Cu2Y Cu7Y Cu38 150.41(7) 3 . ?
CuJY Cu7Y Cu38 89.23(6) . . ?
Cu6Y Cu7Y Cu38 119.28(6) . . ?
Cu8Y Cu7Y Cu38 60.79(5) . . ?
CuKY Cu7Y Cu39 89.89(6) . . ?
Cu49 Cu7Y Cu39 58.28(4) . . ?
Cu2Y Cu7Y Cu39 147.12(7) 3 . ?
CuJY Cu7Y Cu39 58.91(5) . . ?
Cu6Y Cu7Y Cu39 59.38(5) . . ?
Cu8Y Cu7Y Cu39 108.17(6) . . ?
Cu38 Cu7Y Cu39 59.90(4) . . ?
CuLY Cu8Y Cu49 117.05(7) . . ?
Cu3Y Cu8Y Cu49 115.61(7) 3 . ?
CuLY Cu8Y CuMY 62.13(6) . . ?
Cu3Y Cu8Y CuMY 117.59(7) 3 . ?
Cu49 Cu8Y CuMY 118.12(7) . . ?
CuLY Cu8Y Cu9Y 121.24(7) . . ?
Cu3Y Cu8Y Cu9Y 91.49(7) 3 . ?
Cu49 Cu8Y Cu9Y 90.81(6) . . ?
CuMY Cu8Y Cu9Y 59.11(6) . . ?
CuLY Cu8Y Cu7Y 90.00(7) . . ?
Cu3Y Cu8Y Cu7Y 88.57(7) 3 . ?
Cu49 Cu8Y Cu7Y 57.88(5) . . ?
CuMY Cu8Y Cu7Y 147.49(8) . . ?
Cu9Y Cu8Y Cu7Y 144.63(8) . . ?
CuLY Cu8Y Cu47 89.44(6) . . ?
Cu3Y Cu8Y Cu47 150.48(8) 3 . ?
Cu49 Cu8Y Cu47 58.88(4) . . ?
CuMY Cu8Y Cu47 59.24(5) . . ?
Cu9Y Cu8Y Cu47 60.97(5) . . ?
Cu7Y Cu8Y Cu47 107.52(6) . . ?
CuLY Cu8Y Cu38 58.20(5) . . ?
Cu3Y Cu8Y Cu38 146.67(8) 3 . ?
Cu49 Cu8Y Cu38 58.85(4) . . ?
CuMY Cu8Y Cu38 89.57(6) . . ?
Cu9Y Cu8Y Cu38 120.28(6) . . ?
Cu7Y Cu8Y Cu38 60.02(5) . . ?
Cu47 Cu8Y Cu38 59.31(4) . . ?
CuNY Cu9Y Cu53 117.15(7) . . ?
Cu4Y Cu9Y Cu53 115.70(7) 3 . ?
CuNY Cu9Y CuMY 62.33(7) . . ?
Cu4Y Cu9Y CuMY 115.56(8) 3 . ?
Cu53 Cu9Y CuMY 117.05(7) . . ?
CuNY Cu9Y CuAY 89.93(7) . . ?
Cu4Y Cu9Y CuAY 91.64(7) 3 . ?
Cu53 Cu9Y CuAY 59.01(5) . . ?
CuMY Cu9Y CuAY 147.59(8) . . ?
CuNY Cu9Y Cu8Y 121.89(8) . . ?
Cu4Y Cu9Y Cu8Y 87.80(7) 3 . ?
Cu53 Cu9Y Cu8Y 88.80(6) . . ?
CuMY Cu9Y Cu8Y 59.57(6) . . ?
CuAY Cu9Y Cu8Y 143.71(7) . . ?
CuNY Cu9Y Cu46 58.13(5) . . ?
Cu4Y Cu9Y Cu46 150.40(8) 3 . ?
Cu53 Cu9Y Cu46 59.02(4) . . ?
CuMY Cu9Y Cu46 89.64(6) . . ?
CuAY Cu9Y Cu46 60.02(5) . . ?
Cu8Y Cu9Y Cu46 119.74(7) . . ?
CuNY Cu9Y Cu47 89.72(6) . . ?
Cu4Y Cu9Y Cu47 146.07(7) 3 . ?
Cu53 Cu9Y Cu47 58.01(4) . . ?
CuMY Cu9Y Cu47 59.04(5) . . ?
CuAY Cu9Y Cu47 107.87(6) . . ?
Cu8Y Cu9Y Cu47 59.97(5) . . ?
Cu46 Cu9Y Cu47 59.77(4) . . ?
CuOY CuAY Cu53 118.21(8) . . ?
Cu5Y CuAY Cu53 114.26(7) 3 . ?
CuOY CuAY CuPY 62.42(7) . . ?
Cu5Y CuAY CuPY 117.13(8) 3 . ?
Cu53 CuAY CuPY 118.28(7) . . ?
CuOY CuAY Cu9Y 90.61(7) . . ?
Cu5Y CuAY Cu9Y 88.70(7) 3 . ?
Cu53 CuAY Cu9Y 58.45(5) . . ?
CuPY CuAY Cu9Y 148.49(8) . . ?
CuOY CuAY Cu1Y 121.67(8) . . ?
Cu5Y CuAY Cu1Y 89.90(7) 3 . ?
Cu53 CuAY Cu1Y 89.76(6) . . ?
CuPY CuAY Cu1Y 59.25(6) . . ?
Cu9Y CuAY Cu1Y 143.92(7) . . ?
CuOY CuAY Cu46 59.05(6) . . ?
Cu5Y CuAY Cu46 148.31(8) 3 . ?
Cu53 CuAY Cu46 59.17(4) . . ?
CuPY CuAY Cu46 89.80(6) . . ?
Cu9Y CuAY Cu46 60.93(5) . . ?
Cu1Y CuAY Cu46 119.64(7) . . ?
CuOY CuAY Cu45 91.06(6) . . ?
Cu5Y CuAY Cu45 147.42(7) 3 . ?
Cu53 CuAY Cu45 58.52(4) . . ?
CuPY CuAY Cu45 59.76(5) . . ?
Cu9Y CuAY Cu45 108.32(7) . . ?
Cu1Y CuAY Cu45 59.85(5) . . ?
Cu46 CuAY Cu45 59.80(4) . . ?
Cu1Y CuBY Cu44 64.45(6) . . ?
Cu1Y CuBY CuPY 60.96(6) . . ?
Cu44 CuBY CuPY 92.64(7) . . ?
Cu1Y CuBY CuCY 90.04(7) . . ?
Cu44 CuBY CuCY 57.86(6) . . ?
CuPY CuBY CuCY 146.64(9) . . ?
Cu1Y CuBY Cu33 90.46(7) . . ?
Cu44 CuBY Cu33 56.63(5) . . ?
CuPY CuBY Cu33 61.61(6) . . ?
CuCY CuBY Cu33 105.99(8) . . ?
Cu1Y CuBY Cu32 121.25(8) . . ?
Cu44 CuBY Cu32 56.80(4) . . ?
CuPY CuBY Cu32 119.73(8) . . ?
CuCY CuBY Cu32 59.56(6) . . ?
Cu33 CuBY Cu32 58.21(5) . . ?
Cu2Y CuCY Cu44 63.77(6) . . ?
Cu2Y CuCY CuDY 60.58(6) . . ?
Cu44 CuCY CuDY 90.88(7) . . ?
Cu2Y CuCY CuBY 89.13(7) . . ?
Cu44 CuCY CuBY 58.72(6) . . ?
CuDY CuCY CuBY 145.39(9) . . ?
Cu2Y CuCY Cu32 121.68(8) . . ?
Cu44 CuCY Cu32 57.92(5) . . ?
CuDY CuCY Cu32 118.01(8) . . ?
CuBY CuCY Cu32 61.99(6) . . ?
Cu2Y CuCY Cu31 89.86(7) . . ?
Cu44 CuCY Cu31 56.47(5) . . ?
CuDY CuCY Cu31 60.13(6) . . ?
CuBY CuCY Cu31 107.23(8) . . ?
Cu32 CuCY Cu31 58.00(5) . . ?
Cu2Y CuDY Cu43 62.69(6) . . ?
Cu2Y CuDY Cu3Y 61.70(6) . . ?
Cu43 CuDY Cu3Y 61.50(6) . . ?
Cu2Y CuDY CuEY 118.63(8) . . ?
Cu43 CuDY CuEY 87.66(7) . . ?
Cu3Y CuDY CuEY 56.92(6) . . ?
Cu2Y CuDY CuCY 57.20(6) . . ?
Cu43 CuDY CuCY 89.97(7) . . ?
Cu3Y CuDY CuCY 118.90(8) . . ?
CuEY CuDY CuCY 175.82(9) . . ?
Cu2Y CuDY Cu31 89.63(7) . . ?
Cu43 CuDY Cu31 56.54(4) . . ?
Cu3Y CuDY Cu31 118.04(8) . . ?
CuEY CuDY Cu31 118.23(8) . . ?
CuCY CuDY Cu31 62.93(6) . . ?
Cu2Y CuDY Cu30 118.71(8) . . ?
Cu43 CuDY Cu30 56.02(5) . . ?
Cu3Y CuDY Cu30 88.80(7) . . ?
CuEY CuDY Cu30 61.33(6) . . ?
CuCY CuDY Cu30 119.85(8) . . ?
Cu31 CuDY Cu30 56.95(5) . . ?
Cu3Y CuEY Cu42 65.35(6) . . ?
Cu3Y CuEY CuDY 61.14(6) . . ?
Cu42 CuEY CuDY 93.45(7) . . ?
Cu3Y CuEY CuFY 89.42(7) . . ?
Cu42 CuEY CuFY 56.99(6) . . ?
CuDY CuEY CuFY 146.22(9) . . ?
Cu3Y CuEY Cu30 91.35(7) . . ?
Cu42 CuEY Cu30 57.43(5) . . ?
CuDY CuEY Cu30 61.67(6) . . ?
CuFY CuEY Cu30 106.40(8) . . ?
Cu3Y CuEY Cu29 122.86(8) . . ?
Cu42 CuEY Cu29 57.53(5) . . ?
CuDY CuEY Cu29 119.41(8) . . ?
CuFY CuEY Cu29 61.19(6) . . ?
Cu30 CuEY Cu29 57.90(5) . . ?
Cu42 CuFY Cu4Y 64.85(5) . . ?
Cu42 CuFY CuGY 92.29(7) . . ?
Cu4Y CuFY CuGY 61.16(6) . . ?
Cu42 CuFY CuEY 58.34(6) . . ?
Cu4Y CuFY CuEY 89.34(7) . . ?
CuGY CuFY CuEY 146.28(8) . . ?
Cu42 CuFY Cu28 57.30(5) . . ?
Cu4Y CuFY Cu28 91.40(7) . . ?
CuGY CuFY Cu28 61.02(6) . . ?
CuEY CuFY Cu28 107.47(7) . . ?
Cu42 CuFY Cu29 57.73(4) . . ?
Cu4Y CuFY Cu29 122.58(7) . . ?
CuGY CuFY Cu29 119.95(8) . . ?
CuEY CuFY Cu29 60.73(6) . . ?
Cu28 CuFY Cu29 59.01(5) . . ?
Cu41 CuGY Cu5Y 62.06(5) . . ?
Cu41 CuGY Cu4Y 62.12(5) . . ?
Cu5Y CuGY Cu4Y 61.05(6) . . ?
Cu41 CuGY CuHY 87.60(6) . . ?
Cu5Y CuGY CuHY 56.96(6) . . ?
Cu4Y CuGY CuHY 117.99(7) . . ?
Cu41 CuGY CuFY 88.47(7) . . ?
Cu5Y CuGY CuFY 117.72(8) . . ?
Cu4Y CuGY CuFY 56.67(6) . . ?
CuHY CuGY CuFY 174.53(8) . . ?
Cu41 CuGY Cu27 56.39(4) . . ?
Cu5Y CuGY Cu27 89.71(6) . . ?
Cu4Y CuGY Cu27 118.50(7) . . ?
CuHY CuGY Cu27 61.36(6) . . ?
CuFY CuGY Cu27 119.13(7) . . ?
Cu41 CuGY Cu28 56.87(4) . . ?
Cu5Y CuGY Cu28 118.93(7) . . ?
Cu4Y CuGY Cu28 89.09(6) . . ?
CuHY CuGY Cu28 119.10(8) . . ?
CuFY CuGY Cu28 61.39(6) . . ?
Cu27 CuGY Cu28 57.81(4) . . ?
Cu40 CuHY Cu5Y 65.38(5) . . ?
Cu40 CuHY CuGY 92.90(7) . . ?
Cu5Y CuHY CuGY 60.94(6) . . ?
Cu40 CuHY CuIY 57.83(5) . . ?
Cu5Y CuHY CuIY 89.88(7) . . ?
CuGY CuHY CuIY 146.50(8) . . ?
Cu40 CuHY Cu26 57.04(4) . . ?
Cu5Y CuHY Cu26 122.42(7) . . ?
CuGY CuHY Cu26 119.71(7) . . ?
CuIY CuHY Cu26 60.48(6) . . ?
Cu40 CuHY Cu27 58.14(4) . . ?
Cu5Y CuHY Cu27 91.71(7) . . ?
CuGY CuHY Cu27 60.92(6) . . ?
CuIY CuHY Cu27 107.73(7) . . ?
Cu26 CuHY Cu27 58.84(5) . . ?
Cu6Y CuIY Cu40 64.99(6) . . ?
Cu6Y CuIY CuJY 61.08(6) . . ?
Cu40 CuIY CuJY 93.45(6) . . ?
Cu6Y CuIY CuHY 90.05(7) . . ?
Cu40 CuIY CuHY 57.60(5) . . ?
CuJY CuIY CuHY 146.97(8) . . ?
Cu6Y CuIY Cu26 121.96(7) . . ?
Cu40 CuIY Cu26 56.98(4) . . ?
CuJY CuIY Cu26 119.59(7) . . ?
CuHY CuIY Cu26 60.49(5) . . ?
Cu6Y CuIY Cu25 90.69(6) . . ?
Cu40 CuIY Cu25 57.95(4) . . ?
CuJY CuIY Cu25 60.86(5) . . ?
CuHY CuIY Cu25 107.48(7) . . ?
Cu26 CuIY Cu25 58.83(4) . . ?
Cu39 CuJY Cu7Y 62.14(5) . . ?
Cu39 CuJY Cu6Y 60.89(5) . . ?
Cu7Y CuJY Cu6Y 61.05(6) . . ?
Cu39 CuJY CuIY 87.30(6) . . ?
Cu7Y CuJY CuIY 117.64(8) . . ?
Cu6Y CuJY CuIY 56.59(6) . . ?
Cu39 CuJY CuKY 88.48(6) . . ?
Cu7Y CuJY CuKY 56.79(6) . . ?
Cu6Y CuJY CuKY 117.82(8) . . ?
CuIY CuJY CuKY 174.26(9) . . ?
Cu39 CuJY Cu24 56.98(4) . . ?
Cu7Y CuJY Cu24 89.12(6) . . ?
Cu6Y CuJY Cu24 117.87(7) . . ?
CuIY CuJY Cu24 119.17(7) . . ?
CuKY CuJY Cu24 61.20(5) . . ?
Cu39 CuJY Cu25 56.17(4) . . ?
Cu7Y CuJY Cu25 118.31(7) . . ?
Cu6Y CuJY Cu25 88.39(6) . . ?
CuIY CuJY Cu25 61.24(5) . . ?
CuKY CuJY Cu25 119.11(7) . . ?
Cu24 CuJY Cu25 58.00(4) . . ?
Cu38 CuKY Cu7Y 64.71(5) . . ?
Cu38 CuKY CuJY 92.05(6) . . ?
Cu7Y CuKY CuJY 60.61(6) . . ?
Cu38 CuKY CuLY 58.78(5) . . ?
Cu7Y CuKY CuLY 89.94(7) . . ?
CuJY CuKY CuLY 146.47(8) . . ?
Cu38 CuKY Cu23 57.82(4) . . ?
Cu7Y CuKY Cu23 122.53(7) . . ?
CuJY CuKY Cu23 120.04(7) . . ?
CuLY CuKY Cu23 60.65(5) . . ?
Cu38 CuKY Cu24 57.58(4) . . ?
Cu7Y CuKY Cu24 90.95(6) . . ?
CuJY CuKY Cu24 60.61(5) . . ?
CuLY CuKY Cu24 108.13(7) . . ?
Cu23 CuKY Cu24 59.50(4) . . ?
Cu8Y CuLY Cu38 64.61(5) . . ?
Cu8Y CuLY CuMY 60.72(6) . . ?
Cu38 CuLY CuMY 92.34(6) . . ?
Cu8Y CuLY CuKY 89.85(7) . . ?
Cu38 CuLY CuKY 57.38(5) . . ?
CuMY CuLY CuKY 145.92(8) . . ?
Cu8Y CuLY Cu23 121.87(7) . . ?
Cu38 CuLY Cu23 57.25(4) . . ?
CuMY CuLY Cu23 119.09(7) . . ?
CuKY CuLY Cu23 60.21(5) . . ?
Cu8Y CuLY Cu37 90.22(6) . . ?
Cu38 CuLY Cu37 57.39(4) . . ?
CuMY CuLY Cu37 60.34(5) . . ?
CuKY CuLY Cu37 106.71(7) . . ?
Cu23 CuLY Cu37 58.84(4) . . ?
Cu9Y CuMY Cu8Y 61.32(6) . . ?
Cu9Y CuMY Cu47 62.56(5) . . ?
Cu8Y CuMY Cu47 61.72(5) . . ?
Cu9Y CuMY CuNY 57.20(6) . . ?
Cu8Y CuMY CuNY 118.51(8) . . ?
Cu47 CuMY CuNY 88.87(6) . . ?
Cu9Y CuMY CuLY 118.47(7) . . ?
Cu8Y CuMY CuLY 57.15(6) . . ?
Cu47 CuMY CuLY 88.07(6) . . ?
CuNY CuMY CuLY 175.59(8) . . ?
Cu9Y CuMY Cu37 118.42(7) . . ?
Cu8Y CuMY Cu37 89.14(6) . . ?
Cu47 CuMY Cu37 55.85(4) . . ?
CuNY CuMY Cu37 118.61(7) . . ?
CuLY CuMY Cu37 61.91(6) . . ?
Cu9Y CuMY Cu36 88.38(6) . . ?
Cu8Y CuMY Cu36 118.07(7) . . ?
Cu47 CuMY Cu36 56.37(4) . . ?
CuNY CuMY Cu36 60.57(5) . . ?
CuLY CuMY Cu36 119.91(7) . . ?
Cu37 CuMY Cu36 58.07(4) . . ?
Cu9Y CuNY Cu46 64.62(5) . . ?
Cu9Y CuNY CuMY 60.47(6) . . ?
Cu46 CuNY CuMY 92.20(6) . . ?
Cu9Y CuNY CuOY 89.82(7) . . ?
Cu46 CuNY CuOY 58.69(6) . . ?
CuMY CuNY CuOY 146.38(8) . . ?
Cu9Y CuNY Cu36 90.83(6) . . ?
Cu46 CuNY Cu36 56.80(4) . . ?
CuMY CuNY Cu36 61.63(6) . . ?
CuOY CuNY Cu36 107.18(7) . . ?
Cu9Y CuNY Cu35 121.51(7) . . ?
Cu46 CuNY Cu35 56.89(4) . . ?
CuMY CuNY Cu35 120.28(7) . . ?
CuOY CuNY Cu35 60.10(6) . . ?
Cu36 CuNY Cu35 58.70(4) . . ?
CuAY CuOY Cu46 63.86(6) . . ?
CuAY CuOY CuPY 60.83(6) . . ?
Cu46 CuOY CuPY 91.56(7) . . ?
CuAY CuOY CuNY 89.63(7) . . ?
Cu46 CuOY CuNY 58.02(5) . . ?
CuPY CuOY CuNY 145.84(8) . . ?
CuAY CuOY Cu35 121.14(8) . . ?
Cu46 CuOY Cu35 57.31(4) . . ?
CuPY CuOY Cu35 117.12(7) . . ?
CuNY CuOY Cu35 61.80(6) . . ?
CuAY CuOY Cu34 89.25(6) . . ?
Cu46 CuOY Cu34 56.59(4) . . ?
CuPY CuOY Cu34 59.82(6) . . ?
CuNY CuOY Cu34 106.69(7) . . ?
Cu35 CuOY Cu34 57.46(4) . . ?
Cu1Y CuPY CuAY 61.43(6) . . ?
Cu1Y CuPY CuBY 56.95(6) . . ?
CuAY CuPY CuBY 118.39(8) . . ?
Cu1Y CuPY Cu45 61.17(5) . . ?
CuAY CuPY Cu45 61.57(5) . . ?
CuBY CuPY Cu45 88.27(7) . . ?
Cu1Y CuPY CuOY 118.19(8) . . ?
CuAY CuPY CuOY 56.75(6) . . ?
CuBY CuPY CuOY 175.14(8) . . ?
Cu45 CuPY CuOY 88.90(7) . . ?
Cu1Y CuPY Cu34 117.10(7) . . ?
CuAY CuPY Cu34 88.81(7) . . ?
CuBY CuPY Cu34 118.33(8) . . ?
Cu45 CuPY Cu34 55.93(4) . . ?
CuOY CuPY Cu34 62.91(6) . . ?
Cu1Y CuPY Cu33 88.13(6) . . ?
CuAY CuPY Cu33 117.77(7) . . ?
CuBY CuPY Cu33 61.39(6) . . ?
Cu45 CuPY Cu33 56.19(4) . . ?
CuOY CuPY Cu33 119.87(8) . . ?
Cu34 CuPY Cu33 57.00(4) . . ?
Cu8X Cu1X CuPX 97.54(7) 3 . ?
Cu45 Cu1X CuPX 61.68(5) 3 . ?
Cu8X Cu1X CuBX 98.12(8) 3 . ?
Cu45 Cu1X CuBX 61.46(5) 3 . ?
CuPX Cu1X CuBX 61.73(6) . . ?
Cu8X Cu1X CuAX 90.05(7) 3 . ?
Cu45 Cu1X CuAX 89.85(6) 3 . ?
CuPX Cu1X CuAX 59.55(6) . . ?
CuBX Cu1X CuAX 121.27(7) . . ?
Cu45 Cu1X Cu52 58.79(4) 3 3 ?
Cu45 Cu1X Cu53 59.14(4) 3 3 ?
Cu52 Cu1X Cu53 60.68(4) 3 3 ?
Cu8X Cu1X Cu6X 91.09(8) 3 . ?
Cu45 Cu1X Cu6X 89.75(6) 3 . ?
CuPX Cu1X Cu6X 121.80(7) . . ?
CuBX Cu1X Cu6X 60.08(6) . . ?
CuAX Cu1X Cu6X 178.08(8) . . ?
Cu52 Cu1X Cu6X 59.00(5) 3 . ?
Cu53 Cu1X Cu6X 119.68(6) 3 . ?
Cu45 Cu1X Cu4X 132.24(6) 3 3 ?
Cu52 Cu1X Cu4X 81.73(5) 3 3 ?
Cu53 Cu1X Cu4X 125.09(6) 3 3 ?
Cu45 Cu1X Cu3X 132.20(7) 3 3 ?
Cu52 Cu1X Cu3X 125.07(6) 3 3 ?
Cu53 Cu1X Cu3X 81.27(5) 3 3 ?
Cu9X Cu2X CuDX 98.05(8) 3 . ?
Cu43 Cu2X CuDX 61.38(5) 3 . ?
Cu9X Cu2X CuEX 100.39(8) 3 . ?
Cu43 Cu2X CuEX 62.58(5) 3 . ?
CuDX Cu2X CuEX 61.62(6) . . ?
Cu9X Cu2X Cu6X 88.00(8) 3 . ?
Cu43 Cu2X Cu6X 89.00(6) 3 . ?
CuDX Cu2X Cu6X 59.84(6) . . ?
CuEX Cu2X Cu6X 121.45(8) . . ?
Cu9X Cu2X Cu7X 92.91(7) 3 . ?
Cu43 Cu2X Cu7X 90.72(6) 3 . ?
CuDX Cu2X Cu7X 121.43(7) . . ?
CuEX Cu2X Cu7X 59.81(6) . . ?
Cu6X Cu2X Cu7X 178.28(8) . . ?
Cu43 Cu2X Cu51 58.76(4) 3 3 ?
Cu43 Cu2X Cu52 58.38(4) 3 3 ?
Cu51 Cu2X Cu52 59.65(4) 3 3 ?
Cu43 Cu2X Cu5X 133.63(7) 3 3 ?
Cu51 Cu2X Cu5X 82.08(5) 3 3 ?
Cu52 Cu2X Cu5X 123.58(6) 3 3 ?
Cu43 Cu2X Cu4X 129.95(6) 3 3 ?
Cu51 Cu2X Cu4X 122.83(6) 3 3 ?
Cu52 Cu2X Cu4X 79.48(5) 3 3 ?
CuAX Cu3X CuGX 100.30(8) 3 . ?
Cu41 Cu3X CuGX 62.27(5) 3 . ?
CuAX Cu3X CuHX 101.19(8) 3 . ?
Cu41 Cu3X CuHX 63.03(5) 3 . ?
CuGX Cu3X CuHX 61.06(7) . . ?
CuAX Cu3X Cu8X 91.39(8) 3 . ?
Cu41 Cu3X Cu8X 90.69(7) 3 . ?
CuGX Cu3X Cu8X 121.93(8) . . ?
CuHX Cu3X Cu8X 60.87(7) . . ?
CuAX Cu3X Cu7X 89.32(8) 3 . ?
Cu41 Cu3X Cu7X 89.34(6) 3 . ?
CuGX Cu3X Cu7X 59.91(6) . . ?
CuHX Cu3X Cu7X 120.98(8) . . ?
Cu8X Cu3X Cu7X 177.84(8) . . ?
Cu41 Cu3X Cu50 58.88(4) 3 3 ?
Cu41 Cu3X Cu51 58.09(4) 3 3 ?
Cu50 Cu3X Cu51 59.05(4) 3 3 ?
Cu41 Cu3X Cu1X 132.23(7) 3 3 ?
Cu50 Cu3X Cu1X 79.83(5) 3 3 ?
Cu51 Cu3X Cu1X 121.11(6) 3 3 ?
Cu41 Cu3X Cu5X 130.29(7) 3 3 ?
Cu50 Cu3X Cu5X 120.91(6) 3 3 ?
Cu51 Cu3X Cu5X 79.25(5) 3 3 ?
Cu6X Cu4X CuKX 98.98(8) 3 . ?
Cu39 Cu4X CuKX 62.58(6) 3 . ?
Cu6X Cu4X CuJX 101.14(8) 3 . ?
Cu39 Cu4X CuJX 63.49(6) 3 . ?
CuKX Cu4X CuJX 61.71(7) . . ?
Cu6X Cu4X Cu9X 88.45(7) 3 . ?
Cu39 Cu4X Cu9X 89.08(6) 3 . ?
CuKX Cu4X Cu9X 60.05(6) . . ?
CuJX Cu4X Cu9X 121.76(8) . . ?
Cu6X Cu4X Cu8X 92.37(8) 3 . ?
Cu39 Cu4X Cu8X 90.87(6) 3 . ?
CuKX Cu4X Cu8X 121.83(8) . . ?
CuJX Cu4X Cu8X 60.11(6) . . ?
Cu9X Cu4X Cu8X 177.75(9) . . ?
Cu39 Cu4X Cu50 58.78(4) 3 3 ?
Cu39 Cu4X Cu49 58.07(4) 3 3 ?
Cu50 Cu4X Cu49 59.69(4) 3 3 ?
Cu39 Cu4X Cu1X 132.69(7) 3 3 ?
Cu50 Cu4X Cu1X 80.20(5) 3 3 ?
Cu49 Cu4X Cu1X 121.62(7) 3 3 ?
Cu39 Cu4X Cu2X 129.66(6) 3 3 ?
Cu50 Cu4X Cu2X 121.28(6) 3 3 ?
Cu49 Cu4X Cu2X 78.66(5) 3 3 ?
Cu7X Cu5X CuNX 97.90(8) 3 . ?
Cu47 Cu5X CuNX 61.20(5) 3 . ?
Cu7X Cu5X CuMX 99.37(8) 3 . ?
Cu47 Cu5X CuMX 62.81(5) 3 . ?
CuNX Cu5X CuMX 61.46(7) . . ?
Cu7X Cu5X CuAX 88.79(8) 3 . ?
Cu47 Cu5X CuAX 88.89(6) 3 . ?
CuNX Cu5X CuAX 60.43(6) . . ?
CuMX Cu5X CuAX 121.89(7) . . ?
Cu47 Cu5X Cu49 59.32(4) 3 3 ?
Cu7X Cu5X Cu9X 92.45(8) 3 . ?
Cu47 Cu5X Cu9X 90.96(6) 3 . ?
CuNX Cu5X Cu9X 121.83(8) . . ?
CuMX Cu5X Cu9X 60.38(6) . . ?
CuAX Cu5X Cu9X 177.19(8) . . ?
Cu49 Cu5X Cu9X 59.41(5) 3 . ?
Cu47 Cu5X Cu53 58.41(4) 3 3 ?
Cu49 Cu5X Cu53 59.86(4) 3 3 ?
Cu47 Cu5X Cu2X 133.67(7) 3 3 ?
Cu49 Cu5X Cu2X 81.62(5) 3 3 ?
Cu53 Cu5X Cu2X 123.58(6) 3 3 ?
Cu47 Cu5X Cu3X 130.21(7) 3 3 ?
Cu49 Cu5X Cu3X 123.00(6) 3 3 ?
Cu53 Cu5X Cu3X 79.89(5) 3 3 ?
Cu4X Cu6X CuCX 137.67(9) 3 . ?
Cu4X Cu6X CuDX 124.12(8) 3 . ?
CuCX Cu6X CuDX 62.54(6) . . ?
Cu44 Cu6X CuDX 62.52(5) 3 . ?
Cu44 Cu6X Cu52 60.22(4) 3 3 ?
Cu4X Cu6X CuBX 119.94(8) 3 . ?
CuCX Cu6X CuBX 61.61(6) . . ?
Cu44 Cu6X CuBX 61.53(5) 3 . ?
CuDX Cu6X CuBX 114.33(7) . . ?
Cu52 Cu6X CuBX 89.58(6) 3 . ?
Cu4X Cu6X Cu2X 79.71(7) 3 . ?
CuCX Cu6X Cu2X 121.54(8) . . ?
Cu44 Cu6X Cu2X 92.23(6) 3 . ?
CuDX Cu6X Cu2X 59.00(6) . . ?
Cu52 Cu6X Cu2X 61.71(5) 3 . ?
CuBX Cu6X Cu2X 149.07(8) . . ?
Cu4X Cu6X Cu1X 76.58(7) 3 . ?
CuCX Cu6X Cu1X 120.20(7) . . ?
Cu44 Cu6X Cu1X 91.04(6) 3 . ?
CuDX Cu6X Cu1X 148.91(8) . . ?
Cu52 Cu6X Cu1X 60.39(5) 3 . ?
CuBX Cu6X Cu1X 58.59(6) . . ?
Cu2X Cu6X Cu1X 109.83(7) . . ?
Cu5X Cu7X CuFX 139.73(9) 3 . ?
Cu5X Cu7X CuEX 120.53(9) 3 . ?
CuFX Cu7X CuEX 61.93(7) . . ?
Cu42 Cu7X CuEX 61.40(5) 3 . ?
Cu5X Cu7X CuGX 124.23(9) 3 . ?
CuFX Cu7X CuGX 61.75(7) . . ?
Cu42 Cu7X CuGX 63.03(5) 3 . ?
CuEX Cu7X CuGX 114.03(7) . . ?
Cu5X Cu7X Cu2X 75.53(7) 3 . ?
CuFX Cu7X Cu2X 121.06(8) . . ?
Cu42 Cu7X Cu2X 90.46(6) 3 . ?
CuEX Cu7X Cu2X 59.13(6) . . ?
CuGX Cu7X Cu2X 148.93(8) . . ?
Cu5X Cu7X Cu3X 78.75(7) 3 . ?
CuFX Cu7X Cu3X 120.65(8) . . ?
Cu42 Cu7X Cu3X 91.84(7) 3 . ?
CuEX Cu7X Cu3X 149.04(8) . . ?
CuGX Cu7X Cu3X 58.90(6) . . ?
Cu2X Cu7X Cu3X 109.72(7) . . ?
Cu42 Cu7X Cu51 59.82(4) 3 3 ?
Cu1X Cu8X CuIX 140.48(9) 3 . ?
Cu1X Cu8X CuJX 122.22(9) 3 . ?
CuIX Cu8X CuJX 61.85(7) . . ?
Cu40 Cu8X CuJX 62.36(6) 3 . ?
Cu1X Cu8X Cu3X 77.49(7) 3 . ?
CuIX Cu8X Cu3X 119.79(8) . . ?
Cu40 Cu8X Cu3X 90.59(6) 3 . ?
CuJX Cu8X Cu3X 149.35(8) . . ?
Cu1X Cu8X Cu4X 76.46(7) 3 . ?
CuIX Cu8X Cu4X 121.02(9) . . ?
Cu40 Cu8X Cu4X 90.57(6) 3 . ?
CuJX Cu8X Cu4X 59.17(6) . . ?
Cu3X Cu8X Cu4X 110.68(7) . . ?
Cu1X Cu8X CuHX 123.25(9) 3 . ?
CuIX Cu8X CuHX 60.73(7) . . ?
Cu40 Cu8X CuHX 62.54(5) 3 . ?
CuJX Cu8X CuHX 113.29(8) . . ?
Cu3X Cu8X CuHX 59.06(6) . . ?
Cu4X Cu8X CuHX 149.46(8) . . ?
Cu40 Cu8X Cu50 59.37(4) 3 3 ?
Cu2X Cu9X CuLX 138.45(9) 3 . ?
Cu2X Cu9X CuKX 124.80(9) 3 . ?
CuLX Cu9X CuKX 61.50(7) . . ?
Cu38 Cu9X CuKX 63.69(6) 3 . ?
Cu38 Cu9X Cu49 60.02(4) 3 3 ?
Cu2X Cu9X Cu4X 79.58(7) 3 . ?
CuLX Cu9X Cu4X 120.80(9) . . ?
Cu38 Cu9X Cu4X 92.46(6) 3 . ?
CuKX Cu9X Cu4X 59.31(6) . . ?
Cu49 Cu9X Cu4X 61.85(5) 3 . ?
Cu2X Cu9X CuMX 119.89(9) 3 . ?
CuLX Cu9X CuMX 61.71(7) . . ?
Cu38 Cu9X CuMX 60.98(5) 3 . ?
CuKX Cu9X CuMX 113.71(8) . . ?
Cu49 Cu9X CuMX 90.28(6) 3 . ?
Cu4X Cu9X CuMX 149.53(8) . . ?
Cu2X Cu9X Cu5X 75.78(7) 3 . ?
CuLX Cu9X Cu5X 120.56(8) . . ?
Cu38 Cu9X Cu5X 89.83(6) 3 . ?
CuKX Cu9X Cu5X 149.47(8) . . ?
Cu49 Cu9X Cu5X 60.29(5) 3 . ?
Cu4X Cu9X Cu5X 110.46(7) . . ?
CuMX Cu9X Cu5X 58.85(6) . . ?
Cu3X CuAX CuOX 137.37(9) 3 . ?
Cu46 CuAX Cu53 60.43(4) 3 3 ?
Cu3X CuAX CuPX 120.82(9) 3 . ?
CuOX CuAX CuPX 63.08(7) . . ?
Cu46 CuAX CuPX 61.14(5) 3 . ?
Cu53 CuAX CuPX 90.24(6) 3 . ?
Cu3X CuAX CuNX 123.03(9) 3 . ?
CuOX CuAX CuNX 60.60(7) . . ?
Cu46 CuAX CuNX 62.97(5) 3 . ?
Cu53 CuAX CuNX 90.57(6) 3 . ?
CuPX CuAX CuNX 114.24(7) . . ?
Cu3X CuAX Cu5X 79.41(7) 3 . ?
CuOX CuAX Cu5X 119.37(9) . . ?
Cu46 CuAX Cu5X 92.63(6) 3 . ?
Cu53 CuAX Cu5X 61.51(5) 3 . ?
CuPX CuAX Cu5X 149.40(8) . . ?
CuNX CuAX Cu5X 58.78(6) . . ?
Cu3X CuAX Cu1X 77.49(7) 3 . ?
CuOX CuAX Cu1X 122.08(8) . . ?
Cu46 CuAX Cu1X 91.03(6) 3 . ?
Cu53 CuAX Cu1X 60.88(5) 3 . ?
CuPX CuAX Cu1X 59.01(6) . . ?
CuNX CuAX Cu1X 149.23(8) . . ?
Cu5X CuAX Cu1X 110.09(7) . . ?
Cu33 CuBX Cu1X 117.82(8) 3 . ?
Cu33 CuBX Cu6X 116.25(7) 3 . ?
Cu1X CuBX Cu6X 61.33(6) . . ?
Cu33 CuBX Cu45 58.82(4) 3 3 ?
Cu33 CuBX CuCX 90.11(6) 3 . ?
Cu1X CuBX CuCX 118.59(7) . . ?
Cu6X CuBX CuCX 57.26(6) . . ?
Cu45 CuBX CuCX 118.96(7) 3 . ?
Cu33 CuBX CuPX 90.91(6) 3 . ?
Cu1X CuBX CuPX 59.11(6) . . ?
Cu6X CuBX CuPX 120.44(7) . . ?
Cu45 CuBX CuPX 59.99(5) 3 . ?
CuCX CuBX CuPX 177.69(8) . . ?
Cu33 CuBX Cu44 58.01(4) 3 3 ?
Cu45 CuBX Cu44 61.18(4) 3 3 ?
Cu44 CuCX Cu32 59.64(5) 3 3 ?
Cu6X CuCX CuBX 61.12(6) . . ?
Cu44 CuCX CuBX 61.51(6) 3 . ?
Cu32 CuCX CuBX 91.38(7) 3 . ?
Cu6X CuCX CuDX 60.23(6) . . ?
Cu44 CuCX CuDX 61.87(6) 3 . ?
Cu32 CuCX CuDX 90.43(7) 3 . ?
CuBX CuCX CuDX 112.02(8) . . ?
Cu2X CuDX Cu6X 61.16(6) . . ?
Cu31 CuDX Cu6X 115.95(7) 3 . ?
Cu31 CuDX Cu43 58.27(4) 3 3 ?
Cu2X CuDX CuEX 59.39(6) . . ?
Cu31 CuDX CuEX 91.04(7) 3 . ?
Cu6X CuDX CuEX 120.56(8) . . ?
Cu43 CuDX CuEX 61.09(6) 3 . ?
Cu2X CuDX CuCX 118.40(7) . . ?
Cu31 CuDX CuCX 90.05(6) 3 . ?
Cu6X CuDX CuCX 57.24(6) . . ?
Cu43 CuDX CuCX 118.03(7) 3 . ?
CuEX CuDX CuCX 177.79(8) . . ?
Cu31 CuDX Cu44 57.82(4) 3 3 ?
Cu43 CuDX Cu44 60.84(4) 3 3 ?
Cu30 CuEX Cu2X 115.94(7) 3 . ?
Cu30 CuEX Cu7X 117.04(8) 3 . ?
Cu2X CuEX Cu7X 61.05(6) . . ?
Cu30 CuEX CuFX 92.06(7) 3 . ?
Cu2X CuEX CuFX 118.56(8) . . ?
Cu7X CuEX CuFX 57.50(6) . . ?
Cu30 CuEX Cu42 58.51(5) 3 3 ?
Cu30 CuEX CuDX 88.62(6) 3 . ?
Cu2X CuEX CuDX 58.99(6) . . ?
Cu7X CuEX CuDX 120.04(7) . . ?
CuFX CuEX CuDX 177.45(9) . . ?
Cu42 CuEX CuDX 119.89(7) 3 . ?
Cu30 CuEX Cu43 57.52(4) 3 3 ?
Cu42 CuEX Cu43 60.76(5) 3 3 ?
Cu29 CuFX Cu42 59.34(5) 3 3 ?
Cu7X CuFX CuGX 60.72(6) . . ?
Cu29 CuFX CuGX 92.57(8) 3 . ?
Cu42 CuFX CuGX 62.46(6) 3 . ?
Cu7X CuFX CuEX 60.57(6) . . ?
Cu29 CuFX CuEX 88.58(7) 3 . ?
Cu42 CuFX CuEX 60.74(6) 3 . ?
CuGX CuFX CuEX 112.04(8) . . ?
Cu28 CuGX Cu3X 116.99(8) 3 . ?
Cu28 CuGX Cu7X 115.08(7) 3 . ?
Cu3X CuGX Cu7X 61.19(6) . . ?
Cu28 CuGX CuHX 91.32(7) 3 . ?
Cu3X CuGX CuHX 59.66(6) . . ?
Cu7X CuGX CuHX 120.85(8) . . ?
Cu28 CuGX CuFX 89.51(7) 3 . ?
Cu3X CuGX CuFX 118.72(8) . . ?
Cu7X CuGX CuFX 57.53(6) . . ?
CuHX CuGX CuFX 178.38(8) . . ?
Cu28 CuGX Cu41 58.40(4) 3 3 ?
Cu28 CuGX Cu42 57.34(4) 3 3 ?
Cu41 CuGX Cu42 60.25(4) 3 3 ?
Cu27 CuHX Cu3X 115.45(7) 3 . ?
Cu27 CuHX CuIX 91.92(8) 3 . ?
Cu3X CuHX CuIX 117.25(8) . . ?
Cu27 CuHX CuGX 89.38(7) 3 . ?
Cu3X CuHX CuGX 59.27(6) . . ?
CuIX CuHX CuGX 176.48(8) . . ?
Cu27 CuHX Cu8X 115.71(8) 3 . ?
Cu3X CuHX Cu8X 60.07(6) . . ?
CuIX CuHX Cu8X 57.18(7) . . ?
CuGX CuHX Cu8X 119.33(8) . . ?
Cu27 CuHX Cu41 57.41(4) 3 3 ?
Cu27 CuHX Cu40 58.37(5) 3 3 ?
Cu41 CuHX Cu40 59.42(4) 3 3 ?
Cu8X CuIX CuHX 62.09(7) . . ?
Cu26 CuIX CuHX 90.00(8) 3 . ?
Cu26 CuIX Cu40 58.03(5) 3 3 ?
Cu8X CuIX CuJX 61.08(7) . . ?
Cu26 CuIX CuJX 88.66(7) 3 . ?
CuHX CuIX CuJX 113.78(8) . . ?
Cu40 CuIX CuJX 61.55(6) 3 . ?
Cu25 CuJX Cu4X 114.96(7) 3 . ?
Cu25 CuJX Cu8X 116.25(8) 3 . ?
Cu4X CuJX Cu8X 60.72(6) . . ?
Cu25 CuJX CuIX 92.52(7) 3 . ?
Cu4X CuJX CuIX 117.78(9) . . ?
Cu8X CuJX CuIX 57.07(7) . . ?
Cu25 CuJX CuKX 88.66(7) 3 . ?
Cu4X CuJX CuKX 59.13(6) . . ?
Cu8X CuJX CuKX 119.85(8) . . ?
CuIX CuJX CuKX 176.89(10) . . ?
Cu25 CuJX Cu40 58.46(5) 3 3 ?
Cu25 CuJX Cu39 57.25(4) 3 3 ?
Cu40 CuJX Cu39 60.00(4) 3 3 ?
Cu24 CuKX Cu4X 116.58(8) 3 . ?
Cu24 CuKX Cu9X 114.63(8) 3 . ?
Cu4X CuKX Cu9X 60.64(6) . . ?
Cu24 CuKX CuLX 89.82(7) 3 . ?
Cu4X CuKX CuLX 118.19(9) . . ?
Cu9X CuKX CuLX 57.55(6) . . ?
Cu24 CuKX CuJX 91.39(7) 3 . ?
Cu4X CuKX CuJX 59.15(6) . . ?
Cu9X CuKX CuJX 119.78(9) . . ?
CuLX CuKX CuJX 177.33(10) . . ?
Cu24 CuKX Cu39 58.43(5) 3 3 ?
Cu24 CuKX Cu38 57.42(4) 3 3 ?
Cu39 CuKX Cu38 59.81(4) 3 3 ?
Cu23 CuLX Cu38 58.78(5) 3 3 ?
Cu9X CuLX CuKX 60.95(7) . . ?
Cu23 CuLX CuKX 92.07(7) 3 . ?
Cu38 CuLX CuKX 63.03(6) 3 . ?
Cu9X CuLX CuMX 61.15(6) . . ?
Cu23 CuLX CuMX 87.74(7) 3 . ?
Cu38 CuLX CuMX 60.34(6) 3 . ?
CuKX CuLX CuMX 112.79(8) . . ?
Cu37 CuMX Cu5X 115.45(7) 3 . ?
Cu37 CuMX Cu9X 117.35(7) 3 . ?
Cu5X CuMX Cu9X 60.77(6) . . ?
Cu37 CuMX Cu38 59.21(4) 3 3 ?
Cu37 CuMX CuNX 87.51(7) 3 . ?
Cu5X CuMX CuNX 59.17(6) . . ?
Cu9X CuMX CuNX 119.93(8) . . ?
Cu38 CuMX CuNX 119.31(7) 3 . ?
Cu37 CuMX CuLX 93.37(7) 3 . ?
Cu5X CuMX CuLX 117.91(8) . . ?
Cu9X CuMX CuLX 57.14(6) . . ?
Cu38 CuMX CuLX 58.98(6) 3 . ?
CuNX CuMX CuLX 176.99(9) . . ?
Cu37 CuMX Cu47 57.16(4) 3 3 ?
Cu38 CuMX Cu47 60.35(4) 3 3 ?
Cu36 CuNX Cu5X 118.15(7) 3 . ?
Cu36 CuNX CuOX 88.16(7) 3 . ?
Cu5X CuNX CuOX 118.65(9) . . ?
Cu36 CuNX Cu47 59.03(4) 3 3 ?
Cu36 CuNX CuAX 114.47(7) 3 . ?
Cu5X CuNX CuAX 60.79(6) . . ?
CuOX CuNX CuAX 57.86(6) . . ?
Cu47 CuNX CuAX 87.98(6) 3 . ?
Cu36 CuNX CuMX 93.03(7) 3 . ?
Cu5X CuNX CuMX 59.36(6) . . ?
CuOX CuNX CuMX 178.01(9) . . ?
Cu47 CuNX CuMX 61.40(5) 3 . ?
CuAX CuNX CuMX 120.16(7) . . ?
Cu36 CuNX Cu46 57.06(4) 3 3 ?
Cu47 CuNX Cu46 60.88(4) 3 3 ?
Cu46 CuOX Cu35 59.43(4) 3 3 ?
CuAX CuOX CuNX 61.54(6) . . ?
Cu46 CuOX CuNX 63.57(6) 3 . ?
Cu35 CuOX CuNX 94.04(7) 3 . ?
CuAX CuOX CuPX 59.63(6) . . ?
Cu46 CuOX CuPX 60.21(5) 3 . ?
Cu35 CuOX CuPX 88.06(7) 3 . ?
CuNX CuOX CuPX 112.16(7) . . ?
Cu1X CuPX CuAX 61.44(6) . . ?
Cu34 CuPX CuAX 117.70(8) 3 . ?
Cu34 CuPX Cu46 58.88(4) 3 3 ?
Cu34 CuPX Cu45 57.88(4) 3 3 ?
Cu46 CuPX Cu45 61.31(4) 3 3 ?
Cu1X CuPX CuBX 59.16(6) . . ?
Cu34 CuPX CuBX 88.72(6) 3 . ?
CuAX CuPX CuBX 120.60(7) . . ?
Cu46 CuPX CuBX 120.99(7) 3 . ?
Cu45 CuPX CuBX 59.69(5) 3 . ?
Cu1X CuPX CuOX 118.73(8) . . ?
Cu34 CuPX CuOX 91.55(7) 3 . ?
CuAX CuPX CuOX 57.30(6) . . ?
Cu46 CuPX CuOX 57.36(6) 3 . ?
Cu45 CuPX CuOX 118.61(8) 3 . ?
CuBX CuPX CuOX 177.67(9) . . ?
C307 Cu91 Cu25 116.2(5) . . ?
C307 Cu91 Cu24 147.0(6) . . ?
Cu25 Cu91 Cu24 62.93(13) . . ?
C507 Cu92 C506 33.2(11) . . ?
C309 Cu94 C308 38.9(8) . . ?
C309 Cu94 C304 37.3(7) . . ?
C308 Cu94 C304 64.7(9) . . ?
C309 Cu94 Cu25 145.0(15) . . ?
C308 Cu94 Cu25 137.0(16) . . ?
C304 Cu94 Cu25 108.5(13) . . ?
C309 Cu94 Cu26 109.7(12) . . ?
C308 Cu94 Cu26 148.3(13) . . ?
C304 Cu94 Cu26 86.2(9) . . ?
Cu25 Cu94 Cu26 62.3(7) . . ?
Cu24 Cu95 Cu23 64.31(18) . . ?

loop_
_geom_torsion_atom_site_label_1
_geom_torsion_atom_site_label_2
_geom_torsion_atom_site_label_3
_geom_torsion_atom_site_label_4
_geom_torsion
_geom_torsion_site_symmetry_1
_geom_torsion_site_symmetry_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion_publ_flag
N101 C102 C103 N102 -0.8(13) . . . . ?
C109 C104 C105 C106 3.4(12) . . . . ?
N101 C104 C105 C106 -169.5(8) . . . . ?
C109 C104 C105 C110 -178.3(8) . . . . ?
N101 C104 C105 C110 8.8(11) . . . . ?
C104 C105 C106 C107 -1.7(14) . . . . ?
C110 C105 C106 C107 180.0(9) . . . . ?
C105 C106 C107 C108 -1.2(16) . . . . ?
C106 C107 C108 C109 2.5(15) . . . . ?
C105 C104 C109 C108 -2.2(11) . . . . ?
N101 C104 C109 C108 170.8(7) . . . . ?
C105 C104 C109 C113 173.8(7) . . . . ?
N101 C104 C109 C113 -13.3(10) . . . . ?
C107 C108 C109 C104 -0.9(12) . . . . ?
C107 C108 C109 C113 -176.9(8) . . . . ?
C106 C105 C110 C112 97.5(12) . . . . ?
C104 C105 C110 C112 -80.7(11) . . . . ?
C106 C105 C110 C111 -29.9(13) . . . . ?
C104 C105 C110 C111 151.9(8) . . . . ?
C104 C109 C113 C114 -85.6(12) . . . . ?
C108 C109 C113 C114 90.3(12) . . . . ?
C104 C109 C113 C115 146.6(10) . . . . ?
C108 C109 C113 C115 -37.5(13) . . . . ?
C121 C116 C117 C118 5.0(12) . . . . ?
N102 C116 C117 C118 -174.3(7) . . . . ?
C121 C116 C117 C122 -175.6(8) . . . . ?
N102 C116 C117 C122 5.1(12) . . . . ?
C116 C117 C118 C119 -3.2(12) . . . . ?
C122 C117 C118 C119 177.4(8) . . . . ?
C117 C118 C119 C120 -0.1(14) . . . . ?
C118 C119 C120 C121 2.0(14) . . . . ?
C119 C120 C121 C116 -0.3(12) . . . . ?
C119 C120 C121 C125 -176.7(8) . . . . ?
C117 C116 C121 C120 -3.3(12) . . . . ?
N102 C116 C121 C120 176.0(7) . . . . ?
C117 C116 C121 C125 173.0(7) . . . . ?
N102 C116 C121 C125 -7.7(11) . . . . ?
C118 C117 C122 C123 29.9(13) . . . . ?
C116 C117 C122 C123 -149.5(9) . . . . ?
C118 C117 C122 C124 -94.1(12) . . . . ?
C116 C117 C122 C124 86.5(12) . . . . ?
C120 C121 C125 C126 -50.3(13) . . . . ?
C116 C121 C125 C126 133.5(11) . . . . ?
C120 C121 C125 C127 76.1(12) . . . . ?
C116 C121 C125 C127 -100.1(11) . . . . ?
N201 C202 C203 N202 0.4(13) . . . . ?
C209 C204 C205 C206 -0.4(18) . . . . ?
N201 C204 C205 C206 178.5(11) . . . . ?
C209 C204 C205 C210 -175.8(12) . . . . ?
N201 C204 C205 C210 3.1(17) . . . . ?
C204 C205 C206 C207 3(2) . . . . ?
C210 C205 C206 C207 178.3(14) . . . . ?
C205 C206 C207 C208 -3(3) . . . . ?
C206 C207 C208 C209 1(3) . . . . ?
C207 C208 C209 C204 1(2) . . . . ?
C207 C208 C209 C213 179.7(14) . . . . ?
C205 C204 C209 C208 -1.8(18) . . . . ?
N201 C204 C209 C208 179.2(11) . . . . ?
C205 C204 C209 C213 179.8(11) . . . . ?
N201 C204 C209 C213 0.8(15) . . . . ?
C206 C205 C210 C212 -89.1(19) . . . . ?
C204 C205 C210 C212 86.3(19) . . . . ?
C206 C205 C210 C211 34(2) . . . . ?
C204 C205 C210 C211 -150.8(13) . . . . ?
C208 C209 C213 C214 -98.5(17) . . . . ?
C204 C209 C213 C214 79.9(17) . . . . ?
C208 C209 C213 C215 27(2) . . . . ?
C204 C209 C213 C215 -154.7(13) . . . . ?
C221 C216 C217 C218 3.0(17) . . . . ?
N202 C216 C217 C218 -175.2(9) . . . . ?
C221 C216 C217 C222 -178.9(11) . . . . ?
N202 C216 C217 C222 3.0(15) . . . . ?
C216 C217 C218 C219 -1.5(18) . . . . ?
C222 C217 C218 C219 -179.6(12) . . . . ?
C217 C218 C219 C220 0.0(19) . . . . ?
C218 C219 C220 C221 0.2(18) . . . . ?
C217 C216 C221 C220 -2.7(15) . . . . ?
N202 C216 C221 C220 175.4(8) . . . . ?
C217 C216 C221 C225 178.6(10) . . . . ?
N202 C216 C221 C225 -3.3(14) . . . . ?
C219 C220 C221 C216 1.0(15) . . . . ?
C219 C220 C221 C225 179.8(10) . . . . ?
C216 C217 C222 C223 -123.9(13) . . . . ?
C218 C217 C222 C223 54.3(17) . . . . ?
C216 C217 C222 C224 112.6(13) . . . . ?
C218 C217 C222 C224 -69.3(17) . . . . ?
C216 C221 C225 C226 162.8(11) . . . . ?
C220 C221 C225 C226 -16.0(14) . . . . ?
C216 C221 C225 C227 -77.3(14) . . . . ?
C220 C221 C225 C227 104.0(13) . . . . ?
N301 C302 C303 N302 5(2) . . . . ?
C309 C304 C305 C306 2(2) . . . . ?
N301 C304 C305 C306 -171.9(12) . . . . ?
Cu94 C304 C305 C306 -54.6(16) . . . . ?
C309 C304 C305 C310 -175.1(12) . . . . ?
N301 C304 C305 C310 11.3(16) . . . . ?
Cu94 C304 C305 C310 128.6(13) . . . . ?
C304 C305 C306 C307 1(2) . . . . ?
C310 C305 C306 C307 178.0(15) . . . . ?
C305 C306 C307 C308 -1(3) . . . . ?
C305 C306 C307 Cu91 103.8(17) . . . . ?
C306 C307 C308 C309 -1(3) . . . . ?
Cu91 C307 C308 C309 -95.1(18) . . . . ?
C306 C307 C308 Cu94 62(2) . . . . ?
C306 C307 C308 Cu93 133.0(18) . . . 3 ?
C307 C308 C309 C304 4(2) . . . . ?
Cu94 C308 C309 C304 -74.0(15) . . . . ?
Cu93 C308 C309 C304 -117.2(17) 3 . . . ?
C307 C308 C309 C313 -178.9(16) . . . . ?
Cu94 C308 C309 C313 102.9(16) . . . . ?
Cu93 C308 C309 C313 59.8(19) 3 . . . ?
C307 C308 C309 Cu94 78.1(19) . . . . ?
C305 C304 C309 C308 -4(2) . . . . ?
N301 C304 C309 C308 168.9(12) . . . . ?
Cu94 C304 C309 C308 69.4(14) . . . . ?
C305 C304 C309 C313 178.6(12) . . . . ?
N301 C304 C309 C313 -8.1(17) . . . . ?
Cu94 C304 C309 C313 -107.7(15) . . . . ?
C305 C304 C309 Cu94 -73.7(15) . . . . ?
N301 C304 C309 Cu94 99.6(13) . . . . ?
C306 C305 C310 C312 -48.2(19) . . . . ?
C304 C305 C310 C312 128.4(13) . . . . ?
C306 C305 C310 C311 74.1(19) . . . . ?
C304 C305 C310 C311 -109.3(14) . . . . ?
C308 C309 C313 C314 -18(2) . . . . ?
C304 C309 C313 C314 158.7(15) . . . . ?
Cu94 C309 C313 C314 65.7(19) . . . . ?
C308 C309 C313 C315 114(2) . . . . ?
C304 C309 C313 C315 -69(2) . . . . ?
Cu94 C309 C313 C315 -162.0(18) . . . . ?
C321 C316 C317 C318 0.3(16) . . . . ?
N302 C316 C317 C318 -174.3(10) . . . . ?
C321 C316 C317 C322 -179.6(10) . . . . ?
N302 C316 C317 C322 5.8(13) . . . . ?
C316 C317 C318 C319 -1(2) . . . . ?
C322 C317 C318 C319 179.2(14) . . . . ?
C317 C318 C319 C320 0(3) . . . . ?
C318 C319 C320 C321 1(3) . . . . ?
C317 C316 C321 C320 0.8(18) . . . . ?
N302 C316 C321 C320 175.1(11) . . . . ?
C317 C316 C321 C325 -178.1(9) . . . . ?
N302 C316 C321 C325 -3.8(15) . . . . ?
C319 C320 C321 C316 -2(2) . . . . ?
C319 C320 C321 C325 177.2(14) . . . . ?
C318 C317 C322 C323 56.1(16) . . . . ?
C316 C317 C322 C323 -124.0(13) . . . . ?
C318 C317 C322 C324 -69.0(16) . . . . ?
C316 C317 C322 C324 110.9(13) . . . . ?
C316 C321 C325 C327 -74.7(17) . . . . ?
C320 C321 C325 C327 107(2) . . . . ?
C316 C321 C325 C326 164.3(11) . . . . ?
C320 C321 C325 C326 -14.5(18) . . . . ?
N401 C402 C403 N402 -2.8(11) . . . . ?
C409 C404 C405 C406 4.8(11) . . . . ?
N401 C404 C405 C406 -179.6(6) . . . . ?
C409 C404 C405 C410 -174.5(7) . . . . ?
N401 C404 C405 C410 1.1(10) . . . . ?
C404 C405 C406 C407 -2.1(11) . . . . ?
C410 C405 C406 C407 177.1(7) . . . . ?
C405 C406 C407 C408 0.1(12) . . . . ?
C406 C407 C408 C409 -0.3(13) . . . . ?
C405 C404 C409 C408 -5.0(12) . . . . ?
N401 C404 C409 C408 179.4(7) . . . . ?
C405 C404 C409 C413 173.8(8) . . . . ?
N401 C404 C409 C413 -1.8(11) . . . . ?
C407 C408 C409 C404 2.7(12) . . . . ?
C407 C408 C409 C413 -176.1(8) . . . . ?
C406 C405 C410 C411 16.5(11) . . . . ?
C404 C405 C410 C411 -164.3(7) . . . . ?
C406 C405 C410 C412 -103.7(9) . . . . ?
C404 C405 C410 C412 75.5(10) . . . . ?
C404 C409 C413 C414 90.9(13) . . . . ?
C408 C409 C413 C414 -90.4(13) . . . . ?
C404 C409 C413 C415 -134.9(10) . . . . ?
C408 C409 C413 C415 43.8(13) . . . . ?
C421 C416 C417 C418 -0.3(12) . . . . ?
N402 C416 C417 C418 174.0(7) . . . . ?
C421 C416 C417 C422 -176.7(8) . . . . ?
N402 C416 C417 C422 -2.4(12) . . . . ?
C416 C417 C418 C419 0.3(14) . . . . ?
C422 C417 C418 C419 176.8(10) . . . . ?
C417 C418 C419 C420 0.5(17) . . . . ?
C418 C419 C420 C421 -1.3(17) . . . . ?
C417 C416 C421 C420 -0.5(13) . . . . ?
N402 C416 C421 C420 -174.8(8) . . . . ?
C417 C416 C421 C425 -179.7(9) . . . . ?
N402 C416 C421 C425 5.9(12) . . . . ?
C419 C420 C421 C416 1.3(15) . . . . ?
C419 C420 C421 C425 -179.5(10) . . . . ?
C416 C417 C422 C423 -123.9(10) . . . . ?
C418 C417 C422 C423 59.8(13) . . . . ?
C416 C417 C422 C424 110.1(12) . . . . ?
C418 C417 C422 C424 -66.2(14) . . . . ?
C416 C421 C425 C426 136.6(15) . . . . ?
C420 C421 C425 C426 -42.7(18) . . . . ?
C416 C421 C425 C427 -94.7(16) . . . . ?
C420 C421 C425 C427 86.1(18) . . . . ?
N501 C502 C503 N502 -0.1(12) . . . . ?
C509 C504 C505 C506 -3(2) . . . . ?
N501 C504 C505 C506 -176.7(14) . . . . ?
C509 C504 C505 C510 175.1(16) . . . . ?
N501 C504 C505 C510 1(2) . . . . ?
C504 C505 C506 C507 -5(3) . . . . ?
C510 C505 C506 C507 177(2) . . . . ?
C504 C505 C506 Cu92 -58(3) . . . . ?
C510 C505 C506 Cu92 124(2) . . . . ?
C505 C506 C507 C508 10(3) . . . . ?
Cu92 C506 C507 C508 138(2) . . . . ?
C505 C506 C507 Cu92 -128(2) . . . . ?
C506 C507 C508 C509 -8(3) . . . . ?
Cu92 C507 C508 C509 123.7(16) . . . . ?
C507 C508 C509 C504 0.1(19) . . . . ?
C507 C508 C509 C513 -177.6(14) . . . . ?
C505 C504 C509 C508 5.2(18) . . . . ?
N501 C504 C509 C508 178.8(9) . . . . ?
C505 C504 C509 C513 -177.0(13) . . . . ?
N501 C504 C509 C513 -3.5(16) . . . . ?
C504 C505 C510 C511 101(2) . . . . ?
C506 C505 C510 C511 -81(3) . . . . ?
C504 C505 C510 C512 -129.1(15) . . . . ?
C506 C505 C510 C512 49(3) . . . . ?
C508 C509 C513 C515 -105.8(16) . . . . ?
C504 C509 C513 C515 76.6(17) . . . . ?
C508 C509 C513 C514 18(2) . . . . ?
C504 C509 C513 C514 -159.9(12) . . . . ?
C521 C516 C517 C518 0.6(16) . . . . ?
N502 C516 C517 C518 -174.1(9) . . . . ?
C521 C516 C517 C522 176.2(11) . . . . ?
N502 C516 C517 C522 1.5(14) . . . . ?
C516 C517 C518 C519 -1.2(18) . . . . ?
C522 C517 C518 C519 -177.0(13) . . . . ?
C517 C518 C519 C520 2(3) . . . . ?
C518 C519 C520 C521 -2(3) . . . . ?
C519 C520 C521 C516 1(3) . . . . ?
C519 C520 C521 C525 178.6(17) . . . . ?
C517 C516 C521 C520 -0.4(19) . . . . ?
N502 C516 C521 C520 174.2(12) . . . . ?
C517 C516 C521 C525 -178.1(13) . . . . ?
N502 C516 C521 C525 -3.5(17) . . . . ?
C516 C517 C522 C523 112.2(15) . . . . ?
C518 C517 C522 C523 -72.3(18) . . . . ?
C516 C517 C522 C524 -117.8(17) . . . . ?
C518 C517 C522 C524 58(2) . . . . ?
C520 C521 C525 C527 -78(2) . . . . ?
C516 C521 C525 C527 99.2(16) . . . . ?
C520 C521 C525 C526 45(2) . . . . ?
C516 C521 C525 C526 -137.1(13) . . . . ?
N601 C602 C603 N602 -1.3(12) . . . . ?
C609 C604 C605 C606 -4.0(16) . . . . ?
N601 C604 C605 C606 177.4(9) . . . . ?
C609 C604 C605 C610 178.1(10) . . . . ?
N601 C604 C605 C610 -0.4(14) . . . . ?
C604 C605 C606 C607 4.4(16) . . . . ?
C610 C605 C606 C607 -177.7(10) . . . . ?
C605 C606 C607 C608 -3.7(18) . . . . ?
C606 C607 C608 C609 2.0(17) . . . . ?
C605 C604 C609 C608 2.3(15) . . . . ?
N601 C604 C609 C608 -179.1(7) . . . . ?
C605 C604 C609 C613 -179.3(9) . . . . ?
N601 C604 C609 C613 -0.7(14) . . . . ?
C607 C608 C609 C604 -1.3(14) . . . . ?
C607 C608 C609 C613 -179.7(10) . . . . ?
C606 C605 C610 C612 91.2(14) . . . . ?
C604 C605 C610 C612 -91.0(13) . . . . ?
C606 C605 C610 C611 -35.5(15) . . . . ?
C604 C605 C610 C611 142.4(11) . . . . ?
C604 C609 C613 C614 -157.8(13) . . . . ?
C608 C609 C613 C614 20.5(16) . . . . ?
C604 C609 C613 C615 85.1(18) . . . . ?
C608 C609 C613 C615 -96.6(17) . . . . ?
C621 C616 C617 C618 -1.6(15) . . . . ?
N602 C616 C617 C618 178.1(10) . . . . ?
C621 C616 C617 C622 179.5(9) . . . . ?
N602 C616 C617 C622 -0.9(14) . . . . ?
C616 C617 C618 C619 3(2) . . . . ?
C622 C617 C618 C619 -178.2(16) . . . . ?
C617 C618 C619 C620 -3(3) . . . . ?
C618 C619 C620 C621 1(3) . . . . ?
C619 C620 C621 C616 1(2) . . . . ?
C619 C620 C621 C625 179.8(16) . . . . ?
C617 C616 C621 C620 -0.2(14) . . . . ?
N602 C616 C621 C620 -179.9(8) . . . . ?
C617 C616 C621 C625 -179.2(9) . . . . ?
N602 C616 C621 C625 1.1(12) . . . . ?
C616 C617 C622 C623 -119.1(13) . . . . ?
C618 C617 C622 C623 62.0(17) . . . . ?
C616 C617 C622 C624 113.8(14) . . . . ?
C618 C617 C622 C624 -65.0(19) . . . . ?
C620 C621 C625 C626 -16.7(13) . . . . ?
C616 C621 C625 C626 162.3(8) . . . . ?
C620 C621 C625 C627 109.1(12) . . . . ?
C616 C621 C625 C627 -72.0(11) . . . . ?
N102 C101 N101 C102 0.6(10) . . . . ?
Cu1 C101 N101 C102 176.5(7) . . . . ?
N102 C101 N101 C104 179.5(7) . . . . ?
Cu1 C101 N101 C104 -4.6(13) . . . . ?
C103 C102 N101 C101 0.1(12) . . . . ?
C103 C102 N101 C104 -178.8(9) . . . . ?
C105 C104 N101 C101 -76.5(10) . . . . ?
C109 C104 N101 C101 110.3(9) . . . . ?
C105 C104 N101 C102 102.3(9) . . . . ?
C109 C104 N101 C102 -70.9(10) . . . . ?
N101 C101 N102 C103 -1.1(10) . . . . ?
Cu1 C101 N102 C103 -177.7(7) . . . . ?
N101 C101 N102 C116 -179.2(9) . . . . ?
Cu1 C101 N102 C116 4.1(12) . . . . ?
C102 C103 N102 C101 1.2(13) . . . . ?
C102 C103 N102 C116 179.3(10) . . . . ?
C121 C116 N102 C101 -93.0(11) . . . . ?
C117 C116 N102 C101 86.3(10) . . . . ?
C121 C116 N102 C103 89.1(12) . . . . ?
C117 C116 N102 C103 -91.6(12) . . . . ?
N202 C201 N201 C202 1.8(11) . . . . ?
Cu23 C201 N201 C202 -174.8(7) . . . . ?
N202 C201 N201 C204 179.6(9) . . . . ?
Cu23 C201 N201 C204 3.0(14) . . . . ?
C203 C202 N201 C201 -1.4(13) . . . . ?
C203 C202 N201 C204 -179.3(10) . . . . ?
C205 C204 N201 C201 82.9(12) . . . . ?
C209 C204 N201 C201 -98.2(12) . . . . ?
C205 C204 N201 C202 -99.5(12) . . . . ?
C209 C204 N201 C202 79.4(12) . . . . ?
C202 C203 N202 C201 0.7(14) . . . . ?
C202 C203 N202 C216 176.2(11) . . . . ?
N201 C201 N202 C203 -1.5(11) . . . . ?
Cu23 C201 N202 C203 175.5(8) . . . . ?
N201 C201 N202 C216 -177.2(9) . . . . ?
Cu23 C201 N202 C216 -0.2(13) . . . . ?
C221 C216 N202 C203 97.1(13) . . . . ?
C217 C216 N202 C203 -84.6(13) . . . . ?
C221 C216 N202 C201 -87.8(12) . . . . ?
C217 C216 N202 C201 90.4(12) . . . . ?
C303 C302 N301 C301 -4(2) . . . . ?
C303 C302 N301 C304 -177.8(15) . . . . ?
N302 C301 N301 C302 1.9(15) . . . . ?
Cu26 C301 N301 C302 177.2(10) . . . . ?
N302 C301 N301 C304 176.0(11) . . . . ?
Cu26 C301 N301 C304 -8.7(16) . . . . ?
C309 C304 N301 C302 96.1(18) . . . . ?
C305 C304 N301 C302 -90.0(17) . . . . ?
Cu94 C304 N301 C302 162.6(15) . . . . ?
C309 C304 N301 C301 -77.3(14) . . . . ?
C305 C304 N301 C301 96.6(14) . . . . ?
Cu94 C304 N301 C301 -10.7(17) . . . . ?
N301 C301 N302 C303 1.2(14) . . . . ?
Cu26 C301 N302 C303 -174.1(10) . . . . ?
N301 C301 N302 C316 -173.0(10) . . . . ?
Cu26 C301 N302 C316 11.7(15) . . . . ?
C302 C303 N302 C301 -3.7(19) . . . . ?
C302 C303 N302 C316 170.0(14) . . . . ?
C321 C316 N302 C301 -84.6(13) . . . . ?
C317 C316 N302 C301 90.2(11) . . . . ?
C321 C316 N302 C303 102.1(16) . . . . ?
C317 C316 N302 C303 -83.1(16) . . . . ?
N402 C401 N401 C402 1.3(9) . . . . ?
Cu29 C401 N401 C402 -176.9(6) . . . . ?
N402 C401 N401 C404 -178.4(7) . . . . ?
Cu29 C401 N401 C404 3.5(11) . . . . ?
C403 C402 N401 C401 1.0(11) . . . . ?
C403 C402 N401 C404 -179.3(8) . . . . ?
C409 C404 N401 C401 -108.3(9) . . . . ?
C405 C404 N401 C401 75.8(9) . . . . ?
C409 C404 N401 C402 72.0(10) . . . . ?
C405 C404 N401 C402 -103.8(9) . . . . ?
N401 C401 N402 C403 -3.1(9) . . . . ?
Cu29 C401 N402 C403 175.0(6) . . . . ?
N401 C401 N402 C416 179.4(7) . . . . ?
Cu29 C401 N402 C416 -2.5(12) . . . . ?
C402 C403 N402 C401 3.8(11) . . . . ?
C402 C403 N402 C416 -178.5(8) . . . . ?
C421 C416 N402 C401 -87.2(9) . . . . ?
C417 C416 N402 C401 98.3(9) . . . . ?
C421 C416 N402 C403 95.5(10) . . . . ?
C417 C416 N402 C403 -79.0(10) . . . . ?
N502 C501 N501 C502 1.1(10) . . . . ?
Cu32 C501 N501 C502 -179.4(7) . . . . ?
N502 C501 N501 C504 175.1(9) . . . . ?
Cu32 C501 N501 C504 -5.3(13) . . . . ?
C503 C502 N501 C501 -0.6(12) . . . . ?
C503 C502 N501 C504 -175.0(10) . . . . ?
C505 C504 N501 C501 -98.4(13) . . . . ?
C509 C504 N501 C501 87.5(12) . . . . ?
C505 C504 N501 C502 75.4(14) . . . . ?
C509 C504 N501 C502 -98.8(11) . . . . ?
N501 C501 N502 C503 -1.1(9) . . . . ?
Cu32 C501 N502 C503 179.4(7) . . . . ?
N501 C501 N502 C516 178.1(8) . . . . ?
Cu32 C501 N502 C516 -1.5(12) . . . . ?
C502 C503 N502 C501 0.8(12) . . . . ?
C502 C503 N502 C516 -178.4(9) . . . . ?
C517 C516 N502 C501 -95.4(10) . . . . ?
C521 C516 N502 C501 89.4(11) . . . . ?
C517 C516 N502 C503 83.6(12) . . . . ?
C521 C516 N502 C503 -91.5(12) . . . . ?
N602 C601 N601 C602 -0.9(10) . . . . ?
Cu35 C601 N601 C602 176.2(7) . . . . ?
N602 C601 N601 C604 168.3(9) . . . . ?
Cu35 C601 N601 C604 -14.6(13) . . . . ?
C603 C602 N601 C601 1.5(12) . . . . ?
C603 C602 N601 C604 -167.9(10) . . . . ?
C609 C604 N601 C601 105.9(11) . . . . ?
C605 C604 N601 C601 -75.4(12) . . . . ?
C609 C604 N601 C602 -86.0(12) . . . . ?
C605 C604 N601 C602 92.7(12) . . . . ?
N601 C601 N602 C603 0.0(10) . . . . ?
Cu35 C601 N602 C603 -176.9(6) . . . . ?
N601 C601 N602 C616 -169.0(8) . . . . ?
Cu35 C601 N602 C616 14.1(12) . . . . ?
C602 C603 N602 C601 0.8(12) . . . . ?
C602 C603 N602 C616 170.1(9) . . . . ?
C617 C616 N602 C601 96.2(10) . . . . ?
C621 C616 N602 C601 -84.1(11) . . . . ?
C617 C616 N602 C603 -71.7(12) . . . . ?
C621 C616 N602 C603 108.0(10) . . . . ?
C508 C507 Cu92 C506 -140(2) . . . . ?

_refine_diff_density_max         0.773
_refine_diff_density_min         -0.799
_refine_diff_density_rms         0.110



