#------------------------------------------------------------------------------
#$Date: 2015-08-13 05:21:24 +0300 (Thu, 13 Aug 2015) $
#$Revision: 153390 $
#$URL: svn://www.crystallography.net/cod/cif/2/24/10/2241003.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2241003
loop_
_publ_author_name
'Khongsichan, Ladawan'
'Nimthong-Roldán, Arunpatcha'
'Pakawatchai, Chaveng'
'Wongnawa, Sumpun'
_publ_section_title
;
 Crystal structure of
 bis[μ-1,2-bis(diphenylphosphanyl)ethane-κ²P:P']bis[(N,N'-diethylthiourea-κS)iodidocopper(I)]
;
_journal_coeditor_code           TK5371
_journal_issue                   9
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m154
_journal_page_last               m155
_journal_paper_doi               10.1107/S2056989015014176
_journal_volume                  71
_journal_year                    2015
_chemical_formula_iupac          '[Cu2 I2 (C26 H24 P2)2 (C5 H12 N2 S)2]'
_chemical_formula_moiety         'C62 H72 Cu2 I2 N4 P4 S2'
_chemical_formula_sum            'C62 H72 Cu2 I2 N4 P4 S2'
_chemical_formula_weight         1442.11
_chemical_name_systematic
Bis[μ-1,2-bis(diphenylphosphanyl)ethane-κ²P:P']bis[(N,N'-diethylthiourea-κS)iodidocopper(I)]
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2014/7
_cell_angle_alpha                90
_cell_angle_beta                 96.414(2)
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   12.2150(8)
_cell_length_b                   15.1836(9)
_cell_length_c                   17.1801(10)
_cell_measurement_reflns_used    9846
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      66.6520
_cell_measurement_theta_min      3.8961
_cell_volume                     3166.4(3)
_computing_cell_refinement
;
SAINT (Bruker, 2013)
;
_computing_data_collection
;
APEX2 (Bruker, 2013)
;
_computing_data_reduction
;
SAINT (Bruker, 2013)
;
_computing_molecular_graphics
;
Mercury (Macrae et al.,  2008)
;
_computing_publication_material
;
publCIF (Westrip, 2010)
;
_computing_structure_refinement
;
SHELXL2015 (Sheldrick, 2015) and
SHELXLE (Hübschle et al.,  2011)
;
_computing_structure_solution
;
SHELXS97 (Sheldrick, 2008)
;
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.984
_diffrn_measured_fraction_theta_max 0.984
_diffrn_measurement_device_type  'Bruker Prospector CCD'
_diffrn_measurement_method       'omega and phi scans'
_diffrn_radiation_monochromator  'laterally graded multilayer (Goebel) mirror'
_diffrn_radiation_type           CuK\a
_diffrn_radiation_wavelength     1.54178
_diffrn_reflns_av_R_equivalents  0.0275
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -14
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -18
_diffrn_reflns_limit_l_max       20
_diffrn_reflns_limit_l_min       -20
_diffrn_reflns_number            23236
_diffrn_reflns_theta_full        67.006
_diffrn_reflns_theta_max         67.006
_diffrn_reflns_theta_min         3.896
_exptl_absorpt_coefficient_mu    10.366
_exptl_absorpt_correction_T_max  0.7529
_exptl_absorpt_correction_T_min  0.4327
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(SADABS; Bruker, 2013)
;
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.513
_exptl_crystal_description       block
_exptl_crystal_F_000             1456
_exptl_crystal_size_max          0.160
_exptl_crystal_size_mid          0.150
_exptl_crystal_size_min          0.080
_refine_diff_density_max         0.975
_refine_diff_density_min         -0.924
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.126
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     345
_refine_ls_number_reflns         5564
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.126
_refine_ls_R_factor_all          0.0248
_refine_ls_R_factor_gt           0.0247
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0315P)²+3.4263P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0629
_refine_ls_wR_factor_ref         0.0630
_reflns_number_gt                5556
_reflns_number_total             5564
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            tk5371sup1.cf
_cod_data_source_block           I
_cod_database_code               2241003
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_min   0.288
_shelx_estimated_absorpt_t_max   0.491
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'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_occupancy
I I1 0.71658(2) 0.56133(2) 0.16309(2) 0.01039(6) Uani d 1
Cu Cu1 0.51704(2) 0.64264(2) 0.12681(2) 0.00798(8) Uani d 1
S S1 0.48147(4) 0.74104(3) 0.22620(3) 0.01238(12) Uani d 1
P P1 0.39142(4) 0.53264(3) 0.12684(3) 0.00711(11) Uani d 1
P P2 0.52134(4) 0.70642(3) 0.00696(3) 0.00768(11) Uani d 1
N N1 0.58767(16) 0.88958(13) 0.27366(12) 0.0163(4) Uani d 1
H H1 0.6493 0.9171 0.2902 0.020 Uiso calc 1
N N2 0.69626(15) 0.77334(13) 0.24764(11) 0.0122(4) Uani d 1
H H2 0.7019 0.7167 0.2380 0.015 Uiso calc 1
C C1 0.59546(18) 0.80593(15) 0.25058(12) 0.0109(4) Uani d 1
C C2 0.4851(2) 0.93892(15) 0.27369(17) 0.0198(5) Uani d 1
H H2A 0.4929 0.9817 0.3174 0.024 Uiso calc 1
H H2B 0.4250 0.8977 0.2827 0.024 Uiso calc 1
C C3 0.4547(3) 0.9875(2) 0.19789(19) 0.0348(7) Uani d 1
H H3A 0.5135 1.0289 0.1891 0.052 Uiso calc 1
H H3B 0.3859 1.0199 0.2007 0.052 Uiso calc 1
H H3C 0.4448 0.9452 0.1546 0.052 Uiso calc 1
C C4 0.79787(18) 0.82441(16) 0.25912(14) 0.0149(5) Uani d 1
H H4A 0.8076 0.8487 0.3129 0.018 Uiso calc 1
H H4B 0.7936 0.8743 0.2218 0.018 Uiso calc 1
C C5 0.89514(18) 0.76646(16) 0.24646(14) 0.0162(5) Uani d 1
H H5A 0.8813 0.7370 0.1956 0.024 Uiso calc 1
H H5B 0.9055 0.7222 0.2881 0.024 Uiso calc 1
H H5C 0.9617 0.8027 0.2475 0.024 Uiso calc 1
C C11 0.38548(18) 0.47611(14) 0.22045(13) 0.0103(4) Uani d 1
C C12 0.45710(18) 0.50116(14) 0.28549(13) 0.0124(4) Uani d 1
H H12 0.5106 0.5456 0.2807 0.015 Uiso calc 1
C C13 0.4500(2) 0.46061(16) 0.35789(13) 0.0161(5) Uani d 1
H H13 0.4989 0.4777 0.4022 0.019 Uiso calc 1
C C14 0.3723(2) 0.39590(16) 0.36541(14) 0.0196(5) Uani d 1
H H14 0.3673 0.3692 0.4149 0.024 Uiso calc 1
C C15 0.3015(2) 0.36998(17) 0.30053(15) 0.0201(5) Uani d 1
H H15 0.2486 0.3250 0.3055 0.024 Uiso calc 1
C C16 0.30793(19) 0.40978(16) 0.22830(14) 0.0149(5) Uani d 1
H H16 0.2594 0.3918 0.1840 0.018 Uiso calc 1
C C21 0.24971(18) 0.57205(14) 0.10553(14) 0.0109(4) Uani d 1
C C22 0.1845(2) 0.55542(16) 0.03495(15) 0.0188(5) Uani d 1
H H22 0.2117 0.5190 -0.0035 0.023 Uiso calc 1
C C23 0.0792(2) 0.59235(18) 0.02086(16) 0.0240(5) Uani d 1
H H23 0.0359 0.5819 -0.0277 0.029 Uiso calc 1
C C24 0.0375(2) 0.64380(17) 0.07685(17) 0.0246(6) Uani d 1
H H24 -0.0346 0.6678 0.0674 0.029 Uiso calc 1
C C25 0.1021(2) 0.66008(18) 0.14715(17) 0.0245(6) Uani d 1
H H25 0.0739 0.6953 0.1860 0.029 Uiso calc 1
C C26 0.2072(2) 0.62539(17) 0.16094(14) 0.0177(5) Uani d 1
H H26 0.2510 0.6381 0.2088 0.021 Uiso calc 1
C C27 0.39162(19) 0.44094(13) 0.05650(13) 0.0098(4) Uani d 1
H H27A 0.3228 0.4068 0.0578 0.012 Uiso calc 1
H H27B 0.3910 0.4658 0.0032 0.012 Uiso calc 1
C C28 0.51050(17) 0.62207(14) -0.07137(12) 0.0090(4) Uani d 1
H H28A 0.4406 0.5891 -0.0713 0.011 Uiso calc 1
H H28B 0.5110 0.6507 -0.1231 0.011 Uiso calc 1
C C31 0.40910(19) 0.78228(15) -0.02656(12) 0.0126(4) Uani d 1
C C32 0.4258(2) 0.87216(18) -0.03567(19) 0.0302(6) Uani d 1
H H32 0.4977 0.8963 -0.0252 0.036 Uiso calc 1
C C33 0.3369(3) 0.9266(2) -0.0601(2) 0.0432(8) Uani d 1
H H33 0.3488 0.9880 -0.0658 0.052 Uiso calc 1
C C34 0.2325(3) 0.8932(2) -0.07599(18) 0.0343(7) Uani d 1
H H34 0.1728 0.9310 -0.0933 0.041 Uiso calc 1
C C35 0.2148(2) 0.8042(2) -0.06672(16) 0.0279(6) Uani d 1
H H35 0.1427 0.7805 -0.0779 0.033 Uiso calc 1
C C36 0.3023(2) 0.74917(18) -0.04106(15) 0.0205(5) Uani d 1
H H36 0.2893 0.6883 -0.0333 0.025 Uiso calc 1
C C41 0.64463(18) 0.76671(14) -0.01297(13) 0.0114(4) Uani d 1
C C42 0.7191(2) 0.79247(18) 0.04993(15) 0.0239(6) Uani d 1
H H42 0.7029 0.7809 0.1018 0.029 Uiso calc 1
C C43 0.8164(3) 0.8347(2) 0.03845(17) 0.0333(7) Uani d 1
H H43 0.8658 0.8524 0.0823 0.040 Uiso calc 1
C C44 0.8419(2) 0.8513(2) -0.03605(18) 0.0315(7) Uani d 1
H H44 0.9092 0.8794 -0.0440 0.038 Uiso calc 1
C C45 0.7686(3) 0.8267(3) -0.09912(18) 0.0423(9) Uani d 1
H H45 0.7856 0.8383 -0.1508 0.051 Uiso calc 1
C C46 0.6708(3) 0.7853(2) -0.08813(15) 0.0316(7) Uani d 1
H H46 0.6209 0.7694 -0.1323 0.038 Uiso calc 1
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'
P P 0.2955 0.4335 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
S S 0.3331 0.5567 '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'
I I -0.3257 6.8362 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle
P1 Cu1 P2 . 113.37(2)
P1 Cu1 S1 . 106.77(2)
P2 Cu1 S1 . 114.30(2)
P1 Cu1 I1 . 104.637(18)
P2 Cu1 I1 . 106.669(17)
S1 Cu1 I1 . 110.709(17)
C1 S1 Cu1 . 109.37(7)
C21 P1 C11 . 101.52(10)
C21 P1 C27 . 100.74(10)
C11 P1 C27 . 102.98(10)
C21 P1 Cu1 . 112.59(7)
C11 P1 Cu1 . 116.01(8)
C27 P1 Cu1 . 120.36(7)
C41 P2 C31 . 103.26(10)
C41 P2 C28 . 101.76(10)
C31 P2 C28 . 102.47(10)
C41 P2 Cu1 . 118.97(7)
C31 P2 Cu1 . 117.28(7)
C28 P2 Cu1 . 110.82(7)
C1 N1 C2 . 125.3(2)
C1 N1 H1 . 117.4
C2 N1 H1 . 117.4
C1 N2 C4 . 124.98(19)
C1 N2 H2 . 117.5
C4 N2 H2 . 117.5
N2 C1 N1 . 117.4(2)
N2 C1 S1 . 120.29(17)
N1 C1 S1 . 122.29(17)
N1 C2 C3 . 112.4(2)
N1 C2 H2A . 109.1
C3 C2 H2A . 109.1
N1 C2 H2B . 109.1
C3 C2 H2B . 109.1
H2A C2 H2B . 107.9
C2 C3 H3A . 109.5
C2 C3 H3B . 109.5
H3A C3 H3B . 109.5
C2 C3 H3C . 109.5
H3A C3 H3C . 109.5
H3B C3 H3C . 109.5
N2 C4 C5 . 109.97(19)
N2 C4 H4A . 109.7
C5 C4 H4A . 109.7
N2 C4 H4B . 109.7
C5 C4 H4B . 109.7
H4A C4 H4B . 108.2
C4 C5 H5A . 109.5
C4 C5 H5B . 109.5
H5A C5 H5B . 109.5
C4 C5 H5C . 109.5
H5A C5 H5C . 109.5
H5B C5 H5C . 109.5
C12 C11 C16 . 119.4(2)
C12 C11 P1 . 119.57(17)
C16 C11 P1 . 121.03(17)
C11 C12 C13 . 119.8(2)
C11 C12 H12 . 120.1
C13 C12 H12 . 120.1
C14 C13 C12 . 120.5(2)
C14 C13 H13 . 119.7
C12 C13 H13 . 119.7
C13 C14 C15 . 119.9(2)
C13 C14 H14 . 120.0
C15 C14 H14 . 120.0
C14 C15 C16 . 120.0(2)
C14 C15 H15 . 120.0
C16 C15 H15 . 120.0
C15 C16 C11 . 120.3(2)
C15 C16 H16 . 119.8
C11 C16 H16 . 119.8
C26 C21 C22 . 118.6(2)
C26 C21 P1 . 118.01(18)
C22 C21 P1 . 123.33(18)
C21 C22 C23 . 120.1(2)
C21 C22 H22 . 119.9
C23 C22 H22 . 119.9
C24 C23 C22 . 120.6(2)
C24 C23 H23 . 119.7
C22 C23 H23 . 119.7
C23 C24 C25 . 119.3(2)
C23 C24 H24 . 120.4
C25 C24 H24 . 120.4
C26 C25 C24 . 120.5(2)
C26 C25 H25 . 119.8
C24 C25 H25 . 119.8
C25 C26 C21 . 120.9(2)
C25 C26 H26 . 119.5
C21 C26 H26 . 119.5
C28 C27 P1 3_665 114.89(15)
C28 C27 H27A 3_665 108.5
P1 C27 H27A . 108.5
C28 C27 H27B 3_665 108.5
P1 C27 H27B . 108.5
H27A C27 H27B . 107.5
C27 C28 P2 3_665 108.66(14)
C27 C28 H28A 3_665 110.0
P2 C28 H28A . 110.0
C27 C28 H28B 3_665 110.0
P2 C28 H28B . 110.0
H28A C28 H28B . 108.3
C32 C31 C36 . 118.7(2)
C32 C31 P2 . 122.5(2)
C36 C31 P2 . 118.77(18)
C33 C32 C31 . 119.8(3)
C33 C32 H32 . 120.1
C31 C32 H32 . 120.1
C34 C33 C32 . 121.2(3)
C34 C33 H33 . 119.4
C32 C33 H33 . 119.4
C33 C34 C35 . 119.6(3)
C33 C34 H34 . 120.2
C35 C34 H34 . 120.2
C34 C35 C36 . 120.0(3)
C34 C35 H35 . 120.0
C36 C35 H35 . 120.0
C35 C36 C31 . 120.8(3)
C35 C36 H36 . 119.6
C31 C36 H36 . 119.6
C42 C41 C46 . 117.8(2)
C42 C41 P2 . 118.50(18)
C46 C41 P2 . 123.68(18)
C43 C42 C41 . 121.2(2)
C43 C42 H42 . 119.4
C41 C42 H42 . 119.4
C44 C43 C42 . 120.3(3)
C44 C43 H43 . 119.8
C42 C43 H43 . 119.8
C43 C44 C45 . 119.2(3)
C43 C44 H44 . 120.4
C45 C44 H44 . 120.4
C44 C45 C46 . 120.8(3)
C44 C45 H45 . 119.6
C46 C45 H45 . 119.6
C45 C46 C41 . 120.7(3)
C45 C46 H46 . 119.6
C41 C46 H46 . 119.6
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
I1 Cu1 . 2.7412(4)
Cu1 P1 . 2.2681(6)
Cu1 P2 . 2.2813(6)
Cu1 S1 . 2.3457(6)
S1 C1 . 1.719(2)
P1 C21 . 1.829(2)
P1 C11 . 1.832(2)
P1 C27 . 1.844(2)
P2 C41 . 1.827(2)
P2 C31 . 1.834(2)
P2 C28 . 1.852(2)
N1 C1 . 1.337(3)
N1 C2 . 1.459(3)
N1 H1 . 0.8800
N2 C1 . 1.333(3)
N2 C4 . 1.458(3)
N2 H2 . 0.8800
C2 C3 . 1.507(4)
C2 H2A . 0.9900
C2 H2B . 0.9900
C3 H3A . 0.9800
C3 H3B . 0.9800
C3 H3C . 0.9800
C4 C5 . 1.514(3)
C4 H4A . 0.9900
C4 H4B . 0.9900
C5 H5A . 0.9800
C5 H5B . 0.9800
C5 H5C . 0.9800
C11 C12 . 1.393(3)
C11 C16 . 1.399(3)
C12 C13 . 1.399(3)
C12 H12 . 0.9500
C13 C14 . 1.382(4)
C13 H13 . 0.9500
C14 C15 . 1.389(4)
C14 H14 . 0.9500
C15 C16 . 1.390(3)
C15 H15 . 0.9500
C16 H16 . 0.9500
C21 C26 . 1.394(3)
C21 C22 . 1.398(4)
C22 C23 . 1.399(4)
C22 H22 . 0.9500
C23 C24 . 1.380(4)
C23 H23 . 0.9500
C24 C25 . 1.389(4)
C24 H24 . 0.9500
C25 C26 . 1.384(4)
C25 H25 . 0.9500
C26 H26 . 0.9500
C27 C28 3_665 1.530(3)
C27 H27A . 0.9900
C27 H27B . 0.9900
C28 C27 3_665 1.530(3)
C28 H28A . 0.9900
C28 H28B . 0.9900
C31 C32 . 1.391(4)
C31 C36 . 1.394(4)
C32 C33 . 1.391(4)
C32 H32 . 0.9500
C33 C34 . 1.371(5)
C33 H33 . 0.9500
C34 C35 . 1.381(5)
C34 H34 . 0.9500
C35 C36 . 1.389(4)
C35 H35 . 0.9500
C36 H36 . 0.9500
C41 C42 . 1.389(3)
C41 C46 . 1.393(3)
C42 C43 . 1.384(4)
C42 H42 . 0.9500
C43 C44 . 1.374(4)
C43 H43 . 0.9500
C44 C45 . 1.378(5)
C44 H44 . 0.9500
C45 C46 . 1.381(4)
C45 H45 . 0.9500
C46 H46 . 0.9500
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
N1 H1 I1 2_655 0.88 2.80 3.622(2) 156
N2 H2 I1 . 0.88 2.70 3.5517(19) 162
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_site_symmetry_4
_geom_torsion
C4 N2 C1 N1 . -7.2(3)
C4 N2 C1 S1 . 173.37(18)
C2 N1 C1 N2 . 174.1(2)
C2 N1 C1 S1 . -6.5(3)
Cu1 S1 C1 N2 . -33.6(2)
Cu1 S1 C1 N1 . 146.99(17)
C1 N1 C2 C3 . -90.6(3)
C1 N2 C4 C5 . -176.4(2)
C21 P1 C11 C12 . -123.32(18)
C27 P1 C11 C12 . 132.67(18)
Cu1 P1 C11 C12 . -0.9(2)
C21 P1 C11 C16 . 54.8(2)
C27 P1 C11 C16 . -49.2(2)
Cu1 P1 C11 C16 . 177.20(16)
C16 C11 C12 C13 . -0.7(3)
P1 C11 C12 C13 . 177.45(17)
C11 C12 C13 C14 . -0.1(3)
C12 C13 C14 C15 . 0.8(4)
C13 C14 C15 C16 . -0.7(4)
C14 C15 C16 C11 . -0.1(4)
C12 C11 C16 C15 . 0.8(3)
P1 C11 C16 C15 . -177.35(18)
C11 P1 C21 C26 . 56.7(2)
C27 P1 C21 C26 . 162.44(19)
Cu1 P1 C21 C26 . -68.06(19)
C11 P1 C21 C22 . -127.0(2)
C27 P1 C21 C22 . -21.2(2)
Cu1 P1 C21 C22 . 108.27(19)
C26 C21 C22 C23 . 0.3(4)
P1 C21 C22 C23 . -176.0(2)
C21 C22 C23 C24 . -1.5(4)
C22 C23 C24 C25 . 1.2(4)
C23 C24 C25 C26 . 0.2(4)
C24 C25 C26 C21 . -1.3(4)
C22 C21 C26 C25 . 1.1(4)
P1 C21 C26 C25 . 177.6(2)
C21 P1 C27 C28 3_665 -165.70(16)
C11 P1 C27 C28 3_665 -61.09(18)
Cu1 P1 C27 C28 3_665 69.95(17)
C41 P2 C28 C27 3_665 66.78(16)
C31 P2 C28 C27 3_665 173.40(15)
Cu1 P2 C28 C27 3_665 -60.70(15)
C41 P2 C31 C32 . -20.2(2)
C28 P2 C31 C32 . -125.7(2)
Cu1 P2 C31 C32 . 112.8(2)
C41 P2 C31 C36 . 161.93(18)
C28 P2 C31 C36 . 56.5(2)
Cu1 P2 C31 C36 . -65.11(19)
C36 C31 C32 C33 . -1.1(4)
P2 C31 C32 C33 . -178.9(3)
C31 C32 C33 C34 . -0.4(5)
C32 C33 C34 C35 . 0.8(5)
C33 C34 C35 C36 . 0.3(4)
C34 C35 C36 C31 . -1.9(4)
C32 C31 C36 C35 . 2.2(4)
P2 C31 C36 C35 . -179.84(19)
C31 P2 C41 C42 . 114.9(2)
C28 P2 C41 C42 . -139.1(2)
Cu1 P2 C41 C42 . -17.1(2)
C31 P2 C41 C46 . -67.9(2)
C28 P2 C41 C46 . 38.1(3)
Cu1 P2 C41 C46 . 160.1(2)
C46 C41 C42 C43 . -0.4(4)
P2 C41 C42 C43 . 177.0(2)
C41 C42 C43 C44 . -0.7(5)
C42 C43 C44 C45 . 1.1(5)
C43 C44 C45 C46 . -0.4(6)
C44 C45 C46 C41 . -0.7(6)
C42 C41 C46 C45 . 1.1(5)
P2 C41 C46 C45 . -176.2(3)

_cod_database_fobs_code 2241003
