#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:19:13 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179104 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/66/4306630.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4306630
loop_
_publ_author_name
'Peter Hofmann'
'Igor V. Shishkov'
'Frank Rominger'
_publ_contact_author_address
;
        Organisch-Chemisches Institut
        Universität Heidelberg
        Im Neuenheimer Feld 270
        D-69120 Heidelberg
        Germany
;
_publ_contact_author_email       ph@oci.uni-heidelberg.de
_publ_contact_author_fax         '049 6221 54-4885'
_publ_contact_author_name        'Hofmann, Peter'
_publ_contact_author_phone       '049 6221 54-8502'
_publ_section_title
;
Synthesis, Molecular Structures, and Reactivity of Mono- and Binuclear
Neutral Copper(I) Carbenes
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              11755
_journal_page_last               11762
_journal_paper_doi               10.1021/ic801443y
_journal_volume                  47
_journal_year                    2008
_chemical_formula_sum            'C41 H82 Cu2 N4 P2 Si4'
_chemical_formula_weight         932.49
_chemical_name_common            'in paper 5'
_chemical_name_systematic
;
 ?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_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-97
_cell_angle_alpha                90.00
_cell_angle_beta                 94.1530(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   11.5457(6)
_cell_length_b                   26.9652(14)
_cell_length_c                   15.9658(8)
_cell_measurement_temperature    100(2)
_cell_volume                     4957.6(4)
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_collection       'Bruker XSCANS'
_computing_data_reduction        'Bruker SHELXTL'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.994
_diffrn_measurement_device_type  'Bruker APEX'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0381
_diffrn_reflns_av_sigmaI/netI    0.0349
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -15
_diffrn_reflns_limit_k_max       35
_diffrn_reflns_limit_k_min       -35
_diffrn_reflns_limit_l_max       21
_diffrn_reflns_limit_l_min       -21
_diffrn_reflns_number            50764
_diffrn_reflns_theta_full        28.32
_diffrn_reflns_theta_max         28.32
_diffrn_reflns_theta_min         1.49
_exptl_absorpt_coefficient_mu    1.051
_exptl_absorpt_correction_T_max  0.9592
_exptl_absorpt_correction_T_min  0.6909
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'Blessing, Acta Cryst. (1995) A51 33-38.'
_exptl_crystal_colour            dark
_exptl_crystal_density_diffrn    1.249
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       polyhedron
_exptl_crystal_F_000             2000
_exptl_crystal_size_max          0.38
_exptl_crystal_size_mid          0.24
_exptl_crystal_size_min          0.04
_refine_diff_density_max         0.511
_refine_diff_density_min         -0.343
_refine_diff_density_rms         0.087
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.122
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     502
_refine_ls_number_reflns         12282
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.122
_refine_ls_R_factor_all          0.0408
_refine_ls_R_factor_gt           0.0324
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0428P)²+1.5022P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0788
_refine_ls_wR_factor_ref         0.0880
_reflns_number_gt                10544
_reflns_number_total             12282
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic801443y_si_001_3.cif
_cod_data_source_block           ivsh3
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_database_code               4306630
loop_
_symmetry_equiv_pos_as_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_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_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
Cu1 Cu 0.314755(18) 0.137447(8) 0.193515(13) 0.01170(6) Uani 1 1 d . . .
N1 N 0.34827(13) 0.13443(5) 0.07029(9) 0.0127(3) Uani 1 1 d . . .
N2 N 0.43621(13) 0.19188(6) 0.18218(9) 0.0139(3) Uani 1 1 d . . .
P1 P 0.42538(4) 0.183869(17) 0.08184(3) 0.01214(9) Uani 1 1 d . . .
Si1 Si 0.28302(4) 0.094830(19) -0.00269(3) 0.01339(10) Uani 1 1 d . . .
Si2 Si 0.52009(5) 0.21661(2) 0.26457(3) 0.01682(11) Uani 1 1 d . . .
Cu2 Cu 0.219087(18) 0.068415(8) 0.255994(13) 0.01154(6) Uani 1 1 d . . .
N3 N 0.30490(12) 0.00300(5) 0.26876(9) 0.0124(3) Uani 1 1 d . . .
N4 N 0.08888(12) 0.01789(6) 0.26888(9) 0.0133(3) Uani 1 1 d . . .
P2 P 0.18482(4) -0.025139(17) 0.28250(3) 0.01101(9) Uani 1 1 d . . .
Si3 Si 0.45287(4) -0.003799(18) 0.27856(3) 0.01179(10) Uani 1 1 d . . .
Si4 Si -0.05740(4) 0.03036(2) 0.26363(3) 0.01497(10) Uani 1 1 d . . .
C1 C 0.21102(15) 0.13782(7) 0.28243(11) 0.0131(3) Uani 1 1 d . . .
C11 C 0.34704(16) 0.23859(7) 0.03255(12) 0.0170(4) Uani 1 1 d . . .
C12 C 0.39130(18) 0.28716(7) 0.07304(14) 0.0238(4) Uani 1 1 d . . .
H12A H 0.3456 0.3150 0.0488 0.036 Uiso 1 1 calc R . .
H12B H 0.4732 0.2918 0.0626 0.036 Uiso 1 1 calc R . .
H12C H 0.3834 0.2858 0.1337 0.036 Uiso 1 1 calc R . .
C13 C 0.21865(16) 0.23330(8) 0.05096(13) 0.0212(4) Uani 1 1 d . . .
H13A H 0.2127 0.2309 0.1117 0.032 Uiso 1 1 calc R . .
H13B H 0.1863 0.2033 0.0237 0.032 Uiso 1 1 calc R . .
H13C H 0.1752 0.2623 0.0292 0.032 Uiso 1 1 calc R . .
C14 C 0.35361(18) 0.24288(8) -0.06304(12) 0.0230(4) Uani 1 1 d . . .
H14A H 0.3024 0.2697 -0.0847 0.035 Uiso 1 1 calc R . .
H14B H 0.3289 0.2115 -0.0898 0.035 Uiso 1 1 calc R . .
H14C H 0.4337 0.2502 -0.0756 0.035 Uiso 1 1 calc R . .
C15 C 0.56951(15) 0.17583(7) 0.03637(12) 0.0162(4) Uani 1 1 d . . .
C16 C 0.63744(17) 0.22406(8) 0.02645(13) 0.0223(4) Uani 1 1 d . . .
H16A H 0.6464 0.2413 0.0806 0.033 Uiso 1 1 calc R . .
H16B H 0.5951 0.2454 -0.0150 0.033 Uiso 1 1 calc R . .
H16C H 0.7142 0.2164 0.0074 0.033 Uiso 1 1 calc R . .
C17 C 0.55402(17) 0.15029(8) -0.04974(12) 0.0210(4) Uani 1 1 d . . .
H17A H 0.5053 0.1710 -0.0885 0.031 Uiso 1 1 calc R . .
H17B H 0.5167 0.1180 -0.0437 0.031 Uiso 1 1 calc R . .
H17C H 0.6301 0.1456 -0.0720 0.031 Uiso 1 1 calc R . .
C18 C 0.64206(17) 0.14097(8) 0.09527(13) 0.0221(4) Uani 1 1 d . . .
H18A H 0.7149 0.1330 0.0704 0.033 Uiso 1 1 calc R . .
H18B H 0.5984 0.1104 0.1034 0.033 Uiso 1 1 calc R . .
H18C H 0.6592 0.1573 0.1496 0.033 Uiso 1 1 calc R . .
C21 C 0.13455(16) 0.07839(7) 0.02795(12) 0.0186(4) Uani 1 1 d . . .
H21A H 0.1396 0.0662 0.0859 0.028 Uiso 1 1 calc R . .
H21B H 0.1014 0.0525 -0.0096 0.028 Uiso 1 1 calc R . .
H21C H 0.0848 0.1078 0.0236 0.028 Uiso 1 1 calc R . .
C22 C 0.25884(17) 0.11894(8) -0.11290(12) 0.0212(4) Uani 1 1 d . . .
H22A H 0.2055 0.1472 -0.1138 0.032 Uiso 1 1 calc R . .
H22B H 0.2252 0.0927 -0.1494 0.032 Uiso 1 1 calc R . .
H22C H 0.3332 0.1295 -0.1330 0.032 Uiso 1 1 calc R . .
C23 C 0.36435(17) 0.03525(7) -0.00905(13) 0.0221(4) Uani 1 1 d . . .
H23A H 0.4449 0.0422 -0.0207 0.033 Uiso 1 1 calc R . .
H23B H 0.3278 0.0148 -0.0543 0.033 Uiso 1 1 calc R . .
H23C H 0.3630 0.0175 0.0444 0.033 Uiso 1 1 calc R . .
C24 C 0.42616(19) 0.24590(8) 0.34127(13) 0.0241(4) Uani 1 1 d . . .
H24A H 0.3766 0.2711 0.3126 0.036 Uiso 1 1 calc R . .
H24B H 0.4752 0.2615 0.3865 0.036 Uiso 1 1 calc R . .
H24C H 0.3775 0.2205 0.3650 0.036 Uiso 1 1 calc R . .
C25 C 0.62442(19) 0.26690(8) 0.23858(14) 0.0280(5) Uani 1 1 d . . .
H25A H 0.6894 0.2523 0.2110 0.042 Uiso 1 1 calc R . .
H25B H 0.6538 0.2836 0.2904 0.042 Uiso 1 1 calc R . .
H25C H 0.5843 0.2910 0.2008 0.042 Uiso 1 1 calc R . .
C26 C 0.61210(17) 0.16804(8) 0.32245(13) 0.0230(4) Uani 1 1 d . . .
H26A H 0.5792 0.1351 0.3100 0.034 Uiso 1 1 calc R . .
H26B H 0.6136 0.1743 0.3830 0.034 Uiso 1 1 calc R . .
H26C H 0.6914 0.1695 0.3044 0.034 Uiso 1 1 calc R . .
C31 C 0.18563(16) -0.04983(7) 0.39183(11) 0.0153(4) Uani 1 1 d . . .
C32 C 0.29574(17) -0.08023(7) 0.41807(12) 0.0196(4) Uani 1 1 d . . .
H32A H 0.2952 -0.0894 0.4774 0.029 Uiso 1 1 calc R . .
H32B H 0.3648 -0.0603 0.4097 0.029 Uiso 1 1 calc R . .
H32C H 0.2970 -0.1103 0.3837 0.029 Uiso 1 1 calc R . .
C33 C 0.18412(19) -0.00418(8) 0.44970(12) 0.0227(4) Uani 1 1 d . . .
H33A H 0.1110 0.0139 0.4383 0.034 Uiso 1 1 calc R . .
H33B H 0.2495 0.0176 0.4392 0.034 Uiso 1 1 calc R . .
H33C H 0.1909 -0.0150 0.5085 0.034 Uiso 1 1 calc R . .
C34 C 0.07868(17) -0.08158(8) 0.40562(12) 0.0208(4) Uani 1 1 d . . .
H34A H 0.0798 -0.0912 0.4648 0.031 Uiso 1 1 calc R . .
H34B H 0.0797 -0.1114 0.3706 0.031 Uiso 1 1 calc R . .
H34C H 0.0082 -0.0624 0.3903 0.031 Uiso 1 1 calc R . .
C35 C 0.15808(15) -0.07588(7) 0.20318(11) 0.0147(3) Uani 1 1 d . . .
C36 C 0.02956(16) -0.08955(7) 0.18990(12) 0.0191(4) Uani 1 1 d . . .
H36A H 0.0192 -0.1146 0.1456 0.029 Uiso 1 1 calc R . .
H36B H -0.0156 -0.0599 0.1734 0.029 Uiso 1 1 calc R . .
H36C H 0.0027 -0.1029 0.2422 0.029 Uiso 1 1 calc R . .
C37 C 0.22699(16) -0.12345(7) 0.22414(12) 0.0182(4) Uani 1 1 d . . .
H37A H 0.1965 -0.1395 0.2730 0.027 Uiso 1 1 calc R . .
H37B H 0.3090 -0.1152 0.2368 0.027 Uiso 1 1 calc R . .
H37C H 0.2194 -0.1460 0.1760 0.027 Uiso 1 1 calc R . .
C38 C 0.19583(17) -0.05514(7) 0.11949(11) 0.0192(4) Uani 1 1 d . . .
H38A H 0.1757 -0.0789 0.0744 0.029 Uiso 1 1 calc R . .
H38B H 0.2800 -0.0497 0.1239 0.029 Uiso 1 1 calc R . .
H38C H 0.1559 -0.0237 0.1070 0.029 Uiso 1 1 calc R . .
C41 C 0.51831(16) 0.03970(7) 0.20495(12) 0.0183(4) Uani 1 1 d . . .
H41A H 0.4983 0.0291 0.1470 0.027 Uiso 1 1 calc R . .
H41B H 0.6029 0.0398 0.2160 0.027 Uiso 1 1 calc R . .
H41C H 0.4882 0.0732 0.2131 0.027 Uiso 1 1 calc R . .
C42 C 0.50838(16) -0.06721(7) 0.25324(13) 0.0198(4) Uani 1 1 d . . .
H42A H 0.4823 -0.0913 0.2939 0.030 Uiso 1 1 calc R . .
H42B H 0.5934 -0.0667 0.2561 0.030 Uiso 1 1 calc R . .
H42C H 0.4783 -0.0767 0.1965 0.030 Uiso 1 1 calc R . .
C43 C 0.52078(16) 0.01207(7) 0.38591(12) 0.0184(4) Uani 1 1 d . . .
H43A H 0.5630 0.0435 0.3833 0.028 Uiso 1 1 calc R . .
H43B H 0.5748 -0.0143 0.4051 0.028 Uiso 1 1 calc R . .
H43C H 0.4599 0.0153 0.4253 0.028 Uiso 1 1 calc R . .
C44 C -0.08617(17) 0.08601(8) 0.32873(13) 0.0216(4) Uani 1 1 d . . .
H44A H -0.0514 0.0811 0.3860 0.032 Uiso 1 1 calc R . .
H44B H -0.1702 0.0907 0.3302 0.032 Uiso 1 1 calc R . .
H44C H -0.0520 0.1154 0.3041 0.032 Uiso 1 1 calc R . .
C45 C -0.11554(16) 0.04243(8) 0.15286(12) 0.0211(4) Uani 1 1 d . . .
H45A H -0.0682 0.0679 0.1279 0.032 Uiso 1 1 calc R . .
H45B H -0.1961 0.0540 0.1526 0.032 Uiso 1 1 calc R . .
H45C H -0.1128 0.0118 0.1201 0.032 Uiso 1 1 calc R . .
C46 C -0.15723(16) -0.01761(7) 0.30436(13) 0.0207(4) Uani 1 1 d . . .
H46A H -0.1433 -0.0496 0.2779 0.031 Uiso 1 1 calc R . .
H46B H -0.2381 -0.0076 0.2911 0.031 Uiso 1 1 calc R . .
H46C H -0.1424 -0.0206 0.3654 0.031 Uiso 1 1 calc R . .
C51 C 0.12409(15) 0.17538(7) 0.25137(11) 0.0149(3) Uani 1 1 d . . .
C52 C 0.12079(17) 0.22334(7) 0.28542(12) 0.0194(4) Uani 1 1 d . . .
H52 H 0.1713 0.2317 0.3329 0.023 Uiso 1 1 calc R . .
C53 C 0.04426(19) 0.25876(8) 0.25026(13) 0.0251(4) Uani 1 1 d . . .
H53 H 0.0448 0.2914 0.2727 0.030 Uiso 1 1 calc R . .
C54 C -0.03267(18) 0.24673(8) 0.18280(14) 0.0273(5) Uani 1 1 d . . .
H54 H -0.0857 0.2709 0.1597 0.033 Uiso 1 1 calc R . .
C55 C -0.03207(17) 0.19944(8) 0.14917(13) 0.0243(4) Uani 1 1 d . . .
H55 H -0.0855 0.1909 0.1034 0.029 Uiso 1 1 calc R . .
C56 C 0.04666(16) 0.16454(7) 0.18231(12) 0.0186(4) Uani 1 1 d . . .
H56 H 0.0481 0.1325 0.1576 0.022 Uiso 1 1 calc R . .
C61 C 0.24086(16) 0.13634(7) 0.37398(11) 0.0144(3) Uani 1 1 d . . .
C62 C 0.15998(17) 0.14800(7) 0.43331(12) 0.0169(4) Uani 1 1 d . . .
H62 H 0.0848 0.1596 0.4147 0.020 Uiso 1 1 calc R . .
C63 C 0.18974(18) 0.14260(8) 0.51862(12) 0.0219(4) Uani 1 1 d . . .
H63 H 0.1338 0.1495 0.5578 0.026 Uiso 1 1 calc R . .
C64 C 0.29996(19) 0.12725(8) 0.54732(12) 0.0240(4) Uani 1 1 d . . .
H64 H 0.3200 0.1244 0.6059 0.029 Uiso 1 1 calc R . .
C65 C 0.38102(18) 0.11605(8) 0.49022(12) 0.0225(4) Uani 1 1 d . . .
H65 H 0.4570 0.1058 0.5096 0.027 Uiso 1 1 calc R . .
C66 C 0.35108(17) 0.11984(7) 0.40468(12) 0.0183(4) Uani 1 1 d . . .
H66 H 0.4065 0.1111 0.3661 0.022 Uiso 1 1 calc R . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0033 0.0016 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
H H 0.0000 0.0000 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
N N 0.0061 0.0033 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
P P 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cu Cu 0.3201 1.2651 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle_publ_flag
C1 Cu1 N1 152.47(7) . . ?
C1 Cu1 N2 121.93(7) . . ?
N1 Cu1 N2 76.33(6) . . ?
C1 Cu1 Cu2 51.05(5) . . ?
N1 Cu1 Cu2 119.55(4) . . ?
N2 Cu1 Cu2 157.72(4) . . ?
C1 Cu1 P1 150.52(5) . . ?
N1 Cu1 P1 38.33(4) . . ?
N2 Cu1 P1 38.50(4) . . ?
Cu2 Cu1 P1 156.848(15) . . ?
P1 N1 Si1 143.88(10) . . ?
P1 N1 Cu1 89.91(7) . . ?
Si1 N1 Cu1 125.26(8) . . ?
P1 N2 Si2 144.57(10) . . ?
P1 N2 Cu1 89.28(7) . . ?
Si2 N2 Cu1 124.37(8) . . ?
N1 P1 N2 103.16(8) . . ?
N1 P1 C11 111.02(8) . . ?
N2 P1 C11 108.19(8) . . ?
N1 P1 C15 111.07(8) . . ?
N2 P1 C15 113.13(8) . . ?
C11 P1 C15 110.07(8) . . ?
N1 P1 Cu1 51.76(5) . . ?
N2 P1 Cu1 52.22(5) . . ?
C11 P1 Cu1 115.00(6) . . ?
C15 P1 Cu1 134.93(6) . . ?
N1 Si1 C23 112.02(8) . . ?
N1 Si1 C21 109.63(8) . . ?
C23 Si1 C21 106.52(9) . . ?
N1 Si1 C22 116.71(9) . . ?
C23 Si1 C22 106.75(10) . . ?
C21 Si1 C22 104.50(9) . . ?
N2 Si2 C24 110.21(9) . . ?
N2 Si2 C25 116.57(9) . . ?
C24 Si2 C25 104.55(10) . . ?
N2 Si2 C26 111.93(8) . . ?
C24 Si2 C26 107.79(10) . . ?
C25 Si2 C26 105.19(10) . . ?
C1 Cu2 N3 148.94(7) . . ?
C1 Cu2 N4 125.27(7) . . ?
N3 Cu2 N4 76.59(6) . . ?
C1 Cu2 Cu1 51.06(5) . . ?
N3 Cu2 Cu1 118.51(4) . . ?
N4 Cu2 Cu1 156.02(4) . . ?
C1 Cu2 P2 154.28(5) . . ?
N3 Cu2 P2 38.36(4) . . ?
N4 Cu2 P2 38.32(4) . . ?
Cu1 Cu2 P2 153.699(14) . . ?
P2 N3 Si3 143.12(10) . . ?
P2 N3 Cu2 90.25(7) . . ?
Si3 N3 Cu2 125.39(8) . . ?
P2 N4 Si4 144.39(10) . . ?
P2 N4 Cu2 89.43(7) . . ?
Si4 N4 Cu2 126.18(8) . . ?
N4 P2 N3 103.49(8) . . ?
N4 P2 C31 109.90(8) . . ?
N3 P2 C31 110.45(8) . . ?
N4 P2 C35 110.92(8) . . ?
N3 P2 C35 110.69(8) . . ?
C31 P2 C35 111.14(8) . . ?
N4 P2 Cu2 52.25(5) . . ?
N3 P2 Cu2 51.39(5) . . ?
C31 P2 Cu2 120.59(6) . . ?
C35 P2 Cu2 128.27(6) . . ?
N3 Si3 C41 108.83(8) . . ?
N3 Si3 C42 115.51(8) . . ?
C41 Si3 C42 106.10(9) . . ?
N3 Si3 C43 113.93(8) . . ?
C41 Si3 C43 105.70(9) . . ?
C42 Si3 C43 106.06(9) . . ?
N4 Si4 C44 110.11(8) . . ?
N4 Si4 C45 111.32(8) . . ?
C44 Si4 C45 108.63(10) . . ?
N4 Si4 C46 118.27(8) . . ?
C44 Si4 C46 102.83(9) . . ?
C45 Si4 C46 105.02(9) . . ?
C61 C1 C51 116.87(15) . . ?
C61 C1 Cu2 100.33(12) . . ?
C51 C1 Cu2 129.25(13) . . ?
C61 C1 Cu1 128.11(13) . . ?
C51 C1 Cu1 101.48(12) . . ?
Cu2 C1 Cu1 77.88(7) . . ?
C12 C11 C14 108.40(16) . . ?
C12 C11 C13 107.17(16) . . ?
C14 C11 C13 108.30(16) . . ?
C12 C11 P1 111.09(13) . . ?
C14 C11 P1 114.77(13) . . ?
C13 C11 P1 106.81(13) . . ?
C16 C15 C18 108.81(16) . . ?
C16 C15 C17 108.37(16) . . ?
C18 C15 C17 107.27(16) . . ?
C16 C15 P1 114.63(13) . . ?
C18 C15 P1 107.08(13) . . ?
C17 C15 P1 110.43(13) . . ?
C34 C31 C33 108.43(16) . . ?
C34 C31 C32 108.69(15) . . ?
C33 C31 C32 107.84(16) . . ?
C34 C31 P2 112.59(13) . . ?
C33 C31 P2 106.04(13) . . ?
C32 C31 P2 113.02(13) . . ?
C36 C35 C37 108.16(15) . . ?
C36 C35 C38 107.46(15) . . ?
C37 C35 C38 108.55(15) . . ?
C36 C35 P2 112.36(13) . . ?
C37 C35 P2 113.93(13) . . ?
C38 C35 P2 106.13(12) . . ?
C56 C51 C52 117.62(17) . . ?
C56 C51 C1 119.89(17) . . ?
C52 C51 C1 122.36(17) . . ?
C53 C52 C51 120.68(19) . . ?
C54 C53 C52 120.4(2) . . ?
C53 C54 C55 119.80(19) . . ?
C54 C55 C56 119.93(19) . . ?
C55 C56 C51 121.53(19) . . ?
C66 C61 C62 117.60(17) . . ?
C66 C61 C1 119.66(16) . . ?
C62 C61 C1 122.62(16) . . ?
C63 C62 C61 120.39(18) . . ?
C64 C63 C62 120.83(19) . . ?
C63 C64 C65 119.71(18) . . ?
C64 C65 C66 119.94(19) . . ?
C65 C66 C61 121.48(18) . . ?
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 1.9225(18) . ?
Cu1 N1 2.0341(15) . ?
Cu1 N2 2.0470(15) . ?
Cu1 Cu2 2.4165(3) . ?
Cu1 P1 2.5898(5) . ?
N1 P1 1.6062(15) . ?
N1 Si1 1.7142(15) . ?
N2 P1 1.6123(15) . ?
N2 Si2 1.7113(16) . ?
P1 C11 1.8739(19) . ?
P1 C15 1.8758(19) . ?
Si1 C23 1.867(2) . ?
Si1 C21 1.8698(19) . ?
Si1 C22 1.878(2) . ?
Si2 C24 1.869(2) . ?
Si2 C25 1.880(2) . ?
Si2 C26 1.885(2) . ?
Cu2 C1 1.9222(18) . ?
Cu2 N3 2.0262(15) . ?
Cu2 N4 2.0503(15) . ?
Cu2 P2 2.5931(5) . ?
N3 P2 1.6094(15) . ?
N3 Si3 1.7140(15) . ?
N4 P2 1.6079(15) . ?
N4 Si4 1.7182(15) . ?
P2 C31 1.8675(18) . ?
P2 C35 1.8748(18) . ?
Si3 C41 1.8593(19) . ?
Si3 C42 1.8804(19) . ?
Si3 C43 1.8816(19) . ?
Si4 C44 1.869(2) . ?
Si4 C45 1.874(2) . ?
Si4 C46 1.880(2) . ?
C1 C61 1.478(2) . ?
C1 C51 1.486(2) . ?
C11 C12 1.532(3) . ?
C11 C14 1.538(3) . ?
C11 C13 1.539(3) . ?
C15 C16 1.533(3) . ?
C15 C18 1.535(3) . ?
C15 C17 1.536(3) . ?
C31 C34 1.532(3) . ?
C31 C33 1.540(3) . ?
C31 C32 1.545(3) . ?
C35 C36 1.529(2) . ?
C35 C37 1.534(3) . ?
C35 C38 1.540(3) . ?
C51 C56 1.399(3) . ?
C51 C52 1.405(3) . ?
C52 C53 1.392(3) . ?
C53 C54 1.384(3) . ?
C54 C55 1.384(3) . ?
C55 C56 1.386(3) . ?
C61 C66 1.403(3) . ?
C61 C62 1.413(3) . ?
C62 C63 1.388(3) . ?
C63 C64 1.384(3) . ?
C64 C65 1.386(3) . ?
C65 C66 1.388(3) . ?
