#------------------------------------------------------------------------------
#$Date: 2016-03-26 16:09:43 +0100 (Sat 26 de Mar de 2016) $
#$Revision: 180378 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/47/7204754.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_7204754
loop_
_publ_author_name
'Afzaal, Mohammad'
'Crouch, David J.'
'O'Brien, Paul'
'Raftery, James'
'Skabara, Peter J.'
'White, Andrew J. P.'
'Williams, David J.'
_publ_section_title
;
 The synthesis, X-ray structures and CVD studies of some group 11
 complexes of iminobis(diisopropylphosphine selenides) and their use in
 the deposition of I/III/VI photovoltaic materials
;
_journal_issue                   2
_journal_name_full               'Journal of Materials Chemistry'
_journal_page_first              233
_journal_paper_doi               10.1039/b311743j
_journal_volume                  14
_journal_year                    2004
_chemical_formula_sum            'C36 H84 Cu3 N3 P6 Se6'
_chemical_formula_weight         1409.26
_chemical_name_systematic
;
?
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 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                 109.423(12)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   13.178(8)
_cell_length_b                   30.108(17)
_cell_length_c                   14.691(9)
_cell_measurement_reflns_used    2290
_cell_measurement_temperature    100(2)
_cell_measurement_theta_max      21.8835
_cell_measurement_theta_min      2.249
_cell_volume                     5497(6)
_computing_cell_refinement       'Bruker SMART'
_computing_data_collection       'Bruker SMART'
_computing_data_reduction        'Bruker SAINT'
_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 0.965
_diffrn_measured_fraction_theta_max 0.965
_diffrn_measurement_device_type  'CCD area detector'
_diffrn_measurement_method       'phi and omega 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  0.1302
_diffrn_reflns_av_sigmaI/netI    0.2018
_diffrn_reflns_limit_h_max       15
_diffrn_reflns_limit_h_min       -16
_diffrn_reflns_limit_k_max       37
_diffrn_reflns_limit_k_min       -36
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            30721
_diffrn_reflns_theta_full        27.10
_diffrn_reflns_theta_max         27.10
_diffrn_reflns_theta_min         1.62
_exptl_absorpt_coefficient_mu    5.325
_exptl_absorpt_correction_T_max  0.7766
_exptl_absorpt_correction_T_min  0.2980
_exptl_absorpt_correction_type   none
_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.703
_exptl_crystal_density_meas      0
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             2808
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.05
_refine_diff_density_max         1.039
_refine_diff_density_min         -1.115
_refine_diff_density_rms         0.174
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.740
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     511
_refine_ls_number_reflns         11700
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.740
_refine_ls_R_factor_all          0.1082
_refine_ls_R_factor_gt           0.0531
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0160P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1016
_refine_ls_wR_factor_ref         0.1134
_reflns_number_gt                5898
_reflns_number_total             11700
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b311743j.txt
_cod_data_source_block           s1684n
_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_original_sg_symbol_H-M      P2(1)/c
_cod_database_code               7204754
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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
C1 C 0.1727(7) 0.0888(3) 0.4806(5) 0.031(2) Uani 1 1 d . . .
H1 H 0.0935 0.0894 0.4689 0.037 Uiso 1 1 calc R . .
C2 C 0.1945(7) 0.1228(3) 0.4128(5) 0.029(2) Uani 1 1 d . . .
H2A H 0.2721 0.1246 0.4246 0.044 Uiso 1 1 calc R . .
H2B H 0.1678 0.1519 0.4242 0.044 Uiso 1 1 calc R . .
H2C H 0.1576 0.1138 0.3458 0.044 Uiso 1 1 calc R . .
C3 C 0.2005(8) 0.0411(3) 0.4596(6) 0.043(3) Uani 1 1 d . . .
H3A H 0.1515 0.0317 0.3964 0.065 Uiso 1 1 calc R . .
H3B H 0.1930 0.0211 0.5096 0.065 Uiso 1 1 calc R . .
H3C H 0.2748 0.0401 0.4595 0.065 Uiso 1 1 calc R . .
C4 C 0.1909(6) 0.0613(3) 0.6747(6) 0.022(2) Uani 1 1 d . . .
H4 H 0.2187 0.0318 0.6622 0.027 Uiso 1 1 calc R . .
C5 C 0.0691(6) 0.0583(3) 0.6432(6) 0.035(2) Uani 1 1 d . . .
H5A H 0.0485 0.0377 0.6857 0.053 Uiso 1 1 calc R . .
H5B H 0.0411 0.0474 0.5766 0.053 Uiso 1 1 calc R . .
H5C H 0.0391 0.0877 0.6470 0.053 Uiso 1 1 calc R . .
C6 C 0.2377(7) 0.0705(3) 0.7832(6) 0.044(3) Uani 1 1 d . . .
H6A H 0.2116 0.0992 0.7975 0.065 Uiso 1 1 calc R . .
H6B H 0.3164 0.0710 0.8031 0.065 Uiso 1 1 calc R . .
H6C H 0.2150 0.0470 0.8186 0.065 Uiso 1 1 calc R . .
C7 C 0.1124(6) 0.2190(2) 0.7049(5) 0.0149(18) Uani 1 1 d . . .
H7 H 0.0530 0.2218 0.6416 0.018 Uiso 1 1 calc R . .
C8 C 0.0731(6) 0.1874(3) 0.7675(5) 0.022(2) Uani 1 1 d . . .
H8A H 0.1284 0.1848 0.8313 0.033 Uiso 1 1 calc R . .
H8B H 0.0591 0.1581 0.7368 0.033 Uiso 1 1 calc R . .
H8C H 0.0067 0.1991 0.7746 0.033 Uiso 1 1 calc R . .
C9 C 0.1338(6) 0.2652(3) 0.7489(6) 0.027(2) Uani 1 1 d . . .
H9A H 0.0694 0.2761 0.7611 0.041 Uiso 1 1 calc R . .
H9B H 0.1517 0.2854 0.7041 0.041 Uiso 1 1 calc R . .
H9C H 0.1941 0.2640 0.8098 0.041 Uiso 1 1 calc R . .
C10 C 0.2669(6) 0.2381(2) 0.6061(5) 0.0130(17) Uani 1 1 d . . .
H10 H 0.2907 0.2655 0.6460 0.016 Uiso 1 1 calc R . .
C11 C 0.1691(6) 0.2501(3) 0.5172(5) 0.023(2) Uani 1 1 d . . .
H11A H 0.1907 0.2719 0.4777 0.034 Uiso 1 1 calc R . .
H11B H 0.1121 0.2626 0.5384 0.034 Uiso 1 1 calc R . .
H11C H 0.1423 0.2233 0.4789 0.034 Uiso 1 1 calc R . .
C12 C 0.3589(6) 0.2220(3) 0.5751(5) 0.0195(19) Uani 1 1 d . . .
H12A H 0.3365 0.1954 0.5348 0.029 Uiso 1 1 calc R . .
H12B H 0.4206 0.2148 0.6323 0.029 Uiso 1 1 calc R . .
H12C H 0.3793 0.2454 0.5380 0.029 Uiso 1 1 calc R . .
C13 C 0.7119(7) 0.0679(3) 0.7743(5) 0.028(2) Uani 1 1 d . . .
H13 H 0.6343 0.0679 0.7332 0.034 Uiso 1 1 calc R . .
C14 C 0.7639(8) 0.1102(3) 0.7520(6) 0.043(3) Uani 1 1 d . . .
H14A H 0.8399 0.1110 0.7921 0.065 Uiso 1 1 calc R . .
H14B H 0.7269 0.1363 0.7658 0.065 Uiso 1 1 calc R . .
H14C H 0.7580 0.1103 0.6837 0.065 Uiso 1 1 calc R . .
C15 C 0.7654(8) 0.0261(3) 0.7491(6) 0.051(3) Uani 1 1 d . . .
H15A H 0.7566 0.0264 0.6802 0.077 Uiso 1 1 calc R . .
H15B H 0.7313 -0.0005 0.7641 0.077 Uiso 1 1 calc R . .
H15C H 0.8422 0.0260 0.7871 0.077 Uiso 1 1 calc R . .
C16 C 0.6587(7) 0.0148(3) 0.9164(6) 0.025(2) Uani 1 1 d . . .
H16 H 0.7033 -0.0099 0.9042 0.030 Uiso 1 1 calc R . .
C17 C 0.6563(7) 0.0097(3) 1.0206(6) 0.046(3) Uani 1 1 d . . .
H17A H 0.6115 0.0332 1.0337 0.069 Uiso 1 1 calc R . .
H17B H 0.7296 0.0121 1.0665 0.069 Uiso 1 1 calc R . .
H17C H 0.6262 -0.0194 1.0276 0.069 Uiso 1 1 calc R . .
C18 C 0.5428(7) 0.0106(3) 0.8419(6) 0.032(2) Uani 1 1 d . . .
H18A H 0.5103 -0.0173 0.8529 0.048 Uiso 1 1 calc R . .
H18B H 0.5464 0.0108 0.7763 0.048 Uiso 1 1 calc R . .
H18C H 0.4990 0.0357 0.8497 0.048 Uiso 1 1 calc R . .
C19 C 1.0576(6) 0.0740(3) 1.0432(5) 0.024(2) Uani 1 1 d . . .
H19 H 1.0594 0.0424 1.0651 0.029 Uiso 1 1 calc R . .
C20 C 1.0677(7) 0.0739(3) 0.9420(6) 0.047(3) Uani 1 1 d . . .
H20A H 1.0719 0.1046 0.9212 0.070 Uiso 1 1 calc R . .
H20B H 1.0046 0.0593 0.8966 0.070 Uiso 1 1 calc R . .
H20C H 1.1329 0.0578 0.9438 0.070 Uiso 1 1 calc R . .
C21 C 1.1535(6) 0.0983(3) 1.1140(6) 0.034(2) Uani 1 1 d . . .
H21A H 1.2205 0.0838 1.1150 0.050 Uiso 1 1 calc R . .
H21B H 1.1478 0.0973 1.1788 0.050 Uiso 1 1 calc R . .
H21C H 1.1538 0.1292 1.0936 0.050 Uiso 1 1 calc R . .
C22 C 0.9311(6) 0.0949(3) 1.1657(5) 0.021(2) Uani 1 1 d . . .
H22 H 0.9879 0.1157 1.2052 0.025 Uiso 1 1 calc R . .
C23 C 0.8247(6) 0.1104(3) 1.1717(5) 0.026(2) Uani 1 1 d . . .
H23A H 0.7686 0.0888 1.1395 0.039 Uiso 1 1 calc R . .
H23B H 0.8064 0.1393 1.1399 0.039 Uiso 1 1 calc R . .
H23C H 0.8299 0.1131 1.2396 0.039 Uiso 1 1 calc R . .
C24 C 0.9603(6) 0.0480(2) 1.2078(5) 0.023(2) Uani 1 1 d . . .
H24A H 0.9497 0.0462 1.2706 0.035 Uiso 1 1 calc R . .
H24B H 1.0358 0.0417 1.2158 0.035 Uiso 1 1 calc R . .
H24C H 0.9142 0.0261 1.1636 0.035 Uiso 1 1 calc R . .
C25 C 0.7148(6) 0.3051(3) 1.0507(5) 0.0167(18) Uani 1 1 d . . .
H25 H 0.7451 0.3348 1.0764 0.020 Uiso 1 1 calc R . .
C26 C 0.5996(6) 0.3039(3) 1.0534(5) 0.024(2) Uani 1 1 d . . .
H26A H 0.5661 0.2755 1.0276 0.036 Uiso 1 1 calc R . .
H26B H 0.5580 0.3283 1.0142 0.036 Uiso 1 1 calc R . .
H26C H 0.6012 0.3073 1.1202 0.036 Uiso 1 1 calc R . .
C27 C 0.7839(6) 0.2706(3) 1.1188(5) 0.033(2) Uani 1 1 d . . .
H27A H 0.7806 0.2753 1.1837 0.050 Uiso 1 1 calc R . .
H27B H 0.8586 0.2735 1.1204 0.050 Uiso 1 1 calc R . .
H27C H 0.7572 0.2409 1.0961 0.050 Uiso 1 1 calc R . .
C28 C 0.8607(6) 0.3022(2) 0.9409(5) 0.0115(17) Uani 1 1 d . . .
H28 H 0.8957 0.2781 0.9876 0.014 Uiso 1 1 calc R . .
C29 C 0.8810(6) 0.2918(3) 0.8472(5) 0.026(2) Uani 1 1 d . . .
H29A H 0.8380 0.3118 0.7963 0.039 Uiso 1 1 calc R . .
H29B H 0.8604 0.2609 0.8286 0.039 Uiso 1 1 calc R . .
H29C H 0.9575 0.2959 0.8563 0.039 Uiso 1 1 calc R . .
C30 C 0.9123(6) 0.3459(3) 0.9858(6) 0.023(2) Uani 1 1 d . . .
H30A H 0.9891 0.3454 0.9935 0.035 Uiso 1 1 calc R . .
H30B H 0.9036 0.3497 1.0490 0.035 Uiso 1 1 calc R . .
H30C H 0.8775 0.3706 0.9436 0.035 Uiso 1 1 calc R . .
C31 C 0.5472(6) 0.4194(3) 0.8335(5) 0.021(2) Uani 1 1 d . . .
H31 H 0.4812 0.4329 0.7866 0.025 Uiso 1 1 calc R . .
C32 C 0.5384(8) 0.4241(3) 0.9348(6) 0.040(3) Uani 1 1 d . . .
H32A H 0.6005 0.4098 0.9822 0.060 Uiso 1 1 calc R . .
H32B H 0.4720 0.4099 0.9362 0.060 Uiso 1 1 calc R . .
H32C H 0.5372 0.4557 0.9506 0.060 Uiso 1 1 calc R . .
C33 C 0.6439(6) 0.4464(3) 0.8295(6) 0.024(2) Uani 1 1 d . . .
H33A H 0.6402 0.4764 0.8541 0.036 Uiso 1 1 calc R . .
H33B H 0.6429 0.4481 0.7626 0.036 Uiso 1 1 calc R . .
H33C H 0.7104 0.4319 0.8694 0.036 Uiso 1 1 calc R . .
C34 C 0.5478(6) 0.3623(3) 0.6739(5) 0.0187(19) Uani 1 1 d . . .
H34 H 0.6065 0.3826 0.6703 0.022 Uiso 1 1 calc R . .
C35 C 0.4405(6) 0.3808(3) 0.6034(5) 0.0207(19) Uani 1 1 d . . .
H35A H 0.4450 0.3827 0.5383 0.031 Uiso 1 1 calc R . .
H35B H 0.4273 0.4105 0.6246 0.031 Uiso 1 1 calc R . .
H35C H 0.3813 0.3610 0.6029 0.031 Uiso 1 1 calc R . .
C36 C 0.5727(7) 0.3159(3) 0.6434(5) 0.033(2) Uani 1 1 d . . .
H36A H 0.5156 0.2952 0.6445 0.049 Uiso 1 1 calc R . .
H36B H 0.6417 0.3055 0.6883 0.049 Uiso 1 1 calc R . .
H36C H 0.5766 0.3172 0.5780 0.049 Uiso 1 1 calc R . .
Cu1 Cu 0.46537(8) 0.13422(3) 0.78473(6) 0.0187(2) Uani 1 1 d . . .
Cu2 Cu 0.74525(8) 0.17759(3) 0.94123(7) 0.0213(3) Uani 1 1 d . . .
Cu3 Cu 0.46503(8) 0.25637(3) 0.82746(6) 0.0190(2) Uani 1 1 d . . .
N1 N 0.1928(5) 0.15062(19) 0.6227(4) 0.0099(14) Uani 1 1 d . . .
N2 N 0.8405(5) 0.0651(2) 0.9736(4) 0.0179(16) Uani 1 1 d . . .
N3 N 0.6667(5) 0.34422(19) 0.8660(4) 0.0150(15) Uani 1 1 d . . .
P1 P 0.23911(18) 0.10399(7) 0.60757(14) 0.0191(5) Uani 1 1 d . . .
P2 P 0.22948(16) 0.19638(7) 0.67973(13) 0.0140(5) Uani 1 1 d . . .
P3 P 0.71917(17) 0.06674(7) 0.90117(14) 0.0169(5) Uani 1 1 d . . .
P4 P 0.93026(17) 0.09791(7) 1.03999(14) 0.0178(5) Uani 1 1 d . . .
P5 P 0.71871(16) 0.30167(7) 0.92735(14) 0.0142(5) Uani 1 1 d . . .
P6 P 0.55152(17) 0.36182(7) 0.79944(14) 0.0162(5) Uani 1 1 d . . .
Se1 Se 0.36102(6) 0.19129(3) 0.82126(5) 0.01514(19) Uani 1 1 d . . .
Se2 Se 0.41021(7) 0.09526(3) 0.63858(6) 0.0254(2) Uani 1 1 d . . .
Se3 Se 0.61709(6) 0.12053(3) 0.92426(5) 0.01616(19) Uani 1 1 d . . .
Se4 Se 0.92981(7) 0.16761(3) 1.00161(7) 0.0293(2) Uani 1 1 d . . .
Se5 Se 0.64888(7) 0.23903(3) 0.85877(6) 0.0204(2) Uani 1 1 d . . .
Se6 Se 0.40468(6) 0.32964(3) 0.80329(6) 0.0200(2) Uani 1 1 d . . .
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'
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'
Se Se -0.0929 2.2259 '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'
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
C2 C1 C3 112.8(7) . . ?
C2 C1 P1 111.6(6) . . ?
C3 C1 P1 111.8(6) . . ?
C2 C1 H1 106.7 . . ?
C3 C1 H1 106.7 . . ?
P1 C1 H1 106.7 . . ?
C1 C2 H2A 109.5 . . ?
C1 C2 H2B 109.5 . . ?
H2A C2 H2B 109.5 . . ?
C1 C2 H2C 109.5 . . ?
H2A C2 H2C 109.5 . . ?
H2B C2 H2C 109.5 . . ?
C1 C3 H3A 109.5 . . ?
C1 C3 H3B 109.5 . . ?
H3A C3 H3B 109.5 . . ?
C1 C3 H3C 109.5 . . ?
H3A C3 H3C 109.5 . . ?
H3B C3 H3C 109.5 . . ?
C5 C4 C6 110.3(7) . . ?
C5 C4 P1 113.2(6) . . ?
C6 C4 P1 109.8(6) . . ?
C5 C4 H4 107.8 . . ?
C6 C4 H4 107.8 . . ?
P1 C4 H4 107.8 . . ?
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 . . ?
C4 C6 H6A 109.5 . . ?
C4 C6 H6B 109.5 . . ?
H6A C6 H6B 109.5 . . ?
C4 C6 H6C 109.5 . . ?
H6A C6 H6C 109.5 . . ?
H6B C6 H6C 109.5 . . ?
C9 C7 C8 111.5(6) . . ?
C9 C7 P2 112.1(5) . . ?
C8 C7 P2 111.5(5) . . ?
C9 C7 H7 107.2 . . ?
C8 C7 H7 107.2 . . ?
P2 C7 H7 107.2 . . ?
C7 C8 H8A 109.5 . . ?
C7 C8 H8B 109.5 . . ?
H8A C8 H8B 109.5 . . ?
C7 C8 H8C 109.5 . . ?
H8A C8 H8C 109.5 . . ?
H8B C8 H8C 109.5 . . ?
C7 C9 H9A 109.5 . . ?
C7 C9 H9B 109.5 . . ?
H9A C9 H9B 109.5 . . ?
C7 C9 H9C 109.5 . . ?
H9A C9 H9C 109.5 . . ?
H9B C9 H9C 109.5 . . ?
C12 C10 C11 110.3(6) . . ?
C12 C10 P2 111.1(5) . . ?
C11 C10 P2 110.4(5) . . ?
C12 C10 H10 108.3 . . ?
C11 C10 H10 108.3 . . ?
P2 C10 H10 108.3 . . ?
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 . . ?
C14 C13 C15 110.7(8) . . ?
C14 C13 P3 110.9(6) . . ?
C15 C13 P3 110.7(6) . . ?
C14 C13 H13 108.1 . . ?
C15 C13 H13 108.1 . . ?
P3 C13 H13 108.1 . . ?
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 C18 110.4(7) . . ?
C17 C16 P3 111.3(6) . . ?
C18 C16 P3 110.7(6) . . ?
C17 C16 H16 108.1 . . ?
C18 C16 H16 108.1 . . ?
P3 C16 H16 108.1 . . ?
C16 C17 H17A 109.5 . . ?
C16 C17 H17B 109.5 . . ?
H17A C17 H17B 109.5 . . ?
C16 C17 H17C 109.5 . . ?
H17A C17 H17C 109.5 . . ?
H17B C17 H17C 109.5 . . ?
C16 C18 H18A 109.5 . . ?
C16 C18 H18B 109.5 . . ?
H18A C18 H18B 109.5 . . ?
C16 C18 H18C 109.5 . . ?
H18A C18 H18C 109.5 . . ?
H18B C18 H18C 109.5 . . ?
C21 C19 C20 109.9(7) . . ?
C21 C19 P4 112.1(6) . . ?
C20 C19 P4 110.6(6) . . ?
C21 C19 H19 108.0 . . ?
C20 C19 H19 108.0 . . ?
P4 C19 H19 108.0 . . ?
C19 C20 H20A 109.5 . . ?
C19 C20 H20B 109.5 . . ?
H20A C20 H20B 109.5 . . ?
C19 C20 H20C 109.5 . . ?
H20A C20 H20C 109.5 . . ?
H20B C20 H20C 109.5 . . ?
C19 C21 H21A 109.5 . . ?
C19 C21 H21B 109.5 . . ?
H21A C21 H21B 109.5 . . ?
C19 C21 H21C 109.5 . . ?
H21A C21 H21C 109.5 . . ?
H21B C21 H21C 109.5 . . ?
C23 C22 C24 112.0(7) . . ?
C23 C22 P4 110.3(5) . . ?
C24 C22 P4 111.3(5) . . ?
C23 C22 H22 107.7 . . ?
C24 C22 H22 107.7 . . ?
P4 C22 H22 107.7 . . ?
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 . . ?
C27 C25 C26 110.4(6) . . ?
C27 C25 P5 113.9(5) . . ?
C26 C25 P5 112.2(5) . . ?
C27 C25 H25 106.6 . . ?
C26 C25 H25 106.6 . . ?
P5 C25 H25 106.6 . . ?
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 . . ?
C29 C28 C30 112.5(6) . . ?
C29 C28 P5 112.6(5) . . ?
C30 C28 P5 110.5(5) . . ?
C29 C28 H28 106.9 . . ?
C30 C28 H28 106.9 . . ?
P5 C28 H28 106.9 . . ?
C28 C29 H29A 109.5 . . ?
C28 C29 H29B 109.5 . . ?
H29A C29 H29B 109.5 . . ?
C28 C29 H29C 109.5 . . ?
H29A C29 H29C 109.5 . . ?
H29B C29 H29C 109.5 . . ?
C28 C30 H30A 109.5 . . ?
C28 C30 H30B 109.5 . . ?
H30A C30 H30B 109.5 . . ?
C28 C30 H30C 109.5 . . ?
H30A C30 H30C 109.5 . . ?
H30B C30 H30C 109.5 . . ?
C33 C31 C32 108.6(7) . . ?
C33 C31 P6 113.3(6) . . ?
C32 C31 P6 112.1(6) . . ?
C33 C31 H31 107.5 . . ?
C32 C31 H31 107.5 . . ?
P6 C31 H31 107.5 . . ?
C31 C32 H32A 109.5 . . ?
C31 C32 H32B 109.5 . . ?
H32A C32 H32B 109.5 . . ?
C31 C32 H32C 109.5 . . ?
H32A C32 H32C 109.5 . . ?
H32B C32 H32C 109.5 . . ?
C31 C33 H33A 109.5 . . ?
C31 C33 H33B 109.5 . . ?
H33A C33 H33B 109.5 . . ?
C31 C33 H33C 109.5 . . ?
H33A C33 H33C 109.5 . . ?
H33B C33 H33C 109.5 . . ?
C36 C34 C35 111.6(7) . . ?
C36 C34 P6 110.4(5) . . ?
C35 C34 P6 112.9(5) . . ?
C36 C34 H34 107.2 . . ?
C35 C34 H34 107.2 . . ?
P6 C34 H34 107.2 . . ?
C34 C35 H35A 109.5 . . ?
C34 C35 H35B 109.5 . . ?
H35A C35 H35B 109.5 . . ?
C34 C35 H35C 109.5 . . ?
H35A C35 H35C 109.5 . . ?
H35B C35 H35C 109.5 . . ?
C34 C36 H36A 109.5 . . ?
C34 C36 H36B 109.5 . . ?
H36A C36 H36B 109.5 . . ?
C34 C36 H36C 109.5 . . ?
H36A C36 H36C 109.5 . . ?
H36B C36 H36C 109.5 . . ?
Se2 Cu1 Se1 122.98(5) . . ?
Se2 Cu1 Se3 128.34(6) . . ?
Se1 Cu1 Se3 108.39(5) . . ?
Se4 Cu2 Se5 128.39(5) . . ?
Se4 Cu2 Se3 124.68(6) . . ?
Se5 Cu2 Se3 105.91(6) . . ?
Se6 Cu3 Se5 120.86(5) . . ?
Se6 Cu3 Se1 127.68(6) . . ?
Se5 Cu3 Se1 111.44(6) . . ?
P1 N1 P2 141.0(4) . . ?
P4 N2 P3 139.4(4) . . ?
P5 N3 P6 139.4(4) . . ?
N1 P1 C1 106.8(3) . . ?
N1 P1 C4 109.0(3) . . ?
C1 P1 C4 103.6(4) . . ?
N1 P1 Se2 120.3(2) . . ?
C1 P1 Se2 107.2(3) . . ?
C4 P1 Se2 108.7(3) . . ?
N1 P2 C10 112.0(3) . . ?
N1 P2 C7 107.3(3) . . ?
C10 P2 C7 105.9(3) . . ?
N1 P2 Se1 115.8(2) . . ?
C10 P2 Se1 108.7(2) . . ?
C7 P2 Se1 106.5(2) . . ?
N2 P3 C16 106.0(4) . . ?
N2 P3 C13 112.3(4) . . ?
C16 P3 C13 105.5(4) . . ?
N2 P3 Se3 116.5(2) . . ?
C16 P3 Se3 107.5(3) . . ?
C13 P3 Se3 108.3(3) . . ?
N2 P4 C19 105.1(4) . . ?
N2 P4 C22 109.7(4) . . ?
C19 P4 C22 104.9(4) . . ?
N2 P4 Se4 120.0(2) . . ?
C19 P4 Se4 108.3(3) . . ?
C22 P4 Se4 107.8(3) . . ?
N3 P5 C28 106.9(3) . . ?
N3 P5 C25 111.5(3) . . ?
C28 P5 C25 104.9(3) . . ?
N3 P5 Se5 113.5(2) . . ?
C28 P5 Se5 108.6(2) . . ?
C25 P5 Se5 111.0(3) . . ?
N3 P6 C31 105.0(4) . . ?
N3 P6 C34 108.8(3) . . ?
C31 P6 C34 106.1(4) . . ?
N3 P6 Se6 120.4(2) . . ?
C31 P6 Se6 107.9(3) . . ?
C34 P6 Se6 107.7(3) . . ?
P2 Se1 Cu1 99.71(7) . . ?
P2 Se1 Cu3 103.84(7) . . ?
Cu1 Se1 Cu3 103.63(6) . . ?
P1 Se2 Cu1 96.68(7) . . ?
P3 Se3 Cu2 95.68(8) . . ?
P3 Se3 Cu1 112.12(7) . . ?
Cu2 Se3 Cu1 109.38(5) . . ?
P4 Se4 Cu2 97.86(7) . . ?
P5 Se5 Cu2 111.69(8) . . ?
P5 Se5 Cu3 98.38(7) . . ?
Cu2 Se5 Cu3 128.20(5) . . ?
P6 Se6 Cu3 99.42(7) . . ?
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 C2 1.520(11) . ?
C1 C3 1.539(11) . ?
C1 P1 1.835(8) . ?
C1 H1 1.0000 . ?
C2 H2A 0.9800 . ?
C2 H2B 0.9800 . ?
C2 H2C 0.9800 . ?
C3 H3A 0.9800 . ?
C3 H3B 0.9800 . ?
C3 H3C 0.9800 . ?
C4 C5 1.518(10) . ?
C4 C6 1.531(11) . ?
C4 P1 1.856(8) . ?
C4 H4 1.0000 . ?
C5 H5A 0.9800 . ?
C5 H5B 0.9800 . ?
C5 H5C 0.9800 . ?
C6 H6A 0.9800 . ?
C6 H6B 0.9800 . ?
C6 H6C 0.9800 . ?
C7 C9 1.520(10) . ?
C7 C8 1.527(10) . ?
C7 P2 1.834(7) . ?
C7 H7 1.0000 . ?
C8 H8A 0.9800 . ?
C8 H8B 0.9800 . ?
C8 H8C 0.9800 . ?
C9 H9A 0.9800 . ?
C9 H9B 0.9800 . ?
C9 H9C 0.9800 . ?
C10 C12 1.510(9) . ?
C10 C11 1.543(10) . ?
C10 P2 1.829(7) . ?
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 1.532(11) . ?
C13 C15 1.545(11) . ?
C13 P3 1.834(8) . ?
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 1.549(11) . ?
C16 C18 1.560(11) . ?
C16 P3 1.803(8) . ?
C16 H16 1.0000 . ?
C17 H17A 0.9800 . ?
C17 H17B 0.9800 . ?
C17 H17C 0.9800 . ?
C18 H18A 0.9800 . ?
C18 H18B 0.9800 . ?
C18 H18C 0.9800 . ?
C19 C21 1.530(10) . ?
C19 C20 1.536(10) . ?
C19 P4 1.813(8) . ?
C19 H19 1.0000 . ?
C20 H20A 0.9800 . ?
C20 H20B 0.9800 . ?
C20 H20C 0.9800 . ?
C21 H21A 0.9800 . ?
C21 H21B 0.9800 . ?
C21 H21C 0.9800 . ?
C22 C23 1.508(10) . ?
C22 C24 1.539(10) . ?
C22 P4 1.846(7) . ?
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 C27 1.517(10) . ?
C25 C26 1.533(10) . ?
C25 P5 1.832(7) . ?
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 . ?
C28 C29 1.519(9) . ?
C28 C30 1.526(9) . ?
C28 P5 1.815(7) . ?
C28 H28 1.0000 . ?
C29 H29A 0.9800 . ?
C29 H29B 0.9800 . ?
C29 H29C 0.9800 . ?
C30 H30A 0.9800 . ?
C30 H30B 0.9800 . ?
C30 H30C 0.9800 . ?
C31 C33 1.529(10) . ?
C31 C32 1.537(10) . ?
C31 P6 1.809(8) . ?
C31 H31 1.0000 . ?
C32 H32A 0.9800 . ?
C32 H32B 0.9800 . ?
C32 H32C 0.9800 . ?
C33 H33A 0.9800 . ?
C33 H33B 0.9800 . ?
C33 H33C 0.9800 . ?
C34 C36 1.537(10) . ?
C34 C35 1.552(10) . ?
C34 P6 1.829(7) . ?
C34 H34 1.0000 . ?
C35 H35A 0.9800 . ?
C35 H35B 0.9800 . ?
C35 H35C 0.9800 . ?
C36 H36A 0.9800 . ?
C36 H36B 0.9800 . ?
C36 H36C 0.9800 . ?
Cu1 Se2 2.3400(16) . ?
Cu1 Se1 2.3712(15) . ?
Cu1 Se3 2.3756(16) . ?
Cu2 Se4 2.3146(19) . ?
Cu2 Se5 2.3408(16) . ?
Cu2 Se3 2.3635(16) . ?
Cu3 Se6 2.3318(18) . ?
Cu3 Se5 2.3692(19) . ?
Cu3 Se1 2.3755(16) . ?
N1 P1 1.575(6) . ?
N1 P2 1.602(6) . ?
N2 P4 1.599(6) . ?
N2 P3 1.601(6) . ?
N3 P5 1.585(6) . ?
N3 P6 1.598(6) . ?
P1 Se2 2.163(3) . ?
P2 Se1 2.226(2) . ?
P3 Se3 2.202(2) . ?
P4 Se4 2.172(3) . ?
P5 Se5 2.191(2) . ?
P6 Se6 2.182(2) . ?
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
P2 N1 P1 C1 -142.9(6) . . . . ?
P2 N1 P1 C4 105.7(6) . . . . ?
P2 N1 P1 Se2 -20.7(7) . . . . ?
C2 C1 P1 N1 59.8(7) . . . . ?
C3 C1 P1 N1 -172.8(6) . . . . ?
C2 C1 P1 C4 174.8(6) . . . . ?
C3 C1 P1 C4 -57.8(7) . . . . ?
C2 C1 P1 Se2 -70.3(6) . . . . ?
C3 C1 P1 Se2 57.1(7) . . . . ?
C5 C4 P1 N1 58.7(7) . . . . ?
C6 C4 P1 N1 -65.0(6) . . . . ?
C5 C4 P1 C1 -54.7(7) . . . . ?
C6 C4 P1 C1 -178.4(6) . . . . ?
C5 C4 P1 Se2 -168.5(5) . . . . ?
C6 C4 P1 Se2 67.8(6) . . . . ?
P1 N1 P2 C10 94.4(6) . . . . ?
P1 N1 P2 C7 -149.8(6) . . . . ?
P1 N1 P2 Se1 -31.0(6) . . . . ?
C12 C10 P2 N1 -59.7(6) . . . . ?
C11 C10 P2 N1 63.0(6) . . . . ?
C12 C10 P2 C7 -176.4(5) . . . . ?
C11 C10 P2 C7 -53.7(6) . . . . ?
C12 C10 P2 Se1 69.5(5) . . . . ?
C11 C10 P2 Se1 -167.7(4) . . . . ?
C9 C7 P2 N1 -173.4(5) . . . . ?
C8 C7 P2 N1 60.8(6) . . . . ?
C9 C7 P2 C10 -53.6(6) . . . . ?
C8 C7 P2 C10 -179.3(5) . . . . ?
C9 C7 P2 Se1 62.0(5) . . . . ?
C8 C7 P2 Se1 -63.8(5) . . . . ?
P4 N2 P3 C16 -145.9(6) . . . . ?
P4 N2 P3 C13 99.4(7) . . . . ?
P4 N2 P3 Se3 -26.4(7) . . . . ?
C17 C16 P3 N2 62.3(7) . . . . ?
C18 C16 P3 N2 -174.6(6) . . . . ?
C17 C16 P3 C13 -178.5(6) . . . . ?
C18 C16 P3 C13 -55.3(7) . . . . ?
C17 C16 P3 Se3 -63.0(6) . . . . ?
C18 C16 P3 Se3 60.2(6) . . . . ?
C14 C13 P3 N2 -63.4(7) . . . . ?
C15 C13 P3 N2 59.9(7) . . . . ?
C14 C13 P3 C16 -178.5(6) . . . . ?
C15 C13 P3 C16 -55.2(7) . . . . ?
C14 C13 P3 Se3 66.7(6) . . . . ?
C15 C13 P3 Se3 -170.0(6) . . . . ?
P3 N2 P4 C19 -149.9(6) . . . . ?
P3 N2 P4 C22 97.8(6) . . . . ?
P3 N2 P4 Se4 -27.8(7) . . . . ?
C21 C19 P4 N2 -173.1(6) . . . . ?
C20 C19 P4 N2 63.8(7) . . . . ?
C21 C19 P4 C22 -57.4(7) . . . . ?
C20 C19 P4 C22 179.5(7) . . . . ?
C21 C19 P4 Se4 57.5(6) . . . . ?
C20 C19 P4 Se4 -65.6(7) . . . . ?
C23 C22 P4 N2 -62.8(6) . . . . ?
C24 C22 P4 N2 62.2(6) . . . . ?
C23 C22 P4 C19 -175.2(6) . . . . ?
C24 C22 P4 C19 -50.3(7) . . . . ?
C23 C22 P4 Se4 69.5(6) . . . . ?
C24 C22 P4 Se4 -165.5(5) . . . . ?
P6 N3 P5 C28 158.2(6) . . . . ?
P6 N3 P5 C25 -87.6(6) . . . . ?
P6 N3 P5 Se5 38.6(7) . . . . ?
C29 C28 P5 N3 -71.1(6) . . . . ?
C30 C28 P5 N3 55.6(6) . . . . ?
C29 C28 P5 C25 170.3(6) . . . . ?
C30 C28 P5 C25 -62.9(6) . . . . ?
C29 C28 P5 Se5 51.6(6) . . . . ?
C30 C28 P5 Se5 178.4(4) . . . . ?
C27 C25 P5 N3 -167.6(5) . . . . ?
C26 C25 P5 N3 66.0(6) . . . . ?
C27 C25 P5 C28 -52.3(6) . . . . ?
C26 C25 P5 C28 -178.6(5) . . . . ?
C27 C25 P5 Se5 64.8(6) . . . . ?
C26 C25 P5 Se5 -61.5(6) . . . . ?
P5 N3 P6 C31 138.0(6) . . . . ?
P5 N3 P6 C34 -108.7(6) . . . . ?
P5 N3 P6 Se6 16.2(7) . . . . ?
C33 C31 P6 N3 52.8(6) . . . . ?
C32 C31 P6 N3 -70.6(7) . . . . ?
C33 C31 P6 C34 -62.4(6) . . . . ?
C32 C31 P6 C34 174.3(6) . . . . ?
C33 C31 P6 Se6 -177.6(5) . . . . ?
C32 C31 P6 Se6 59.1(6) . . . . ?
C36 C34 P6 N3 56.7(7) . . . . ?
C35 C34 P6 N3 -177.6(5) . . . . ?
C36 C34 P6 C31 169.2(6) . . . . ?
C35 C34 P6 C31 -65.1(6) . . . . ?
C36 C34 P6 Se6 -75.4(6) . . . . ?
C35 C34 P6 Se6 50.3(6) . . . . ?
N1 P2 Se1 Cu1 35.9(2) . . . . ?
C10 P2 Se1 Cu1 -91.2(3) . . . . ?
C7 P2 Se1 Cu1 155.1(3) . . . . ?
N1 P2 Se1 Cu3 142.7(2) . . . . ?
C10 P2 Se1 Cu3 15.6(3) . . . . ?
C7 P2 Se1 Cu3 -98.1(3) . . . . ?
Se2 Cu1 Se1 P2 -6.14(8) . . . . ?
Se3 Cu1 Se1 P2 179.67(7) . . . . ?
Se2 Cu1 Se1 Cu3 -113.07(6) . . . . ?
Se3 Cu1 Se1 Cu3 72.74(6) . . . . ?
Se6 Cu3 Se1 P2 51.93(8) . . . . ?
Se5 Cu3 Se1 P2 -126.50(7) . . . . ?
Se6 Cu3 Se1 Cu1 155.73(6) . . . . ?
Se5 Cu3 Se1 Cu1 -22.71(6) . . . . ?
N1 P1 Se2 Cu1 43.9(3) . . . . ?
C1 P1 Se2 Cu1 166.0(3) . . . . ?
C4 P1 Se2 Cu1 -82.6(3) . . . . ?
Se1 Cu1 Se2 P1 -26.42(9) . . . . ?
Se3 Cu1 Se2 P1 146.55(8) . . . . ?
N2 P3 Se3 Cu2 46.5(3) . . . . ?
C16 P3 Se3 Cu2 165.2(3) . . . . ?
C13 P3 Se3 Cu2 -81.3(3) . . . . ?
N2 P3 Se3 Cu1 160.1(3) . . . . ?
C16 P3 Se3 Cu1 -81.2(3) . . . . ?
C13 P3 Se3 Cu1 32.3(3) . . . . ?
Se4 Cu2 Se3 P3 -29.73(8) . . . . ?
Se5 Cu2 Se3 P3 139.56(7) . . . . ?
Se4 Cu2 Se3 Cu1 -145.59(6) . . . . ?
Se5 Cu2 Se3 Cu1 23.70(6) . . . . ?
Se2 Cu1 Se3 P3 4.76(10) . . . . ?
Se1 Cu1 Se3 P3 178.54(7) . . . . ?
Se2 Cu1 Se3 Cu2 109.61(8) . . . . ?
Se1 Cu1 Se3 Cu2 -76.61(7) . . . . ?
N2 P4 Se4 Cu2 36.2(3) . . . . ?
C19 P4 Se4 Cu2 156.8(3) . . . . ?
C22 P4 Se4 Cu2 -90.2(3) . . . . ?
Se5 Cu2 Se4 P4 -171.07(7) . . . . ?
Se3 Cu2 Se4 P4 -4.25(9) . . . . ?
N3 P5 Se5 Cu2 171.7(3) . . . . ?
C28 P5 Se5 Cu2 53.1(3) . . . . ?
C25 P5 Se5 Cu2 -61.8(3) . . . . ?
N3 P5 Se5 Cu3 -51.3(3) . . . . ?
C28 P5 Se5 Cu3 -169.9(2) . . . . ?
C25 P5 Se5 Cu3 75.2(3) . . . . ?
Se4 Cu2 Se5 P5 -44.32(10) . . . . ?
Se3 Cu2 Se5 P5 146.93(7) . . . . ?
Se4 Cu2 Se5 Cu3 -165.15(6) . . . . ?
Se3 Cu2 Se5 Cu3 26.10(8) . . . . ?
Se6 Cu3 Se5 P5 28.11(8) . . . . ?
Se1 Cu3 Se5 P5 -153.34(7) . . . . ?
Se6 Cu3 Se5 Cu2 154.35(5) . . . . ?
Se1 Cu3 Se5 Cu2 -27.09(8) . . . . ?
N3 P6 Se6 Cu3 -35.0(3) . . . . ?
C31 P6 Se6 Cu3 -155.5(3) . . . . ?
C34 P6 Se6 Cu3 90.3(3) . . . . ?
Se5 Cu3 Se6 P6 7.46(8) . . . . ?
Se1 Cu3 Se6 P6 -170.84(7) . . . . ?
