#------------------------------------------------------------------------------
#$Date: 2016-02-16 03:10:39 +0200 (Tue, 16 Feb 2016) $
#$Revision: 176453 $
#$URL: svn://www.crystallography.net/cod/cif/7/03/14/7031405.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_7031405
loop_
_publ_author_name
'Privér, Steven H'
'Bennett, Martin A.'
'Willis, Anthony C.'
'Pottabathula, Srinivas'
'Lakshmi Kantam, M.'
'Bhargava, Suresh K.'
_publ_section_title
;
 ortho-Metallated triphenylphosphine chalcogenide complexes of platinum
 and palladium: synthesis and catalytic activity.
;
_journal_issue                   31
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              12000
_journal_page_last               12012
_journal_paper_doi               10.1039/c4dt01236d
_journal_volume                  43
_journal_year                    2014
_chemical_compound_source        ' from RMIT University'
_chemical_formula_moiety         'C36 H28 P2 Pd Se2, 2(C2 H4 Cl2)'
_chemical_formula_sum            'C40 H36 Cl4 P2 Pd Se2'
_chemical_formula_weight         984.80
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_audit_creation_date             09-02-24
_audit_creation_method           CRYSTALS_ver_12.85
_audit_update_record
;
2009-02-25- Report on C40 H36 Cl4 P2 Pd1 Se2 
             by   Anthony C. Willis
             for  Steven Priver and Martin Bennett

2009-02-25- passes checkcif tests with minor warnings  
;
_cell_angle_alpha                90
_cell_angle_beta                 107.2684(8)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   16.0798(2)
_cell_length_b                   11.3798(2)
_cell_length_c                   22.5745(3)
_cell_measurement_reflns_used    39222
_cell_measurement_temperature    200
_cell_measurement_theta_max      30
_cell_measurement_theta_min      2.6
_cell_volume                     3944.60(10)
_computing_cell_refinement       'DENZO/SCALEPACK (Otwinowski & Minor, 1997)'
_computing_data_collection       'COLLECT (Nonius, 1997-2001).'
_computing_data_reduction        'DENZO/SCALEPACK (Otwinowski & Minor, 1997)'
_computing_molecular_graphics
; 
ORTEP-II (Johnson 1976) in teXsan (MSC, 1992-1997)
;
_computing_publication_material  'CRYSTALS (Betteridge et al., 2003)'
_computing_structure_refinement  'CRYSTALS (Betteridge et al., 2003)'
_computing_structure_solution    'SIR92 (Altomare et al., 1994)'
_diffrn_ambient_temperature      200
_diffrn_measured_fraction_theta_full 0.994
_diffrn_measured_fraction_theta_max 0.993
_diffrn_measurement_device       'Nonius KappaCCD'
_diffrn_measurement_device_type  Area
_diffrn_measurement_method       ' φ and ω scans with CCD '
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.065
_diffrn_reflns_limit_h_max       22
_diffrn_reflns_limit_h_min       -22
_diffrn_reflns_limit_k_max       16
_diffrn_reflns_limit_k_min       -16
_diffrn_reflns_limit_l_max       31
_diffrn_reflns_limit_l_min       -31
_diffrn_reflns_number            40812
_diffrn_reflns_theta_full        29.477
_diffrn_reflns_theta_max         30.078
_diffrn_reflns_theta_min         2.654
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    2.697
_exptl_absorpt_correction_T_max  0.601
_exptl_absorpt_correction_T_min  0.392
_exptl_absorpt_correction_type   integration
_exptl_absorpt_process_details
;
via Gaussian method (Coppens, 1970) implemented in maXus (2000)
;
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.658
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1952
_exptl_crystal_size_max          0.43
_exptl_crystal_size_mid          0.29
_exptl_crystal_size_min          0.23
_refine_diff_density_max         0.87
_refine_diff_density_min         -0.71
_refine_ls_extinction_coef       610(40)
_refine_ls_extinction_method     'Larson (1970), Equation 22'
_refine_ls_goodness_of_fit_ref   1.0021
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     260
_refine_ls_number_reflns         5747
_refine_ls_number_restraints     75
_refine_ls_R_factor_all          0.0398
_refine_ls_R_factor_gt           0.0330
_refine_ls_shift/su_max          0.019158
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
;
 Method= Modified Sheldrick 
 w=1/[σ²(F²) + ( 0.06P)² + 1.21P] 
 ,where P=(max(Fo²,0) + 2Fc²)/3 
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_all         0.0937
_refine_ls_wR_factor_gt          0.0916
_refine_ls_wR_factor_ref         0.0937
_reflns_limit_h_max              21
_reflns_limit_h_min              -22
_reflns_limit_k_max              16
_reflns_limit_k_min              0
_reflns_limit_l_max              31
_reflns_limit_l_min              0
_reflns_number_gt                4719
_reflns_number_total             5748
_reflns_threshold_expression     I>2.0σ(I)
_oxford_diffrn_Wilson_B_factor   2.71
_oxford_diffrn_Wilson_scale      5.13
_oxford_refine_ls_r_factor_ref   0.0398
_oxford_refine_ls_scale          0.5178(10)
_oxford_reflns_number_all        5747
_oxford_reflns_threshold_expression_ref I>-10.0\s(I)
_oxford_structure_analysis_title '2241358 ben0902'
_cod_data_source_file            c4dt01236d2.cif
_cod_data_source_block           complex4
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/usr/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 2281 2013-09-26 08:29:07Z andrius 

 Adding full bibliography for 7031403--7031415.cif.
;
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_original_formula_sum        'C40 H36 Cl4 P2 Pd1 Se2'
_cod_database_code               7031405
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,-z
x+1/2,y+1/2,z
-x+1/2,-y+1/2,-z
-x,y,-z+1/2
x,-y,z+1/2
-x+1/2,y+1/2,-z+1/2
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_occupancy
_atom_site_adp_type
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Pd1 Pd 0.5 0.259348(19) 0.25 0.0331 1.0000 Uani S T . . .
Se1 Se 0.479614(16) 0.09994(2) 0.321652(11) 0.0405 1.0000 Uani . . . . .
Cl31 Cl 0.31348(18) 0.6171(5) 0.4478(4) 0.1367 0.506(6) Uani D U P s 1
Cl32 Cl 0.2743(2) 0.8873(2) 0.35923(15) 0.0964 0.506(6) Uani D U P s 1
Cl41 Cl 0.2918(4) 0.6216(4) 0.4243(3) 0.1300 0.494(6) Uani D U P s 2
Cl42 Cl 0.2844(4) 0.8969(4) 0.4076(3) 0.1801 0.494(6) Uani D U P s 2
P1 P 0.40667(4) 0.22444(5) 0.35784(3) 0.0371 1.0000 Uani . . . . .
C1 C 0.46126(16) 0.3631(2) 0.36149(10) 0.0396 1.0000 Uani . . . . .
C2 C 0.50016(15) 0.38357(19) 0.31457(10) 0.0367 1.0000 Uani . . . . .
C3 C 0.54792(16) 0.4893(2) 0.32009(12) 0.0441 1.0000 Uani . . . . .
C4 C 0.55328(19) 0.5679(2) 0.36818(12) 0.0507 1.0000 Uani . . . . .
C5 C 0.5118(2) 0.5466(2) 0.41212(13) 0.0580 1.0000 Uani . . . . .
C6 C 0.4653(2) 0.4427(2) 0.40941(12) 0.0505 1.0000 Uani . . . . .
C11 C 0.29483(17) 0.2402(2) 0.31003(12) 0.0419 1.0000 Uani . . . . .
C12 C 0.25309(18) 0.1495(3) 0.27044(13) 0.0509 1.0000 Uani . . . . .
C13 C 0.1664(2) 0.1612(3) 0.23575(15) 0.0627 1.0000 Uani . . . . .
C14 C 0.1214(2) 0.2619(3) 0.24112(17) 0.0652 1.0000 Uani . . . . .
C15 C 0.1617(2) 0.3507(3) 0.28055(16) 0.0623 1.0000 Uani . . . . .
C16 C 0.24866(19) 0.3409(2) 0.31486(14) 0.0531 1.0000 Uani . . . . .
C21 C 0.40190(19) 0.1850(2) 0.43425(11) 0.0465 1.0000 Uani . . . . .
C22 C 0.4807(2) 0.1701(3) 0.48163(12) 0.0599 1.0000 Uani . . . . .
C23 C 0.4784(3) 0.1372(3) 0.54057(14) 0.0760 1.0000 Uani . . . . .
C24 C 0.4025(3) 0.1196(3) 0.55236(15) 0.0803 1.0000 Uani . . . . .
C25 C 0.3252(3) 0.1333(4) 0.50655(19) 0.0926 1.0000 Uani . . . . .
C26 C 0.3252(2) 0.1660(4) 0.44693(15) 0.0730 1.0000 Uani . . . . .
C31 C 0.2191(9) 0.6883(14) 0.3998(9) 0.1413 0.506(6) Uani D U P s 1
C32 C 0.2255(7) 0.8329(10) 0.4154(5) 0.1090 0.506(6) Uani D U P s 1
C41 C 0.2029(7) 0.7161(15) 0.4110(9) 0.1267 0.494(6) Uani D U P s 2
C42 C 0.2250(8) 0.7895(12) 0.3650(6) 0.1410 0.494(6) Uani D U P s 2
H31 H 0.5786 0.5080 0.2886 0.0517 1.0000 Uiso R . . . .
H41 H 0.5881 0.6416 0.3708 0.0575 1.0000 Uiso R . . . .
H51 H 0.5149 0.6051 0.4457 0.0669 1.0000 Uiso R . . . .
H61 H 0.4351 0.4253 0.4413 0.0608 1.0000 Uiso R . . . .
H121 H 0.2857 0.0763 0.2671 0.0615 1.0000 Uiso R . . . .
H131 H 0.1366 0.0969 0.2070 0.0747 1.0000 Uiso R . . . .
H141 H 0.0589 0.2704 0.2161 0.0775 1.0000 Uiso R . . . .
H151 H 0.1281 0.4228 0.2845 0.0759 1.0000 Uiso R . . . .
H161 H 0.2780 0.4062 0.3430 0.0638 1.0000 Uiso R . . . .
H221 H 0.5376 0.1830 0.4732 0.0706 1.0000 Uiso R . . . .
H231 H 0.5343 0.1265 0.5745 0.0890 1.0000 Uiso R . . . .
H241 H 0.4022 0.0963 0.5950 0.1010 1.0000 Uiso R . . . .
H251 H 0.2688 0.1200 0.5158 0.1204 1.0000 Uiso R . . . .
H261 H 0.2688 0.1754 0.4134 0.0922 1.0000 Uiso R . . . .
H311 H 0.1661 0.6552 0.4083 0.1675 0.506 Uiso R . . s 1
H312 H 0.2150 0.6756 0.3552 0.1675 0.506 Uiso R . . s 1
H321 H 0.2631 0.8489 0.4586 0.1352 0.506 Uiso R . . s 1
H322 H 0.1666 0.8679 0.4095 0.1352 0.506 Uiso R . . s 1
H411 H 0.2022 0.7610 0.4489 0.1529 0.494 Uiso R . . s 2
H412 H 0.1460 0.6745 0.3937 0.1529 0.494 Uiso R . . s 2
H421 H 0.1715 0.8216 0.3343 0.1610 0.494 Uiso R . . s 2
H422 H 0.2597 0.7443 0.3425 0.1610 0.494 Uiso R . . s 2
loop_
_atom_type_symbol
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_Cromer_Mann_a1
_atom_type_scat_Cromer_Mann_b1
_atom_type_scat_Cromer_Mann_a2
_atom_type_scat_Cromer_Mann_b2
_atom_type_scat_Cromer_Mann_a3
_atom_type_scat_Cromer_Mann_b3
_atom_type_scat_Cromer_Mann_a4
_atom_type_scat_Cromer_Mann_b4
_atom_type_scat_Cromer_Mann_c
_atom_type_scat_source
C 0.0033 0.0016 2.3100 20.8439 1.0200 10.2075 1.5886 0.5687 0.8650 51.6512
0.2156 'International Tables Vol C 4.2.6.8 and 6.1.1.4'
H 0.0000 0.0000 0.4930 10.5109 0.3229 26.1257 0.1402 3.1424 0.0408 57.7998
0.0030 'International Tables Vol C 4.2.6.8 and 6.1.1.4'
Cl 0.1484 0.1585 11.4604 0.0104 7.1964 1.1662 6.2556 18.5194 1.6455 47.7784
-9.5574 'International Tables Vol C 4.2.6.8 and 6.1.1.4'
P 0.1023 0.0942 6.4345 1.9067 4.1791 27.1570 1.7800 0.5260 1.4908 68.1645
1.1149 'International Tables Vol C 4.2.6.8 and 6.1.1.4'
Pd -0.9988 1.0072 19.3319 0.6987 15.5017 7.9893 5.2954 25.2052 0.6058 76.8986
5.2659 'International Tables Vol C 4.2.6.8 and 6.1.1.4'
Se -0.0929 2.2259 17.0006 2.4098 5.8196 0.2726 3.9731 15.2372 4.3543 43.8163
2.8409 'International Tables Vol C 4.2.6.8 and 6.1.1.4'
loop_
_exptl_crystal_face_index_h
_exptl_crystal_face_index_k
_exptl_crystal_face_index_l
_exptl_crystal_face_perp_dist
1 0 0 0.170
-1 0 0 0.170
0 0 1 0.130
0 0 -1 0.160
0 1 0 0.230
0 -1 0 0.200
-1 0 1 0.100
1 0 -1 0.130
0 -4 -4 0.180
0 1 -1 0.208
1 -1 -1 0.150
-1 1 1 0.220
-2 -2 2 0.180
5 5 -5 0.215
loop_
_geom_angle_atom_site_label_1
_geom_angle_site_symmetry_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_3
_geom_angle
_geom_angle_publ_flag
C2 5_655 Pd1 Se1 5_655 90.75(6) yes
C2 5_655 Pd1 Se1 . 172.37(6) yes
Se1 5_655 Pd1 Se1 . 87.716(13) yes
C2 5_655 Pd1 C2 . 91.72(13) yes
Se1 5_655 Pd1 C2 . 172.37(6) yes
Se1 . Pd1 C2 . 90.75(6) yes
Pd1 . Se1 P1 . 87.652(17) yes
Se1 . P1 C1 . 106.38(8) yes
Se1 . P1 C11 . 113.33(9) yes
C1 . P1 C11 . 109.03(11) yes
Se1 . P1 C21 . 112.45(8) yes
C1 . P1 C21 . 109.48(11) yes
C11 . P1 C21 . 106.12(12) yes
P1 . C1 C2 . 115.71(16) yes
P1 . C1 C6 . 121.00(19) yes
C2 . C1 C6 . 123.3(2) yes
C1 . C2 Pd1 . 121.43(16) yes
C1 . C2 C3 . 115.4(2) yes
Pd1 . C2 C3 . 122.77(18) yes
C2 . C3 C4 . 121.6(2) yes
C2 . C3 H31 . 119.2 no
C4 . C3 H31 . 119.2 no
C3 . C4 C5 . 121.3(2) yes
C3 . C4 H41 . 119.3 no
C5 . C4 H41 . 119.3 no
C4 . C5 C6 . 119.3(2) yes
C4 . C5 H51 . 120.3 no
C6 . C5 H51 . 120.3 no
C1 . C6 C5 . 119.1(3) yes
C1 . C6 H61 . 120.5 no
C5 . C6 H61 . 120.4 no
P1 . C11 C12 . 120.8(2) yes
P1 . C11 C16 . 119.7(2) yes
C12 . C11 C16 . 119.5(3) yes
C11 . C12 C13 . 120.1(3) yes
C11 . C12 H121 . 120.0 no
C13 . C12 H121 . 119.9 no
C12 . C13 C14 . 119.7(3) yes
C12 . C13 H131 . 120.2 no
C14 . C13 H131 . 120.2 no
C13 . C14 C15 . 120.6(3) yes
C13 . C14 H141 . 119.7 no
C15 . C14 H141 . 119.7 no
C14 . C15 C16 . 120.3(3) yes
C14 . C15 H151 . 119.8 no
C16 . C15 H151 . 119.8 no
C15 . C16 C11 . 119.8(3) yes
C15 . C16 H161 . 120.1 no
C11 . C16 H161 . 120.1 no
P1 . C21 C22 . 118.2(2) yes
P1 . C21 C26 . 122.5(2) yes
C22 . C21 C26 . 119.2(3) yes
C21 . C22 C23 . 119.1(3) yes
C21 . C22 H221 . 120.4 no
C23 . C22 H221 . 120.4 no
C22 . C23 C24 . 120.9(3) yes
C22 . C23 H231 . 119.6 no
C24 . C23 H231 . 119.5 no
C23 . C24 C25 . 120.6(3) yes
C23 . C24 H241 . 119.7 no
C25 . C24 H241 . 119.7 no
C24 . C25 C26 . 119.9(4) yes
C24 . C25 H251 . 120.1 no
C26 . C25 H251 . 120.1 no
C25 . C26 C21 . 120.3(3) yes
C25 . C26 H261 . 119.9 no
C21 . C26 H261 . 119.9 no
Cl31 . C31 C32 . 109.3(9) yes
Cl31 . C31 H311 . 109.5 no
C32 . C31 H311 . 109.4 no
Cl31 . C31 H312 . 109.6 no
C32 . C31 H312 . 109.5 no
H311 . C31 H312 . 109.5 no
Cl32 . C32 C31 . 101.7(9) yes
Cl32 . C32 H321 . 111.3 no
C31 . C32 H321 . 111.4 no
Cl32 . C32 H322 . 111.4 no
C31 . C32 H322 . 111.4 no
H321 . C32 H322 . 109.5 no
Cl41 . C41 C42 . 96.6(9) yes
Cl41 . C41 H411 . 112.6 no
C42 . C41 H411 . 112.6 no
Cl41 . C41 H412 . 112.6 no
C42 . C41 H412 . 112.5 no
H411 . C41 H412 . 109.5 no
C41 . C42 Cl42 . 103.2(10) yes
C41 . C42 H421 . 111.1 no
Cl42 . C42 H421 . 111.0 no
C41 . C42 H422 . 110.9 no
Cl42 . C42 H422 . 111.0 no
H421 . C42 H422 . 109.5 no
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
Pd1 C2 5_655 2.030(2) yes
Pd1 Se1 5_655 2.5158(3) yes
Pd1 Se1 . 2.5158(3) yes
Pd1 C2 . 2.030(2) yes
Se1 P1 . 2.1493(6) yes
Cl31 C31 . 1.777(13) yes
Cl32 C32 . 1.788(9) yes
Cl41 C41 . 1.742(12) yes
Cl42 C42 . 1.669(13) yes
P1 C1 . 1.795(2) yes
P1 C11 . 1.811(3) yes
P1 C21 . 1.806(2) yes
C1 C2 . 1.400(3) yes
C1 C6 . 1.398(3) yes
C2 C3 . 1.413(3) yes
C3 C4 . 1.390(3) yes
C3 H31 . 1.000 no
C4 C5 . 1.372(4) yes
C4 H41 . 1.000 no
C5 C6 . 1.390(4) yes
C5 H51 . 1.000 no
C6 H61 . 1.000 no
C11 C12 . 1.399(4) yes
C11 C16 . 1.387(4) yes
C12 C13 . 1.388(4) yes
C12 H121 . 1.000 no
C13 C14 . 1.379(5) yes
C13 H131 . 1.000 no
C14 C15 . 1.375(5) yes
C14 H141 . 1.000 no
C15 C16 . 1.388(4) yes
C15 H151 . 1.000 no
C16 H161 . 1.000 no
C21 C22 . 1.405(4) yes
C21 C26 . 1.363(4) yes
C22 C23 . 1.393(4) yes
C22 H221 . 1.000 no
C23 C24 . 1.340(6) yes
C23 H231 . 1.000 no
C24 C25 . 1.370(6) yes
C24 H241 . 1.000 no
C25 C26 . 1.396(4) yes
C25 H251 . 1.000 no
C26 H261 . 1.000 no
C31 C32 . 1.678(16) yes
C31 H311 . 1.000 no
C31 H312 . 1.000 no
C32 H321 . 1.000 no
C32 H322 . 1.000 no
C41 C42 . 1.457(16) yes
C41 H411 . 1.000 no
C41 H412 . 1.000 no
C42 H421 . 1.000 no
C42 H422 . 1.000 no
loop_
_geom_contact_atom_site_label_1
_geom_contact_atom_site_label_2
_geom_contact_distance
_geom_contact_site_symmetry_2
_geom_contact_publ_flag
Cl31 C32 3.38(2) 4_566 no
Cl31 C6 3.450(7) . no
Cl32 C14 3.498(5) 7 no
Cl32 C12 3.554(4) 1_565 no
Cl41 C6 3.549(7) . no
Cl42 C26 3.202(6) 1_565 no
Cl42 C25 3.433(7) 1_565 no
C3 C32 3.51(1) 3_545 no
C3 C42 3.55(1) 3_545 no
C12 C42 3.56(1) 7_545 no
C13 C42 3.57(2) 7_545 no
C25 C25 3.545(9) 4_556 no
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_2
_geom_torsion_site_symmetry_3
_geom_torsion_site_symmetry_4
_geom_torsion
_geom_torsion_publ_flag
Pd1 Se1 P1 C1 . . . -38.73(7) no
Pd1 Se1 P1 C11 . . . 81.1(1) no
Pd1 Se1 P1 C21 . . . -158.57(9) no
Pd1 Se1 P1 C1 5_655 5_655 5_655 -38.73(7) no
Pd1 Se1 P1 C11 5_655 5_655 5_655 81.1(1) no
Pd1 Se1 P1 C21 5_655 5_655 5_655 -158.57(9) no
Pd1 C2 C1 P1 . . . -3.4(2) no
Pd1 C2 C1 C6 . . . 175.2(2) no
Pd1 C2 C3 C4 . . . -174.0(2) no
Pd1 C2 C1 P1 5_655 5_655 5_655 -3.4(2) no
Pd1 C2 C1 C6 5_655 5_655 5_655 175.2(2) no
Pd1 C2 C3 C4 5_655 5_655 5_655 -174.0(2) no
Se1 Pd1 Se1 P1 . 5_655 5_655 -155.44(2) no
Se1 Pd1 C2 C1 . . . -22.9(2) no
Se1 Pd1 C2 C3 . . . 149.1(2) no
Se1 P1 C1 C2 . . . 34.0(2) no
Se1 P1 C1 C6 . . . -144.7(2) no
Se1 P1 C11 C12 . . . 24.4(3) no
Se1 P1 C11 C16 . . . -158.7(2) no
Se1 P1 C21 C22 . . . 57.2(2) no
Se1 P1 C21 C26 . . . -120.9(3) no
Cl31 C31 C32 Cl32 . . . 93(1) no
Cl41 C41 C42 Cl42 . . . -91.6(9) no
P1 Se1 Pd1 C2 . . . 32.04(7) no
P1 C1 C2 C3 . . . -175.9(2) no
P1 C1 C6 C5 . . . 176.9(2) no
P1 C11 C12 C13 . . . 177.7(3) no
P1 C11 C16 C15 . . . -176.8(3) no
P1 C21 C22 C23 . . . -178.6(2) no
P1 C21 C26 C25 . . . 178.7(3) no
C1 P1 C11 C12 . . . 142.7(2) no
C1 P1 C11 C16 . . . -40.5(3) no
C1 P1 C21 C22 . . . -60.9(2) no
C1 P1 C21 C26 . . . 121.1(3) no
C1 C2 Pd1 C2 . . 5_655 149.9(2) no
C1 C2 C3 C4 . . . -1.6(3) no
C1 C6 C5 C4 . . . -0.7(4) no
C2 Pd1 C2 C3 . 5_655 5_655 -38.1(1) no
C2 C1 P1 C11 . . . -88.6(2) no
C2 C1 P1 C21 . . . 155.7(2) no
C2 C1 C6 C5 . . . -1.6(4) no
C2 C3 C4 C5 . . . -0.5(4) no
C3 C2 C1 C6 . . . 2.7(3) no
C3 C4 C5 C6 . . . 1.7(4) no
C6 C1 P1 C11 . . . 92.8(2) no
C6 C1 P1 C21 . . . -22.9(2) no
C11 P1 C21 C22 . . . -178.4(2) no
C11 P1 C21 C26 . . . 3.6(3) no
C11 C12 C13 C14 . . . -0.8(5) no
C11 C16 C15 C14 . . . -1.0(5) no
C12 C11 P1 C21 . . . -99.5(3) no
C12 C11 C16 C15 . . . 0.1(5) no
C12 C13 C14 C15 . . . -0.0(6) no
C13 C12 C11 C16 . . . 0.8(5) no
C13 C14 C15 C16 . . . 0.9(6) no
C16 C11 P1 C21 . . . 77.4(3) no
C21 C22 C23 C24 . . . 0.1(5) no
C21 C26 C25 C24 . . . -0.4(6) no
C22 C21 C26 C25 . . . 0.7(6) no
C22 C23 C24 C25 . . . 0.2(6) no
C23 C22 C21 C26 . . . -0.5(5) no
C23 C24 C25 C26 . . . -0.0(6) no
