#------------------------------------------------------------------------------
#$Date: 2016-03-25 10:58:42 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179771 $
#$URL: svn://www.crystallography.net/cod/cif/7/00/67/7006799.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_7006799
loop_
_publ_author_name
'de Silva, Namal'
'Nichiporuk, Rita V.'
'Dahl, Lawrence F.'
_publ_section_title
;
 Syntheses and structural analyses of variable-stoichiometric Au-Pt-Ni
 carbonyl/phosphine clusters,
 Pt3(Pt(1-x)Ni(x))(AuPPh3)2(mu2-CO)4(CO)(PPh3)3 and
 Pt2(Pt(2-y)Ni(y))(AuPPh3)2(mu2-CO)4(CO)2(PPh3)2, with ligation-induced
 site-specific Pt/Ni substitutional disorder within butterfly-based
 Pt3(Pt(1-x)Ni(x))Au2 and Pt2(Pt(2-y)Ni(y))Au2 core-geometries.
;
_journal_issue                   19
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              2291
_journal_page_last               2300
_journal_paper_doi               10.1039/b514105m
_journal_year                    2006
_chemical_formula_moiety
;
Pt2Pt(2-y)Ni(y)Au2(PPh3)4(CO)6.MeCN (Crystal 2A)
y = 0.42
;
_chemical_formula_sum            'C82 H66 Au2 N2 Ni0.42 O6 P4 Pt3.58'
_chemical_formula_weight         2416.26
_chemical_name_systematic
;
?
;
_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
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                90.00
_cell_angle_beta                 125.5500(10)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   29.9250(12)
_cell_length_b                   16.0342(6)
_cell_length_c                   19.4952(8)
_cell_measurement_temperature    173(2)
_cell_volume                     7610.7(5)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.993
_diffrn_measured_fraction_theta_max 0.993
_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  0.1510
_diffrn_reflns_av_sigmaI/netI    0.1004
_diffrn_reflns_limit_h_max       39
_diffrn_reflns_limit_h_min       -39
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       25
_diffrn_reflns_limit_l_min       -25
_diffrn_reflns_number            35072
_diffrn_reflns_theta_full        28.29
_diffrn_reflns_theta_max         28.29
_diffrn_reflns_theta_min         1.52
_exptl_absorpt_coefficient_mu    10.636
_exptl_absorpt_correction_T_max  0.4478
_exptl_absorpt_correction_T_min  0.1614
_exptl_crystal_colour            red/orange
_exptl_crystal_density_diffrn    2.109
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
_exptl_crystal_F_000             4516
_exptl_crystal_size_max          0.27
_exptl_crystal_size_mid          0.24
_exptl_crystal_size_min          0.09
_refine_diff_density_max         2.493
_refine_diff_density_min         -5.149
_refine_diff_density_rms         0.692
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   0.977
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     345
_refine_ls_number_reflns         9387
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.977
_refine_ls_R_factor_all          0.0502
_refine_ls_R_factor_gt           0.0399
_refine_ls_shift/su_max          0.162
_refine_ls_shift/su_mean         0.002
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0555P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0964
_refine_ls_wR_factor_ref         0.1160
_reflns_number_gt                7769
_reflns_number_total             9387
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b514105m.txt
_cod_data_source_block           dahl269
_cod_original_sg_symbol_H-M      C2/c
_cod_database_code               7006799
loop_
_symmetry_equiv_pos_as_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'
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
Au2 Au 0.050290(11) 0.893148(15) 0.756233(15) 0.01748(8) Uani 1 1 d . . .
Ni2 Ni 0.030877(12) 0.778494(16) 0.840976(17) 0.01358(8) Uani 0.21 1 d P . 2
Pt1 Pt 0.058719(10) 0.683157(15) 0.757359(14) 0.01425(8) Uani 1 1 d . . .
Pt2 Pt 0.030877(12) 0.778494(16) 0.840976(17) 0.01358(8) Uani 0.79 1 d P . 1
N1 N 0.2913(4) 0.7480(6) 0.7243(6) 0.065(3) Uani 1 1 d . . .
O1 O 0.1271(2) 0.6630(3) 0.9492(3) 0.0233(10) Uani 1 1 d . . .
O2 O 0.0066(2) 0.6779(3) 0.5687(3) 0.0288(12) Uani 1 1 d . . .
O3 O 0.0815(3) 0.8961(3) 0.9866(4) 0.0418(15) Uani 1 1 d . . .
P1 P 0.11884(7) 0.58409(10) 0.77721(10) 0.0165(3) Uani 1 1 d . . .
P2 P 0.09336(7) 1.00705(10) 0.74964(10) 0.0166(3) Uani 1 1 d . . .
C1 C 0.0920(3) 0.6906(4) 0.8827(4) 0.0135(12) Uani 1 1 d . . .
C2 C 0.0142(3) 0.6971(4) 0.6323(4) 0.0207(14) Uani 1 1 d . . .
C3 C 0.0619(3) 0.8515(4) 0.9302(5) 0.0274(15) Uani 1 1 d . . .
C4 C 0.10768(8) 0.48247(8) 0.80697(12) 0.0213(14) Uani 1 1 d G . .
C5 C 0.13729(9) 0.41272(7) 0.81274(12) 0.0308(17) Uani 1 1 d G . .
H5 H 0.1620 0.4167 0.7985 0.037 Uiso 1 1 calc R . .
C6 C 0.12999(10) 0.33702(8) 0.83975(14) 0.0347(18) Uani 1 1 d G . .
H6 H 0.1498 0.2904 0.8436 0.042 Uiso 1 1 calc R . .
C7 C 0.09308(11) 0.33107(8) 0.86099(16) 0.038(2) Uani 1 1 d G . .
H7 H 0.0882 0.2804 0.8791 0.045 Uiso 1 1 calc R . .
C8 C 0.06347(10) 0.40081(9) 0.85522(16) 0.040(2) Uani 1 1 d G . .
H8 H 0.0388 0.3968 0.8694 0.048 Uiso 1 1 calc R . .
C9 C 0.07078(9) 0.47651(9) 0.82820(14) 0.0279(16) Uani 1 1 d G . .
H9 H 0.0510 0.5232 0.8243 0.034 Uiso 1 1 calc R . .
C10 C 0.12256(8) 0.55756(8) 0.68931(10) 0.0262(15) Uani 1 1 d G . .
C11 C 0.07939(9) 0.51378(8) 0.62224(10) 0.0348(18) Uani 1 1 d G . .
H11 H 0.0493 0.4999 0.6226 0.042 Uiso 1 1 calc R . .
C12 C 0.08007(10) 0.49021(9) 0.55439(11) 0.051(3) Uani 1 1 d G . .
H12 H 0.0506 0.4613 0.5092 0.061 Uiso 1 1 calc R . .
C13 C 0.12550(11) 0.51033(10) 0.55480(12) 0.055(3) Uani 1 1 d G . .
H13 H 0.1266 0.4939 0.5100 0.066 Uiso 1 1 calc R . .
C14 C 0.16894(10) 0.55441(10) 0.62102(12) 0.059(3) Uani 1 1 d G . .
H14 H 0.1989 0.5685 0.6205 0.071 Uiso 1 1 calc R . .
C15 C 0.16754(8) 0.57779(8) 0.68916(10) 0.043(2) Uani 1 1 d G . .
H15 H 0.1969 0.6069 0.7343 0.051 Uiso 1 1 calc R . .
C16 C 0.18837(7) 0.61253(8) 0.86182(9) 0.0164(13) Uani 1 1 d G . .
C17 C 0.22411(7) 0.56079(8) 0.92982(10) 0.0225(14) Uani 1 1 d G . .
H17 H 0.2128 0.5079 0.9332 0.027 Uiso 1 1 calc R . .
C18 C 0.27711(7) 0.58857(9) 0.99305(10) 0.0280(16) Uani 1 1 d G . .
H18 H 0.3010 0.5536 1.0380 0.034 Uiso 1 1 calc R . .
C19 C 0.29432(7) 0.66738(10) 0.98932(10) 0.0269(15) Uani 1 1 d G . .
H19 H 0.3295 0.6854 1.0318 0.032 Uiso 1 1 calc R . .
C20 C 0.25936(6) 0.71889(9) 0.92285(9) 0.0278(16) Uani 1 1 d G . .
H20 H 0.2710 0.7717 0.9198 0.033 Uiso 1 1 calc R . .
C21 C 0.20664(6) 0.69223(8) 0.86020(8) 0.0239(15) Uani 1 1 d G . .
H21 H 0.1829 0.7282 0.8161 0.029 Uiso 1 1 calc R . .
C22 C 0.13934(6) 0.97975(8) 0.72131(9) 0.0198(13) Uani 1 1 d G . .
C23 C 0.16597(6) 0.90303(8) 0.74733(9) 0.040(2) Uani 1 1 d G . .
H23 H 0.1587 0.8668 0.7770 0.048 Uiso 1 1 calc R . .
C24 C 0.20296(7) 0.87936(9) 0.73010(10) 0.048(3) Uani 1 1 d G . .
H24 H 0.2202 0.8277 0.7477 0.058 Uiso 1 1 calc R . .
C25 C 0.21393(8) 0.93368(10) 0.68633(12) 0.0309(17) Uani 1 1 d G . .
H25 H 0.2389 0.9185 0.6746 0.037 Uiso 1 1 calc R . .
C26 C 0.18838(9) 1.00913(9) 0.66036(12) 0.0277(16) Uani 1 1 d G . .
H26 H 0.1964 1.0452 0.6315 0.033 Uiso 1 1 calc R . .
C27 C 0.15100(8) 1.03281(8) 0.67600(10) 0.0224(14) Uani 1 1 d G . .
H27 H 0.1333 1.0840 0.6566 0.027 Uiso 1 1 calc R . .
C28 C 0.13682(8) 1.06707(8) 0.84759(10) 0.0182(13) Uani 1 1 d G . .
C29 C 0.18731(8) 1.09874(8) 0.87402(11) 0.0254(15) Uani 1 1 d G . .
H29 H 0.1998 1.0922 0.8405 0.030 Uiso 1 1 calc R . .
C30 C 0.21949(9) 1.14034(8) 0.95044(11) 0.0288(16) Uani 1 1 d G . .
H30 H 0.2539 1.1604 0.9687 0.035 Uiso 1 1 calc R . .
C31 C 0.20040(10) 1.15200(9) 0.99933(12) 0.0305(17) Uani 1 1 d G . .
H31 H 0.2221 1.1795 1.0508 0.037 Uiso 1 1 calc R . .
C32 C 0.14879(10) 1.12281(9) 0.97194(12) 0.0269(16) Uani 1 1 d G . .
H32 H 0.1354 1.1328 1.0039 0.032 Uiso 1 1 calc R . .
C33 C 0.11751(9) 1.07913(8) 0.89757(12) 0.0243(15) Uani 1 1 d G . .
H33 H 0.0836 1.0576 0.8804 0.029 Uiso 1 1 calc R . .
C34 C 0.04709(7) 1.08473(8) 0.67136(11) 0.0190(13) Uani 1 1 d G . .
C35 C 0.00654(7) 1.05788(9) 0.58873(11) 0.0272(16) Uani 1 1 d G . .
H35 H 0.0034 1.0014 0.5759 0.033 Uiso 1 1 calc R . .
C36 C -0.02830(8) 1.11334(11) 0.52700(12) 0.0365(19) Uani 1 1 d G . .
H36 H -0.0548 1.0944 0.4727 0.044 Uiso 1 1 calc R . .
C37 C -0.02415(9) 1.19744(10) 0.54511(14) 0.038(2) Uani 1 1 d G . .
H37 H -0.0475 1.2354 0.5030 0.046 Uiso 1 1 calc R . .
C38 C 0.01535(9) 1.22507(9) 0.62708(14) 0.041(2) Uani 1 1 d G . .
H38 H 0.0177 1.2813 0.6404 0.049 Uiso 1 1 calc R . .
C39 C 0.05065(8) 1.16871(8) 0.68787(12) 0.0306(17) Uani 1 1 d G . .
H39 H 0.0778 1.1879 0.7418 0.037 Uiso 1 1 calc R . .
C40 C 0.32433(8) 0.76173(12) 0.79291(17) 0.038(2) Uani 1 1 d G . .
C41 C 0.36588(7) 0.78124(12) 0.87979(17) 0.066(3) Uani 1 1 d G . .
H41A H 0.4002 0.7910 0.8875 0.099 Uiso 1 1 calc R . .
H41B H 0.3698 0.7354 0.9146 0.099 Uiso 1 1 calc R . .
H41C H 0.3554 0.8304 0.8954 0.099 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'
O O 0.0106 0.0060 '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'
Ni Ni 0.3393 1.1124 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pt Pt -1.7033 8.3905 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Au Au -2.0133 8.8022 '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'
H H 0.0000 0.0000 '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
P2 Au2 Pt2 143.15(4) . 2_556 ?
P2 Au2 Ni2 143.15(4) . 2_556 ?
Pt2 Au2 Ni2 0.000(16) 2_556 2_556 ?
P2 Au2 Ni2 153.19(4) . . ?
Pt2 Au2 Ni2 63.598(12) 2_556 . ?
Ni2 Au2 Ni2 63.598(12) 2_556 . ?
P2 Au2 Au2 126.38(4) . 2_556 ?
Pt2 Au2 Au2 58.569(9) 2_556 2_556 ?
Ni2 Au2 Au2 58.569(9) 2_556 2_556 ?
Ni2 Au2 Au2 58.291(9) . 2_556 ?
C3 Ni2 C1 102.5(3) . . ?
C3 Ni2 C2 101.6(3) . 2_556 ?
C1 Ni2 C2 91.5(2) . 2_556 ?
C3 Ni2 Pt1 141.5(2) . 2_556 ?
C1 Ni2 Pt1 100.40(17) . 2_556 ?
C2 Ni2 Pt1 47.21(18) 2_556 2_556 ?
C3 Ni2 Pt1 140.3(2) . . ?
C1 Ni2 Pt1 48.47(16) . . ?
C2 Ni2 Pt1 105.10(17) 2_556 . ?
Pt1 Ni2 Pt1 77.115(12) 2_556 . ?
C3 Ni2 Au2 89.1(2) . 2_556 ?
C1 Ni2 Au2 162.92(16) . 2_556 ?
C2 Ni2 Au2 98.43(19) 2_556 2_556 ?
Pt1 Ni2 Au2 76.876(11) 2_556 2_556 ?
Pt1 Ni2 Au2 115.043(12) . 2_556 ?
C3 Ni2 Au2 88.6(2) . . ?
C1 Ni2 Au2 104.19(17) . . ?
C2 Ni2 Au2 159.07(19) 2_556 . ?
Pt1 Ni2 Au2 115.040(12) 2_556 . ?
Pt1 Ni2 Au2 76.602(10) . . ?
Au2 Ni2 Au2 63.143(12) 2_556 . ?
C3 Ni2 Ni2 140.5(2) . 2_556 ?
C1 Ni2 Ni2 105.74(16) . 2_556 ?
C2 Ni2 Ni2 104.71(18) 2_556 2_556 ?
Pt1 Ni2 Ni2 57.618(10) 2_556 2_556 ?
Pt1 Ni2 Ni2 57.345(9) . 2_556 ?
Au2 Ni2 Ni2 58.340(9) 2_556 2_556 ?
Au2 Ni2 Ni2 58.064(9) . 2_556 ?
C2 Pt1 C1 166.3(3) . . ?
C2 Pt1 P1 100.8(2) . . ?
C1 Pt1 P1 92.92(18) . . ?
C2 Pt1 Pt2 52.0(2) . 2_556 ?
C1 Pt1 Pt2 114.28(18) . 2_556 ?
P1 Pt1 Pt2 152.53(4) . 2_556 ?
C2 Pt1 Ni2 52.0(2) . 2_556 ?
C1 Pt1 Ni2 114.28(18) . 2_556 ?
P1 Pt1 Ni2 152.53(4) . 2_556 ?
Pt2 Pt1 Ni2 0.000(13) 2_556 2_556 ?
C2 Pt1 Ni2 116.9(2) . . ?
C1 Pt1 Ni2 49.33(18) . . ?
P1 Pt1 Ni2 142.25(4) . . ?
Pt2 Pt1 Ni2 65.035(12) 2_556 . ?
Ni2 Pt1 Ni2 65.035(12) 2_556 . ?
C16 P1 C4 105.16(11) . . ?
C16 P1 C10 104.39(12) . . ?
C4 P1 C10 102.24(10) . . ?
C16 P1 Pt1 111.01(8) . . ?
C4 P1 Pt1 114.08(10) . . ?
C10 P1 Pt1 118.62(9) . . ?
C22 P2 C34 104.57(10) . . ?
C22 P2 C28 103.87(12) . . ?
C34 P2 C28 104.22(10) . . ?
C22 P2 Au2 112.23(9) . . ?
C34 P2 Au2 114.45(10) . . ?
C28 P2 Au2 116.25(9) . . ?
O1 C1 Pt1 142.9(5) . . ?
O1 C1 Ni2 135.0(5) . . ?
Pt1 C1 Ni2 82.2(2) . . ?
O2 C2 Pt1 148.0(6) . . ?
O2 C2 Pt2 131.1(5) . 2_556 ?
Pt1 C2 Pt2 80.8(2) . 2_556 ?
O2 C2 Ni2 131.1(5) . 2_556 ?
Pt1 C2 Ni2 80.8(2) . 2_556 ?
Pt2 C2 Ni2 0.000(12) 2_556 2_556 ?
O3 C3 Ni2 179.0(7) . . ?
C5 C4 C9 120.0 . . ?
C5 C4 P1 121.23(7) . . ?
C9 C4 P1 118.69(7) . . ?
C6 C5 C4 120.0 . . ?
C5 C6 C7 120.0 . . ?
C8 C7 C6 120.0 . . ?
C7 C8 C9 120.0 . . ?
C8 C9 C4 120.0 . . ?
C11 C10 C15 119.5 . . ?
C11 C10 P1 118.15(7) . . ?
C15 C10 P1 122.36(7) . . ?
C10 C11 C12 121.1 . . ?
C11 C12 C13 119.1 . . ?
C14 C13 C12 120.6 . . ?
C13 C14 C15 119.4 . . ?
C10 C15 C14 120.2 . . ?
C17 C16 C21 118.2 . . ?
C17 C16 P1 123.90(7) . . ?
C21 C16 P1 117.90(6) . . ?
C16 C17 C18 119.9 . . ?
C19 C18 C17 120.7 . . ?
C20 C19 C18 119.8 . . ?
C19 C20 C21 119.9 . . ?
C20 C21 C16 121.4 . . ?
C23 C22 C27 117.7 . . ?
C23 C22 P2 118.60(6) . . ?
C27 C22 P2 123.70(6) . . ?
C24 C23 C22 121.6 . . ?
C23 C24 C25 119.1 . . ?
C26 C25 C24 120.3 . . ?
C25 C26 C27 121.1 . . ?
C26 C27 C22 120.2 . . ?
C29 C28 C33 119.5 . . ?
C29 C28 P2 122.75(7) . . ?
C33 C28 P2 117.69(7) . . ?
C28 C29 C30 120.3 . . ?
C31 C30 C29 120.0 . . ?
C30 C31 C32 120.2 . . ?
C33 C32 C31 120.0 . . ?
C32 C33 C28 119.9 . . ?
C39 C34 C35 117.8 . . ?
C39 C34 P2 123.66(7) . . ?
C35 C34 P2 118.54(7) . . ?
C36 C35 C34 121.2 . . ?
C35 C36 C37 120.1 . . ?
C36 C37 C38 119.5 . . ?
C39 C38 C37 119.6 . . ?
C38 C39 C34 121.8 . . ?
N1 C40 C41 178.6(5) . . ?
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
Au2 P2 2.2817(16) . ?
Au2 Pt2 2.7419(4) 2_556 ?
Au2 Ni2 2.7419(4) 2_556 ?
Au2 Ni2 2.7500(4) . ?
Au2 Au2 2.8754(5) 2_556 ?
Ni2 C3 1.838(8) . ?
Ni2 C1 2.064(6) . ?
Ni2 C2 2.147(7) 2_556 ?
Ni2 Pt1 2.6876(4) 2_556 ?
Ni2 Pt1 2.6959(4) . ?
Ni2 Au2 2.7419(4) 2_556 ?
Ni2 Ni2 2.8939(5) 2_556 ?
Pt1 C2 1.998(7) . ?
Pt1 C1 2.037(6) . ?
Pt1 P1 2.2583(17) . ?
Pt1 Pt2 2.6876(4) 2_556 ?
Pt1 Ni2 2.6876(4) 2_556 ?
N1 C40 1.131(10) . ?
O1 C1 1.182(7) . ?
O2 C2 1.163(8) . ?
O3 C3 1.146(9) . ?
P1 C16 1.808(2) . ?
P1 C4 1.824(2) . ?
P1 C10 1.831(2) . ?
P2 C22 1.809(2) . ?
P2 C34 1.828(2) . ?
P2 C28 1.837(2) . ?
C2 Pt2 2.147(7) 2_556 ?
C2 Ni2 2.147(7) 2_556 ?
C4 C5 1.3900 . ?
C4 C9 1.3900 . ?
C5 C6 1.3900 . ?
C6 C7 1.3900 . ?
C7 C8 1.3900 . ?
C8 C9 1.3900 . ?
C10 C11 1.3811 . ?
C10 C15 1.3860 . ?
C11 C12 1.3873 . ?
C12 C13 1.3926 . ?
C13 C14 1.3801 . ?
C14 C15 1.4041 . ?
C16 C17 1.3931 . ?
C16 C21 1.3976 . ?
C17 C18 1.4001 . ?
C18 C19 1.3823 . ?
C19 C20 1.3709 . ?
C20 C21 1.3866 . ?
C22 C23 1.3912 . ?
C22 C27 1.4085 . ?
C23 C24 1.3838 . ?
C24 C25 1.3857 . ?
C25 C26 1.3617 . ?
C26 C27 1.3732 . ?
C28 C29 1.3787 . ?
C28 C33 1.4057 . ?
C29 C30 1.3869 . ?
C30 C31 1.3795 . ?
C31 C32 1.3894 . ?
C32 C33 1.3750 . ?
C34 C39 1.3742 . ?
C34 C35 1.4070 . ?
C35 C36 1.3663 . ?
C36 C37 1.3811 . ?
C37 C38 1.3967 . ?
C38 C39 1.3716 . ?
C40 C41 1.4367 . ?
