#------------------------------------------------------------------------------
#$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $
#$Revision: 130149 $
#$URL: svn://www.crystallography.net/cod/cif/4/10/11/4101108.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_4101108
_publ_section_title
;
Mimicking [2,2]Paracyclophane Topology : Molecular Clips for the
 Coordination-Driven Co-facial Assembly of pi-Conjugated Systems
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_paper_doi               10.1021/ja058617+
_journal_year                    2006
_chemical_formula_moiety         'C70 H56 Cl12 Cu2 F12 N6 P4'
_chemical_formula_sum            'C70 H56 Cl12 Cu2 F12 N6 P4'
_chemical_formula_weight         1885.57
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                97.1936(10)
_cell_angle_beta                 99.6936(10)
_cell_angle_gamma                98.6028(12)
_cell_formula_units_Z            2
_cell_length_a                   15.4965(3)
_cell_length_b                   15.6184(4)
_cell_length_c                   16.5106(3)
_cell_measurement_temperature    120(2)
_cell_volume                     3848.06(18)
_diffrn_ambient_temperature      120(2)
_exptl_crystal_density_diffrn    1.628
_cod_database_code               4101108
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, -z'
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 0.91050(3) 0.81716(3) 0.15980(3) 0.01335(13) Uani 1 1 d . . .
Cu2 Cu 0.77027(3) 0.74489(3) 0.20473(3) 0.01283(13) Uani 1 1 d . . .
P1 P 0.77201(7) 0.84938(7) 0.11134(6) 0.0120(2) Uani 1 1 d . . .
P2 P 0.84065(7) 0.63406(7) 0.22994(7) 0.0138(2) Uani 1 1 d . . .
N1 N 0.9507(2) 0.9330(2) 0.1141(2) 0.0143(7) Uani 1 1 d . . .
N2 N 0.6365(2) 0.7206(2) 0.1615(2) 0.0147(7) Uani 1 1 d . . .
N3 N 0.9664(2) 0.7201(2) 0.1049(2) 0.0157(7) Uani 1 1 d . . .
N4 N 0.7111(3) 0.5948(3) 0.3335(3) 0.0280(9) Uani 1 1 d . . .
C1 C 0.8074(3) 0.9671(3) 0.1201(3) 0.0141(8) Uani 1 1 d . . .
C2 C 0.7394(3) 1.0102(3) 0.1326(3) 0.0156(8) Uani 1 1 d . . .
C3 C 0.7432(3) 1.1089(3) 0.1411(3) 0.0217(9) Uani 1 1 d . . .
H3A H 0.7672 1.1301 0.0953 0.026 Uiso 1 1 calc R . .
H3B H 0.7835 1.1364 0.1923 0.026 Uiso 1 1 calc R . .
C4 C 0.6526(4) 1.1365(3) 0.1418(4) 0.0316(12) Uani 1 1 d . . .
H4A H 0.6610 1.1990 0.1612 0.038 Uiso 1 1 calc R . .
H4B H 0.6179 1.1250 0.0857 0.038 Uiso 1 1 calc R . .
C5 C 0.6020(4) 1.0870(4) 0.1980(4) 0.0357(13) Uani 1 1 d . . .
H5A H 0.5485 1.1107 0.2034 0.043 Uiso 1 1 calc R . .
H5B H 0.6387 1.0937 0.2529 0.043 Uiso 1 1 calc R . .
C6 C 0.5774(3) 0.9896(3) 0.1604(4) 0.0276(11) Uani 1 1 d . . .
H6A H 0.5516 0.9570 0.1995 0.033 Uiso 1 1 calc R . .
H6B H 0.5328 0.9826 0.1101 0.033 Uiso 1 1 calc R . .
C7 C 0.6572(3) 0.9520(3) 0.1401(3) 0.0176(9) Uani 1 1 d . . .
C8 C 0.6628(3) 0.8653(3) 0.1299(3) 0.0153(8) Uani 1 1 d . . .
C9 C 0.5988(3) 0.7886(3) 0.1368(3) 0.0156(8) Uani 1 1 d . . .
C10 C 0.5068(3) 0.7835(3) 0.1200(3) 0.0199(9) Uani 1 1 d . . .
H10 H 0.4819 0.8296 0.1010 0.024 Uiso 1 1 calc R . .
C11 C 0.4526(3) 0.7082(3) 0.1322(3) 0.0229(10) Uani 1 1 d . . .
H11 H 0.3912 0.7043 0.1234 0.028 Uiso 1 1 calc R . .
C12 C 0.4917(3) 0.6391(3) 0.1576(3) 0.0224(10) Uani 1 1 d . . .
H12 H 0.4570 0.5879 0.1654 0.027 Uiso 1 1 calc R . .
C13 C 0.5837(3) 0.6481(3) 0.1711(3) 0.0192(9) Uani 1 1 d . . .
H13 H 0.6098 0.6016 0.1875 0.023 Uiso 1 1 calc R . .
C14 C 0.9003(3) 0.9978(3) 0.1161(2) 0.0147(8) Uani 1 1 d . . .
C15 C 0.9392(3) 1.0850(3) 0.1161(3) 0.0173(8) Uani 1 1 d . . .
H15 H 0.9051 1.1291 0.1183 0.021 Uiso 1 1 calc R . .
C16 C 1.0287(3) 1.1048(3) 0.1130(3) 0.0190(9) Uani 1 1 d . . .
H16 H 1.0556 1.1627 0.1153 0.023 Uiso 1 1 calc R . .
C17 C 1.0780(3) 1.0377(3) 0.1064(3) 0.0176(9) Uani 1 1 d . . .
H17 H 1.1373 1.0493 0.1012 0.021 Uiso 1 1 calc R . .
C18 C 1.0365(3) 0.9532(3) 0.1077(3) 0.0172(8) Uani 1 1 d . . .
H18 H 1.0695 0.9083 0.1039 0.021 Uiso 1 1 calc R . .
C19 C 0.7472(3) 0.8083(3) -0.0001(2) 0.0141(8) Uani 1 1 d . . .
C20 C 0.7659(3) 0.7265(3) -0.0291(3) 0.0197(9) Uani 1 1 d . . .
H20 H 0.7928 0.6940 0.0081 0.024 Uiso 1 1 calc R . .
C21 C 0.7443(3) 0.6935(3) -0.1136(3) 0.0257(10) Uani 1 1 d . . .
H21 H 0.7562 0.6387 -0.1329 0.031 Uiso 1 1 calc R . .
C22 C 0.7051(4) 0.7426(4) -0.1690(3) 0.0277(11) Uani 1 1 d . . .
H22 H 0.6909 0.7206 -0.2255 0.033 Uiso 1 1 calc R . .
C23 C 0.6869(3) 0.8238(3) -0.1411(3) 0.0239(10) Uani 1 1 d . . .
H23 H 0.6610 0.8564 -0.1788 0.029 Uiso 1 1 calc R . .
C24 C 0.7075(3) 0.8569(3) -0.0565(3) 0.0182(9) Uani 1 1 d . . .
H24 H 0.6947 0.9114 -0.0376 0.022 Uiso 1 1 calc R . .
C31 C 0.9571(3) 0.6430(3) 0.2225(3) 0.0159(8) Uani 1 1 d . . .
C32 C 1.0066(3) 0.6339(3) 0.2956(3) 0.0173(9) Uani 1 1 d . . .
C33 C 1.1064(3) 0.6441(3) 0.3132(3) 0.0234(10) Uani 1 1 d . . .
H33A H 1.1312 0.6935 0.2891 0.028 Uiso 1 1 calc R . .
H33B H 1.1237 0.5919 0.2868 0.028 Uiso 1 1 calc R . .
C34 C 1.1446(3) 0.6585(4) 0.4064(3) 0.0274(11) Uani 1 1 d . . .
H34A H 1.2077 0.6564 0.4153 0.033 Uiso 1 1 calc R . .
H34B H 1.1371 0.7157 0.4316 0.033 Uiso 1 1 calc R . .
C35 C 1.0974(4) 0.5884(4) 0.4461(3) 0.0285(11) Uani 1 1 d . . .
H35A H 1.1276 0.5919 0.5033 0.034 Uiso 1 1 calc R . .
H35B H 1.0993 0.5311 0.4166 0.034 Uiso 1 1 calc R . .
C36 C 1.0004(3) 0.5991(3) 0.4444(3) 0.0225(10) Uani 1 1 d . . .
H36A H 0.9681 0.5465 0.4584 0.027 Uiso 1 1 calc R . .
H36B H 0.9987 0.6477 0.4866 0.027 Uiso 1 1 calc R . .
C37 C 0.9542(3) 0.6156(3) 0.3607(3) 0.0173(9) Uani 1 1 d . . .
C38 C 0.8653(3) 0.6138(3) 0.3366(3) 0.0173(9) Uani 1 1 d . . .
C39 C 0.7917(3) 0.6018(3) 0.3819(3) 0.0206(9) Uani 1 1 d . . .
C40 C 0.8012(4) 0.5996(3) 0.4684(3) 0.0257(10) Uani 1 1 d . . .
H40 H 0.8574 0.6053 0.5013 0.031 Uiso 1 1 calc R . .
C41 C 0.7262(4) 0.5888(4) 0.5031(4) 0.0328(12) Uani 1 1 d . . .
H41 H 0.7313 0.5866 0.5597 0.039 Uiso 1 1 calc R . .
C42 C 0.6436(4) 0.5813(5) 0.4536(4) 0.0415(14) Uani 1 1 d . . .
H42 H 0.5922 0.5741 0.4759 0.050 Uiso 1 1 calc R . .
C43 C 0.6393(4) 0.5848(4) 0.3691(4) 0.0371(13) Uani 1 1 d . . .
H43 H 0.5836 0.5801 0.3356 0.044 Uiso 1 1 calc R . .
C44 C 0.9893(3) 0.6538(3) 0.1449(3) 0.0155(8) Uani 1 1 d . . .
C45 C 1.0397(3) 0.5955(3) 0.1127(3) 0.0219(9) Uani 1 1 d . . .
H45 H 1.0543 0.5501 0.1408 0.026 Uiso 1 1 calc R . .
C46 C 1.0677(3) 0.6060(3) 0.0382(3) 0.0266(10) Uani 1 1 d . . .
H46 H 1.1021 0.5684 0.0163 0.032 Uiso 1 1 calc R . .
C47 C 1.0435(4) 0.6732(4) -0.0028(3) 0.0265(10) Uani 1 1 d . . .
H47 H 1.0610 0.6814 -0.0528 0.032 Uiso 1 1 calc R . .
C48 C 0.9926(3) 0.7280(3) 0.0323(3) 0.0222(9) Uani 1 1 d . . .
H48 H 0.9757 0.7725 0.0041 0.027 Uiso 1 1 calc R . .
C49 C 0.7924(3) 0.5283(3) 0.1655(3) 0.0167(8) Uani 1 1 d . . .
C50 C 0.8182(3) 0.4511(3) 0.1871(3) 0.0231(10) Uani 1 1 d . . .
H50 H 0.8572 0.4522 0.2368 0.028 Uiso 1 1 calc R . .
C51 C 0.7851(3) 0.3720(3) 0.1337(4) 0.0277(11) Uani 1 1 d . . .
H51 H 0.8019 0.3203 0.1480 0.033 Uiso 1 1 calc R . .
C52 C 0.7276(3) 0.3702(3) 0.0596(3) 0.0274(11) Uani 1 1 d . . .
H52 H 0.7060 0.3173 0.0242 0.033 Uiso 1 1 calc R . .
C53 C 0.7017(3) 0.4467(3) 0.0376(3) 0.0258(10) Uani 1 1 d . . .
H53 H 0.6633 0.4453 -0.0125 0.031 Uiso 1 1 calc R . .
C54 C 0.7336(3) 0.5261(3) 0.0911(3) 0.0196(9) Uani 1 1 d . . .
H54 H 0.7156 0.5774 0.0770 0.024 Uiso 1 1 calc R . .
N60 N 0.9849(3) 0.8538(3) 0.2764(2) 0.0177(7) Uani 1 1 d . . .
N70 N 0.7779(3) 0.8286(3) 0.3121(2) 0.0195(8) Uani 1 1 d . . .
C61 C 1.0280(3) 0.8917(3) 0.3374(3) 0.0168(8) Uani 1 1 d . . .
C62 C 1.0798(3) 0.9443(3) 0.4122(3) 0.0160(8) Uani 1 1 d . . .
C63 C 1.0699(3) 0.9188(3) 0.4900(3) 0.0150(8) Uani 1 1 d . . .
C64 C 1.0153(3) 0.8399(3) 0.4979(3) 0.0188(9) Uani 1 1 d . . .
H64 H 0.9846 0.8021 0.4504 0.023 Uiso 1 1 calc R . .
C65 C 1.0074(3) 0.8192(3) 0.5745(3) 0.0229(10) Uani 1 1 d . . .
H65 H 0.9710 0.7675 0.5787 0.027 Uiso 1 1 calc R . .
C66 C 1.0540(3) 0.8754(3) 0.6478(3) 0.0227(10) Uani 1 1 d . . .
H66 H 1.0486 0.8600 0.6995 0.027 Uiso 1 1 calc R . .
C67 C 1.1070(3) 0.9525(3) 0.6430(3) 0.0199(9) Uani 1 1 d . . .
H67 H 1.1374 0.9889 0.6914 0.024 Uiso 1 1 calc R . .
C68 C 1.1157(3) 0.9769(3) 0.5639(3) 0.0170(8) Uani 1 1 d . . .
C69 C 1.1655(3) 1.0576(3) 0.5560(3) 0.0166(8) Uani 1 1 d . . .
C70 C 1.1766(3) 1.0821(3) 0.4782(3) 0.0171(8) Uani 1 1 d . . .
C71 C 1.2260(3) 1.1645(3) 0.4707(3) 0.0226(10) Uani 1 1 d . . .
H71 H 1.2533 1.2041 0.5182 0.027 Uiso 1 1 calc R . .
C72 C 1.2332(4) 1.1852(3) 0.3944(3) 0.0266(11) Uani 1 1 d . . .
H72 H 1.2650 1.2393 0.3900 0.032 Uiso 1 1 calc R . .
C73 C 1.1926(3) 1.1249(3) 0.3209(3) 0.0252(10) Uani 1 1 d . . .
H73 H 1.1993 1.1395 0.2691 0.030 Uiso 1 1 calc R . .
C74 C 1.1443(3) 1.0462(3) 0.3259(3) 0.0211(9) Uani 1 1 d . . .
H74 H 1.1180 1.0076 0.2775 0.025 Uiso 1 1 calc R . .
C75 C 1.1336(3) 1.0226(3) 0.4046(3) 0.0164(8) Uani 1 1 d . . .
C76 C 0.8003(3) 0.8794(3) 0.3709(3) 0.0168(8) Uani 1 1 d . . .
P10 P 0.71678(9) 0.10813(10) 0.87173(9) 0.0293(3) Uani 1 1 d . . .
F11 F 0.7381(4) 0.0305(4) 0.8103(3) 0.088(2) Uani 1 1 d . . .
F12 F 0.6396(3) 0.0390(4) 0.8909(5) 0.090(2) Uani 1 1 d . . .
F13 F 0.7854(2) 0.0819(3) 0.9449(2) 0.0437(9) Uani 1 1 d . . .
F14 F 0.6918(4) 0.1788(4) 0.9353(3) 0.095(2) Uani 1 1 d . . .
F15 F 0.7937(4) 0.1695(5) 0.8480(5) 0.115(3) Uani 1 1 d . . .
F16 F 0.6463(3) 0.1318(3) 0.7990(2) 0.0503(10) Uani 1 1 d . . .
P20 P 0.05279(9) 0.34834(8) 0.26213(8) 0.0224(3) Uani 1 1 d . . .
F21 F -0.0422(2) 0.2933(2) 0.2195(2) 0.0439(9) Uani 1 1 d . . .
F22 F 0.0829(3) 0.2606(2) 0.2866(2) 0.0461(9) Uani 1 1 d . . .
F23 F 0.0205(4) 0.3655(3) 0.3481(2) 0.0573(12) Uani 1 1 d . . .
F24 F 0.1486(3) 0.4035(3) 0.3042(3) 0.0679(14) Uani 1 1 d . . .
F25 F 0.0222(3) 0.4356(2) 0.2374(3) 0.0450(9) Uani 1 1 d . . .
F26 F 0.0856(3) 0.3303(3) 0.1764(3) 0.0508(10) Uani 1 1 d . . .
C100 C 0.4999(4) 0.3287(4) 0.0987(4) 0.0381(13) Uani 1 1 d . . .
H10A H 0.4496 0.2819 0.0939 0.046 Uiso 1 1 calc R . .
H10B H 0.5431 0.3056 0.0699 0.046 Uiso 1 1 calc R . .
Cl10 Cl 0.46391(10) 0.41489(10) 0.05114(10) 0.0412(3) Uani 1 1 d . . .
Cl11 Cl 0.5474(2) 0.3624(3) 0.20284(13) 0.1040(12) Uani 1 1 d . . .
C200 C 0.3043(6) 0.5444(7) 0.2938(7) 0.078(3) Uani 1 1 d . . .
H20A H 0.3252 0.6010 0.3285 0.093 Uiso 1 1 calc R . .
H20B H 0.2536 0.5154 0.3133 0.093 Uiso 1 1 calc R . .
Cl20 Cl 0.26998(14) 0.56021(17) 0.18879(17) 0.0729(7) Uani 1 1 d . . .
Cl21 Cl 0.38851(12) 0.48170(13) 0.30356(14) 0.0582(5) Uani 1 1 d . . .
C300 C 0.7224(9) 0.3584(11) 0.3590(11) 0.060(4) Uani 0.50 1 d P . .
C301 C 0.6785(19) 0.2657(11) 0.3765(13) 0.091(7) Uani 0.50 1 d P . .
Cl30 Cl 0.6588(3) 0.3588(4) 0.4137(2) 0.1385(17) Uani 1 1 d . . .
Cl31 Cl 0.79046(18) 0.2745(2) 0.34915(17) 0.0873(8) Uani 1 1 d . . .
Cl40 Cl 0.4497 0.1839 0.3502 0.122(4) Uani 0.50 1 d P . .
Cl41 Cl 0.4622 0.2241 0.3727 0.47(3) Uani 0.50 1 d P . .
C60 C 0.7194(18) 0.170(3) 0.440(4) 0.61(6) Uani 1 1 d . . .
Cl50 Cl 0.4458 -0.2755 0.4253 0.1542(19) Uani 1 1 d . . .
Cl51 Cl 0.5735 -0.1813 0.3487 0.1186(13) Uani 1 1 d . . .
Cl61 Cl 0.7183(3) 0.1274(4) 0.5973(5) 0.0915(19) Uani 0.50 1 d P . .
Cl71 Cl 0.5202 0.0493 0.3862 0.0976(18) Uani 0.50 1 d P . .
Cl74 Cl 0.6206(5) -0.0092(6) 0.5791(5) 0.235(4) Uani 1 1 d . . .
C701 C 0.4142 0.0611 0.3394 0.106(5) Uani 1 1 d . . .
Cl80 Cl 0.6418 0.0308 0.4426 0.81(3) Uani 1 1 d . . .
C801 C 0.4678 -0.1890 0.3662 0.196(10) Uani 1 1 d . . .
H80A H 0.4262 -0.2008 0.3136 0.235 Uiso 1 1 calc R . .
H80B H 0.4604 -0.1341 0.3964 0.235 Uiso 1 1 calc R . .
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 N60 2.035(4) . ?
Cu1 N3 2.046(4) . ?
Cu1 N1 2.096(4) . ?
Cu1 P1 2.3118(13) . ?
Cu1 Cu2 2.5622(10) . ?
Cu2 N2 2.037(4) . ?
Cu2 N70 2.042(4) . ?
Cu2 P2 2.2249(13) . ?
Cu2 P1 2.3815(13) . ?
P1 C8 1.816(4) . ?
P1 C1 1.818(4) . ?
P1 C19 1.827(4) . ?
P2 C31 1.815(5) . ?
P2 C38 1.816(4) . ?
P2 C49 1.828(4) . ?
N1 C18 1.345(6) . ?
N1 C14 1.368(6) . ?
N2 C13 1.336(6) . ?
N2 C9 1.360(6) . ?
N3 C48 1.343(6) . ?
N3 C44 1.355(6) . ?
N4 C43 1.341(7) . ?
N4 C39 1.346(7) . ?
C1 C2 1.363(6) . ?
C1 C14 1.463(6) . ?
C2 C7 1.483(6) . ?
C2 C3 1.521(6) . ?
C3 C4 1.531(7) . ?
C4 C5 1.521(8) . ?
C5 C6 1.535(7) . ?
C6 C7 1.515(6) . ?
C7 C8 1.362(6) . ?
C8 C9 1.465(6) . ?
C9 C10 1.394(6) . ?
C10 C11 1.397(7) . ?
C11 C12 1.389(7) . ?
C12 C13 1.388(7) . ?
C14 C15 1.404(6) . ?
C15 C16 1.387(7) . ?
C16 C17 1.391(7) . ?
C17 C18 1.382(6) . ?
C19 C24 1.396(6) . ?
C19 C20 1.395(6) . ?
C20 C21 1.391(6) . ?
C21 C22 1.386(8) . ?
C22 C23 1.380(8) . ?
C23 C24 1.393(6) . ?
C31 C32 1.353(6) . ?
C31 C44 1.470(6) . ?
C32 C37 1.483(6) . ?
C32 C33 1.505(6) . ?
C33 C34 1.529(7) . ?
C34 C35 1.505(8) . ?
C35 C36 1.534(7) . ?
C36 C37 1.516(6) . ?
C37 C38 1.363(7) . ?
C38 C39 1.468(7) . ?
C39 C40 1.416(7) . ?
C40 C41 1.378(8) . ?
C41 C42 1.378(9) . ?
C42 C43 1.394(9) . ?
C44 C45 1.397(6) . ?
C45 C46 1.392(7) . ?
C46 C47 1.381(8) . ?
C47 C48 1.386(7) . ?
C49 C54 1.394(6) . ?
C49 C50 1.394(7) . ?
C50 C51 1.398(7) . ?
C51 C52 1.382(8) . ?
C52 C53 1.387(8) . ?
C53 C54 1.399(6) . ?
N60 C61 1.148(6) . ?
N70 C76 1.141(6) . ?
C61 C62 1.435(6) . ?
C62 C75 1.406(6) . ?
C62 C63 1.416(6) . ?
C63 C64 1.420(6) . ?
C63 C68 1.433(6) . ?
C64 C65 1.364(7) . ?
C65 C66 1.417(7) . ?
C66 C67 1.370(7) . ?
C67 C68 1.427(6) . ?
C68 C69 1.410(6) . ?
C69 C70 1.415(6) . ?
C69 C76 1.428(6) 2_776 ?
C70 C71 1.425(7) . ?
C70 C75 1.430(6) . ?
C71 C72 1.358(7) . ?
C72 C73 1.427(7) . ?
C73 C74 1.360(7) . ?
C74 C75 1.423(6) . ?
C76 C69 1.428(6) 2_776 ?
P10 F15 1.551(5) . ?
P10 F14 1.563(4) . ?
P10 F12 1.588(5) . ?
P10 F11 1.592(5) . ?
P10 F16 1.600(4) . ?
P10 F13 1.605(4) . ?
P20 F25 1.587(3) . ?
P20 F21 1.588(4) . ?
P20 F23 1.588(4) . ?
P20 F22 1.589(4) . ?
P20 F26 1.590(4) . ?
P20 F24 1.597(4) . ?
C100 Cl11 1.734(7) . ?
C100 Cl10 1.756(6) . ?
C200 Cl21 1.744(10) . ?
C200 Cl20 1.784(12) . ?
C300 Cl30 1.444(19) . ?
C300 C301 1.59(3) . ?
C300 Cl31 1.810(15) . ?
C301 Cl30 1.599(17) . ?
C301 Cl31 1.85(3) . ?
C301 C60 2.04(7) . ?
Cl40 Cl41 0.67220(17) . ?
Cl40 C701 1.8904(6) . ?
Cl50 C801 1.7877(4) . ?
Cl51 C801 1.6995(5) . ?
Cl61 Cl74 2.378(11) . ?
Cl71 C701 1.7406(5) . ?
Cl71 Cl80 2.0343(6) . ?
Cl71 Cl74 2.363(8) 2_656 ?
Cl74 C701 1.773(9) 2_656 ?
Cl74 Cl71 2.363(8) 2_656 ?
Cl74 Cl80 2.474(9) . ?
C701 Cl74 1.773(9) 2_656 ?
