#------------------------------------------------------------------------------
#$Date: 2016-03-25 13:03:28 +0100 (vie 25 de mar de 2016) $
#$Revision: 179877 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/73/7017315.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_7017315
loop_
_publ_author_name
'Wang, Qingming'
'Zhu, Miaoli'
'Lu, Liping'
'Yuan, Caixia'
'Xing, Shu'
'Fu, Xueqi'
_publ_section_title
;
 Potent inhibition of protein tyrosine phosphatases by quinquedentate
 binuclear copper complexes: synthesis, characterization and biological
 activities.
;
_journal_issue                   48
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              12926
_journal_page_last               12934
_journal_paper_doi               10.1039/c1dt11006c
_journal_volume                  40
_journal_year                    2011
_chemical_formula_moiety         'C40 H56 Cu2 N4 O16 P4, 2(C H4 O), H2 O '
_chemical_formula_sum            'C42 H66 Cu2 N4 O19 P4'
_chemical_formula_weight         1181.95
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                99.471(4)
_cell_angle_beta                 104.719(4)
_cell_angle_gamma                102.425(3)
_cell_formula_units_Z            1
_cell_length_a                   9.708(2)
_cell_length_b                   11.614(3)
_cell_length_c                   14.477(4)
_cell_measurement_reflns_used    1366
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      20.73
_cell_measurement_theta_min      2.27
_cell_volume                     1499.6(6)
_computing_cell_refinement       'SAINT (Bruker,2000)'
_computing_data_collection       'SMART (Bruker,2000)'
_computing_data_reduction        SAINT
_computing_molecular_graphics    'SHELXTL/PC (Sheldrick, 1999)'
_computing_publication_material  SHELXTL/PC
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.987
_diffrn_measured_fraction_theta_max 0.987
_diffrn_measurement_device_type  'CCD area detector, Bruker'
_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  0.0825
_diffrn_reflns_av_sigmaI/netI    0.1329
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -10
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -15
_diffrn_reflns_number            9442
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         1.50
_exptl_absorpt_coefficient_mu    0.882
_exptl_absorpt_correction_T_max  0.9170
_exptl_absorpt_correction_T_min  0.8434
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS; Sheldrick, 2000'
_exptl_crystal_colour            blue
_exptl_crystal_density_diffrn    1.309
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             616
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.782
_refine_diff_density_min         -0.980
_refine_diff_density_rms         0.091
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.018
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     340
_refine_ls_number_reflns         5202
_refine_ls_number_restraints     47
_refine_ls_restrained_S_all      1.026
_refine_ls_R_factor_all          0.1551
_refine_ls_R_factor_gt           0.0818
_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)+(0.1237P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2002
_refine_ls_wR_factor_ref         0.2503
_reflns_number_gt                2654
_reflns_number_total             5202
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            c1dt11006c.txt
_cod_data_source_block           826911
_cod_database_code               7017315
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 0.40687(10) 0.26657(8) 0.42505(6) 0.0614(4) Uani 1 1 d . . .
N1 N 0.4161(7) 0.2798(6) 0.5693(4) 0.0709(17) Uani 1 1 d . . .
H1A H 0.4578 0.2209 0.5878 0.085 Uiso 1 1 calc R . .
N2 N 0.2003(7) 0.1511(5) 0.3965(4) 0.0668(17) Uani 1 1 d . A .
H2A H 0.1362 0.1918 0.3694 0.080 Uiso 1 1 calc R . .
O1 O 0.6116(6) 0.3767(5) 0.4681(4) 0.0744(14) Uani 1 1 d . . .
O2 O 0.7126(6) 0.5847(4) 0.5979(4) 0.0807(16) Uani 1 1 d . . .
O3 O 0.8132(7) 0.4031(5) 0.6290(5) 0.0896(18) Uani 1 1 d . . .
O4 O 0.6246(8) 0.2043(5) 0.7232(4) 0.0863(17) Uani 1 1 d . . .
H4A H 0.6483 0.1559 0.7553 0.129 Uiso 1 1 calc R . .
O5 O 0.4060(6) 0.1903(5) 0.2887(4) 0.0716(14) Uani 1 1 d . . .
O6 O 0.3071(7) -0.0308(5) 0.1842(4) 0.0879(17) Uani 1 1 d . . .
O7 O 0.1663(9) 0.1242(8) 0.1500(6) 0.130(3) Uani 1 1 d DU . .
O8 O -0.0998(7) 0.1331(6) 0.2771(6) 0.102(2) Uani 1 1 d . A .
H8 H -0.1779 0.1491 0.2541 0.153 Uiso 1 1 calc R . .
P1 P 0.6722(2) 0.44764(17) 0.57757(15) 0.0623(6) Uani 1 1 d . . .
P2 P 0.2719(2) 0.08174(17) 0.22887(14) 0.0605(6) Uani 1 1 d . A .
C1 C 0.6311(8) 0.3114(7) 0.7867(5) 0.0630(19) Uani 1 1 d . . .
C2 C 0.6875(9) 0.3289(7) 0.8903(6) 0.074(2) Uani 1 1 d . . .
H2 H 0.7272 0.2713 0.9168 0.089 Uiso 1 1 calc R . .
C3 C 0.6830(12) 0.4342(9) 0.9524(7) 0.099(3) Uani 1 1 d . . .
H3 H 0.7186 0.4457 1.0202 0.119 Uiso 1 1 calc R . .
C4 C 0.6246(15) 0.5218(9) 0.9116(8) 0.117(4) Uani 1 1 d . . .
H4 H 0.6221 0.5912 0.9530 0.140 Uiso 1 1 calc R . .
C5 C 0.5712(12) 0.5066(8) 0.8119(8) 0.096(3) Uani 1 1 d . . .
H5A H 0.5323 0.5655 0.7869 0.115 Uiso 1 1 calc R . .
C6 C 0.5742(9) 0.4011(7) 0.7447(5) 0.071(2) Uani 1 1 d . . .
C7 C 0.5179(9) 0.3959(7) 0.6336(6) 0.071(2) Uani 1 1 d . . .
H7 H 0.4603 0.4555 0.6284 0.086 Uiso 1 1 calc R . .
C8 C 0.9383(14) 0.4844(12) 0.7113(11) 0.134(4) Uani 1 1 d DU . .
H8A H 0.9134 0.5586 0.7334 0.161 Uiso 1 1 calc R . .
H8B H 0.9569 0.4454 0.7658 0.161 Uiso 1 1 calc R . .
C9 C 1.0666(19) 0.5122(18) 0.6811(14) 0.211(8) Uani 1 1 d DU . .
H9A H 1.0921 0.4388 0.6604 0.316 Uiso 1 1 calc R . .
H9B H 1.1469 0.5653 0.7350 0.316 Uiso 1 1 calc R . .
H9C H 1.0482 0.5514 0.6275 0.316 Uiso 1 1 calc R . .
C10 C 0.2612(9) 0.2435(8) 0.5742(6) 0.077(2) Uani 1 1 d . . .
H10A H 0.2179 0.3111 0.5701 0.092 Uiso 1 1 calc R . .
H10B H 0.2623 0.2230 0.6367 0.092 Uiso 1 1 calc R . .
C11 C 0.1691(9) 0.1369(8) 0.4921(6) 0.082(3) Uani 1 1 d . . .
H11A H 0.0652 0.1294 0.4846 0.099 Uiso 1 1 calc R . .
H11B H 0.1907 0.0634 0.5079 0.099 Uiso 1 1 calc R . .
C12 C 0.1698(10) 0.0394(7) 0.3206(6) 0.077(2) Uani 1 1 d . . .
H12 H 0.2209 -0.0134 0.3539 0.092 Uiso 1 1 calc R A .
C13 C 0.0078(9) -0.0395(8) 0.2690(6) 0.071(2) Uani 1 1 d . A .
C14 C -0.1187(10) 0.0073(8) 0.2475(6) 0.079(2) Uani 1 1 d . . .
C15 C -0.2652(10) -0.0749(9) 0.1950(6) 0.086(3) Uani 1 1 d . A .
H15 H -0.3485 -0.0459 0.1816 0.104 Uiso 1 1 calc R . .
C16 C -0.2767(12) -0.1987(9) 0.1655(6) 0.085(3) Uani 1 1 d . . .
H16 H -0.3691 -0.2519 0.1315 0.102 Uiso 1 1 calc R A .
C17 C -0.1559(11) -0.2432(9) 0.1852(6) 0.084(3) Uani 1 1 d . A .
H17 H -0.1670 -0.3254 0.1625 0.101 Uiso 1 1 calc R . .
C18 C -0.0157(10) -0.1670(8) 0.2389(6) 0.084(2) Uani 1 1 d . . .
H18 H 0.0636 -0.2004 0.2554 0.100 Uiso 1 1 calc R A .
C19A C 0.067(2) 0.1117(17) 0.0570(11) 0.120(10) Uani 0.51(2) 1 d PDU A 1
H19A H 0.0018 0.0312 0.0254 0.120 Uiso 0.51(2) 1 d PR A 1
H19B H 0.1348 0.1288 0.0189 0.120 Uiso 0.51(2) 1 d PR A 1
C19B C 0.138(2) 0.2276(14) 0.1208(18) 0.136(12) Uani 0.49(2) 1 d PDU A 2
H19C H 0.2202 0.2756 0.1051 0.136 Uiso 0.49(2) 1 d PR A 2
H19D H 0.1285 0.2748 0.1796 0.136 Uiso 0.49(2) 1 d PR A 2
C20 C -0.0003(15) 0.2094(13) 0.0480(10) 0.143(5) Uani 1 1 d DU . .
H20A H -0.0973 0.1715 0.0501 0.215 Uiso 1 1 d R A .
H20B H -0.0076 0.2326 -0.0133 0.215 Uiso 1 1 d R . .
H20C H 0.0444 0.2800 0.1011 0.215 Uiso 1 1 d R . .
C21 C 0.5690(15) 0.1797(13) 0.1018(10) 0.139(5) Uani 1 1 d . . .
H21A H 0.4778 0.2023 0.0925 0.209 Uiso 1 1 calc R . .
H21B H 0.5484 0.0946 0.0742 0.209 Uiso 1 1 calc R . .
H21C H 0.6297 0.2248 0.0698 0.209 Uiso 1 1 calc R . .
O9 O 0.6472(8) 0.2065(8) 0.2072(6) 0.118(2) Uani 1 1 d . . .
H9 H 0.5876 0.2074 0.2384 0.177 Uiso 1 1 calc R . .
O10 O 0.744(3) 0.142(2) 0.4652(19) 0.202(9) Uani 0.50 1 d PU . .
H10C H 0.7017 0.1832 0.4294 0.303 Uiso 0.50 1 d PR . .
H10D H 0.7918 0.1890 0.5210 0.303 Uiso 0.50 1 d PR . .
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'
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'
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_3
O1 Cu1 O5 97.0(2) .
O1 Cu1 N1 89.1(2) .
O5 Cu1 N1 158.0(3) .
O1 Cu1 N2 173.7(2) .
O5 Cu1 N2 88.1(2) .
N1 Cu1 N2 84.7(2) .
O1 Cu1 O2 96.0(2) 2_666
O5 Cu1 O2 104.3(2) 2_666
N1 Cu1 O2 95.9(3) 2_666
N2 Cu1 O2 86.2(2) 2_666
C7 N1 C10 118.9(6) .
C7 N1 Cu1 112.2(5) .
C10 N1 Cu1 108.0(5) .
C7 N1 H1A 105.5 .
C10 N1 H1A 105.5 .
Cu1 N1 H1A 105.5 .
C12 N2 C11 117.3(6) .
C12 N2 Cu1 113.7(5) .
C11 N2 Cu1 109.9(4) .
C12 N2 H2A 104.9 .
C11 N2 H2A 104.9 .
Cu1 N2 H2A 104.9 .
P1 O1 Cu1 116.5(3) .
P1 O2 Cu1 137.6(3) 2_666
C8 O3 P1 121.8(6) .
C1 O4 H4A 109.5 .
P2 O5 Cu1 116.5(3) .
C19B O7 C19A 60.8(11) .
C19B O7 P2 142.6(10) .
C19A O7 P2 154.9(9) .
C14 O8 H8 109.5 .
O2 P1 O1 117.3(3) .
O2 P1 O3 110.1(3) .
O1 P1 O3 107.4(3) .
O2 P1 C7 108.0(3) .
O1 P1 C7 105.2(3) .
O3 P1 C7 108.5(4) .
O6 P2 O5 116.3(3) .
O6 P2 O7 111.1(4) .
O5 P2 O7 109.3(4) .
O6 P2 C12 107.0(3) .
O5 P2 C12 105.3(3) .
O7 P2 C12 107.4(4) .
O4 C1 C2 121.1(7) .
O4 C1 C6 118.1(6) .
C2 C1 C6 120.8(7) .
C3 C2 C1 119.6(8) .
C3 C2 H2 120.2 .
C1 C2 H2 120.2 .
C4 C3 C2 119.8(8) .
C4 C3 H3 120.1 .
C2 C3 H3 120.1 .
C5 C4 C3 121.1(9) .
C5 C4 H4 119.4 .
C3 C4 H4 119.4 .
C4 C5 C6 121.4(9) .
C4 C5 H5A 119.3 .
C6 C5 H5A 119.3 .
C1 C6 C5 117.1(7) .
C1 C6 C7 125.7(7) .
C5 C6 C7 117.2(8) .
N1 C7 C6 117.1(6) .
N1 C7 P1 108.7(5) .
C6 C7 P1 113.7(5) .
N1 C7 H7 105.4 .
C6 C7 H7 105.4 .
P1 C7 H7 105.4 .
C9 C8 O3 110.2(14) .
C9 C8 H8A 109.6 .
O3 C8 H8A 109.6 .
C9 C8 H8B 109.6 .
O3 C8 H8B 109.6 .
H8A C8 H8B 108.1 .
C8 C9 H9A 109.5 .
C8 C9 H9B 109.5 .
H9A C9 H9B 109.5 .
C8 C9 H9C 109.5 .
H9A C9 H9C 109.5 .
H9B C9 H9C 109.5 .
N1 C10 C11 110.7(7) .
N1 C10 H10A 109.5 .
C11 C10 H10A 109.5 .
N1 C10 H10B 109.5 .
C11 C10 H10B 109.5 .
H10A C10 H10B 108.1 .
C10 C11 N2 110.9(6) .
C10 C11 H11A 109.5 .
N2 C11 H11A 109.5 .
C10 C11 H11B 109.5 .
N2 C11 H11B 109.5 .
H11A C11 H11B 108.0 .
N2 C12 C13 120.2(7) .
N2 C12 P2 106.8(5) .
C13 C12 P2 112.4(5) .
N2 C12 H12 105.4 .
C13 C12 H12 105.4 .
P2 C12 H12 105.4 .
C18 C13 C14 117.6(7) .
C18 C13 C12 117.7(8) .
C14 C13 C12 124.7(8) .
O8 C14 C13 119.2(7) .
O8 C14 C15 120.8(9) .
C13 C14 C15 120.0(8) .
C16 C15 C14 118.3(9) .
C16 C15 H15 120.9 .
C14 C15 H15 120.9 .
C17 C16 C15 121.7(8) .
C17 C16 H16 119.1 .
C15 C16 H16 119.1 .
C16 C17 C18 121.0(9) .
C16 C17 H17 119.5 .
C18 C17 H17 119.5 .
C17 C18 C13 121.3(9) .
C17 C18 H18 119.4 .
C13 C18 H18 119.4 .
O7 C19A C20 114.9(11) .
O7 C19A H19A 116.2 .
C20 C19A H19A 115.3 .
O7 C19A H19B 101.0 .
C20 C19A H19B 99.5 .
H19A C19A H19B 106.8 .
O7 C19B C20 115.8(12) .
O7 C19B H19C 112.9 .
C20 C19B H19C 112.4 .
O7 C19B H19D 102.9 .
C20 C19B H19D 104.3 .
H19C C19B H19D 107.3 .
O7 C19B H20C 143.9 .
H19C C19B H20C 103.1 .
H19D C19B H20C 68.6 .
C19B C20 C19A 59.4(11) .
C19B C20 H20A 127.7 .
C19A C20 H20A 100.0 .
C19B C20 H20B 122.8 .
C19A C20 H20B 113.4 .
H20A C20 H20B 109.5 .
C19B C20 H20C 56.3 .
C19A C20 H20C 114.6 .
H20A C20 H20C 109.5 .
H20B C20 H20C 109.5 .
O9 C21 H21A 109.5 .
O9 C21 H21B 109.5 .
H21A C21 H21B 109.5 .
O9 C21 H21C 109.5 .
H21A C21 H21C 109.5 .
H21B C21 H21C 109.5 .
C21 O9 H9 109.5 .
H10C O10 H10D 107.7 .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Cu1 O1 1.997(5) .
Cu1 O5 2.024(5) .
Cu1 N1 2.046(6) .
Cu1 N2 2.057(6) .
Cu1 O2 2.301(5) 2_666
N1 C7 1.486(9) .
N1 C10 1.495(10) .
N1 H1A 0.9100 .
N2 C12 1.476(9) .
N2 C11 1.517(9) .
N2 H2A 0.9100 .
O1 P1 1.557(6) .
O2 P1 1.514(5) .
O2 Cu1 2.301(5) 2_666
O3 C8 1.480(13) .
O3 P1 1.615(6) .
O4 C1 1.398(8) .
O4 H4A 0.8200 .
O5 P2 1.547(5) .
O6 P2 1.507(6) .
O7 C19B 1.395(10) .
O7 C19A 1.406(9) .
O7 P2 1.551(8) .
O8 C14 1.411(10) .
O8 H8 0.8200 .
P1 C7 1.912(8) .
P2 C12 1.914(8) .
C1 C2 1.423(10) .
C1 C6 1.430(11) .
C2 C3 1.409(12) .
C2 H2 0.9300 .
C3 C4 1.408(14) .
C3 H3 0.9300 .
C4 C5 1.371(13) .
C4 H4 0.9300 .
C5 C6 1.444(12) .
C5 H5A 0.9300 .
C6 C7 1.548(10) .
C7 H7 0.9800 .
C8 C9 1.413(9) .
C8 H8A 0.9700 .
C8 H8B 0.9700 .
C9 H9A 0.9600 .
C9 H9B 0.9600 .
C9 H9C 0.9600 .
C10 C11 1.499(10) .
C10 H10A 0.9700 .
C10 H10B 0.9700 .
C11 H11A 0.9700 .
C11 H11B 0.9700 .
C12 C13 1.558(11) .
C12 H12 0.9800 .
C13 C18 1.424(12) .
C13 C14 1.431(12) .
C14 C15 1.462(11) .
C15 C16 1.403(13) .
C15 H15 0.9300 .
C16 C17 1.365(13) .
C16 H16 0.9300 .
C17 C18 1.399(11) .
C17 H17 0.9300 .
C18 H18 0.9300 .
C19A C20 1.434(10) .
C19A H19A 0.9700 .
C19A H19B 0.9700 .
C19B C20 1.430(10) .
C19B H19C 0.9700 .
C19B H19D 0.9700 .
C19B H20C 1.2002 .
C20 H20A 0.9600 .
C20 H20B 0.9600 .
C20 H20C 0.9600 .
C21 O9 1.468(13) .
C21 H21A 0.9600 .
C21 H21B 0.9600 .
C21 H21C 0.9600 .
O9 H9 0.8200 .
O10 H10C 0.8500 .
O10 H10D 0.8500 .
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
_geom_hbond_site_symmetry_A
O10 H10C O1 0.85 2.61 3.25(2) 133.2 .
O10 H10D O3 0.85 2.65 3.35(2) 140.9 .
O9 H9 O5 0.82 2.06 2.863(9) 167.9 .
O8 H8 O9 0.82 1.96 2.776(10) 173.5 1_455
O4 H4A O6 0.82 1.89 2.704(9) 173.5 2_656
N2 H2A O8 0.91 2.23 2.929(9) 133.2 .
N1 H1A O4 0.91 2.27 2.991(10) 136.0 .
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
O1 Cu1 N1 C7 27.2(6) .
O5 Cu1 N1 C7 134.0(6) .
N2 Cu1 N1 C7 -154.4(6) .
O2 Cu1 N1 C7 -68.7(6) 2_666
O1 Cu1 N1 C10 160.3(5) .
O5 Cu1 N1 C10 -92.9(8) .
N2 Cu1 N1 C10 -21.3(5) .
O2 Cu1 N1 C10 64.4(5) 2_666
O5 Cu1 N2 C12 24.3(5) .
N1 Cu1 N2 C12 -134.8(6) .
O2 Cu1 N2 C12 128.8(5) 2_666
O5 Cu1 N2 C11 158.1(6) .
N1 Cu1 N2 C11 -1.0(5) .
O2 Cu1 N2 C11 -97.4(6) 2_666
O5 Cu1 O1 P1 -173.3(3) .
N1 Cu1 O1 P1 -14.5(4) .
O2 Cu1 O1 P1 81.4(4) 2_666
O1 Cu1 O5 P2 171.9(3) .
N1 Cu1 O5 P2 66.5(7) .
N2 Cu1 O5 P2 -4.5(4) .
O2 Cu1 O5 P2 -90.1(3) 2_666
Cu1 O2 P1 O1 65.2(6) 2_666
Cu1 O2 P1 O3 -171.6(5) 2_666
Cu1 O2 P1 C7 -53.2(6) 2_666
Cu1 O1 P1 O2 -118.7(4) .
Cu1 O1 P1 O3 116.7(4) .
Cu1 O1 P1 C7 1.2(4) .
C8 O3 P1 O2 20.7(9) .
C8 O3 P1 O1 149.4(8) .
C8 O3 P1 C7 -97.3(9) .
Cu1 O5 P2 O6 -129.1(4) .
Cu1 O5 P2 O7 104.1(4) .
Cu1 O5 P2 C12 -11.0(5) .
C19B O7 P2 O6 -141(2) .
C19A O7 P2 O6 13(3) .
C19B O7 P2 O5 -11(2) .
C19A O7 P2 O5 143(3) .
C19B O7 P2 C12 102(2) .
C19A O7 P2 C12 -104(3) .
O4 C1 C2 C3 -175.6(8) .
C6 C1 C2 C3 2.0(12) .
C1 C2 C3 C4 -0.8(15) .
C2 C3 C4 C5 0.2(18) .
C3 C4 C5 C6 -0.7(18) .
O4 C1 C6 C5 175.2(7) .
C2 C1 C6 C5 -2.5(12) .
O4 C1 C6 C7 -5.8(12) .
C2 C1 C6 C7 176.4(7) .
C4 C5 C6 C1 1.8(14) .
C4 C5 C6 C7 -177.2(10) .
C10 N1 C7 C6 71.8(10) .
Cu1 N1 C7 C6 -160.7(6) .
C10 N1 C7 P1 -157.6(6) .
Cu1 N1 C7 P1 -30.2(7) .
C1 C6 C7 N1 46.6(11) .
C5 C6 C7 N1 -134.4(8) .
C1 C6 C7 P1 -81.6(8) .
C5 C6 C7 P1 97.4(8) .
O2 P1 C7 N1 144.8(5) .
O1 P1 C7 N1 18.9(6) .
O3 P1 C7 N1 -95.9(6) .
O2 P1 C7 C6 -82.8(6) .
O1 P1 C7 C6 151.3(5) .
O3 P1 C7 C6 36.5(6) .
P1 O3 C8 C9 -112.0(12) .
C7 N1 C10 C11 169.7(7) .
Cu1 N1 C10 C11 40.3(8) .
N1 C10 C11 N2 -42.5(10) .
C12 N2 C11 C10 155.5(8) .
Cu1 N2 C11 C10 23.5(9) .
C11 N2 C12 C13 67.1(10) .
Cu1 N2 C12 C13 -162.6(6) .
C11 N2 C12 P2 -163.3(6) .
Cu1 N2 C12 P2 -33.1(7) .
O6 P2 C12 N2 152.3(5) .
O5 P2 C12 N2 28.0(7) .
O7 P2 C12 N2 -88.3(7) .
O6 P2 C12 C13 -73.8(7) .
O5 P2 C12 C13 161.9(6) .
O7 P2 C12 C13 45.6(7) .
N2 C12 C13 C18 -147.8(8) .
P2 C12 C13 C18 85.2(8) .
N2 C12 C13 C14 33.7(11) .
P2 C12 C13 C14 -93.4(8) .
C18 C13 C14 O8 179.4(7) .
C12 C13 C14 O8 -2.1(12) .
C18 C13 C14 C15 -1.1(11) .
C12 C13 C14 C15 177.5(7) .
O8 C14 C15 C16 178.5(8) .
C13 C14 C15 C16 -1.0(12) .
C14 C15 C16 C17 0.5(12) .
C15 C16 C17 C18 2.2(13) .
C16 C17 C18 C13 -4.5(13) .
C14 C13 C18 C17 3.8(12) .
C12 C13 C18 C17 -174.8(7) .
C19B O7 C19A C20 -23.9(18) .
P2 O7 C19A C20 173.7(16) .
C19A O7 C19B C20 24.2(18) .
P2 O7 C19B C20 -168.0(11) .
O7 C19B C20 C19A -24.1(18) .
O7 C19A C20 C19B 23.7(18) .
