#------------------------------------------------------------------------------
#$Date: 2016-03-26 16:38:37 +0200 (Sat, 26 Mar 2016) $
#$Revision: 180347 $
#$URL: svn://www.crystallography.net/cod/cif/7/20/16/7201600.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_7201600
loop_
_publ_author_name
'Kelly, Niamh R.'
'Goetz, Sandrine'
'Batten, Stuart R.'
'Kruger, Paul E.'
_publ_section_title
;
 Coordination behaviour and network formation with
 4,4′,6,6′-tetracarboxy-2,2′-bipyridine and
 4,4′-dicarboxy-2,2′-bipyridine ligands with rare and
 alkaline earth metals
;
_journal_issue                   1
_journal_name_full               CrystEngComm
_journal_page_first              68
_journal_paper_doi               10.1039/b711469a
_journal_volume                  10
_journal_year                    2008
_chemical_formula_sum            'C14 H10 Cu N2 O11 Sr'
_chemical_formula_weight         533.40
_chemical_name_common            4
_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                107.7870(10)
_cell_angle_beta                 91.8570(10)
_cell_angle_gamma                115.3890(10)
_cell_formula_units_Z            2
_cell_length_a                   9.2075(6)
_cell_length_b                   9.6199(6)
_cell_length_c                   10.2189(7)
_cell_measurement_temperature    153(2)
_cell_volume                     764.46(9)
_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  'SHELXTL version 5.1 (Sheldrick, 1998)'
_computing_structure_solution    'SHELXTL version 5.1 (Sheldrick, 1998)'
_diffrn_ambient_temperature      153(2)
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.914
_diffrn_measurement_device_type  'Bruker SMART APEX CCD'
_diffrn_measurement_method       '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  0.0244
_diffrn_reflns_av_sigmaI/netI    0.0408
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       14
_diffrn_reflns_limit_l_min       -14
_diffrn_reflns_number            8484
_diffrn_reflns_theta_full        25.5
_diffrn_reflns_theta_max         30.47
_diffrn_reflns_theta_min         2.13
_exptl_absorpt_coefficient_mu    4.956
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.5935
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            needle
_exptl_crystal_density_diffrn    2.317
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'very pale green'
_exptl_crystal_F_000             526
_exptl_crystal_size_max          0.14
_exptl_crystal_size_mid          0.05
_exptl_crystal_size_min          0.05
_refine_diff_density_max         0.969
_refine_diff_density_min         -0.493
_refine_diff_density_rms         0.127
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.042
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     280
_refine_ls_number_reflns         4256
_refine_ls_number_restraints     9
_refine_ls_restrained_S_all      1.042
_refine_ls_R_factor_all          0.0445
_refine_ls_R_factor_gt           0.0336
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0437P)²+0.3637P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0769
_refine_ls_wR_factor_ref         0.0808
_reflns_number_gt                3564
_reflns_number_total             4256
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b711469a.txt
_cod_data_source_block           6
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Triclinic' changed to 'triclinic'
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      P-1
_cod_database_code               7201600
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 0.17066(4) 0.82553(4) 0.18945(3) 0.01167(9) Uani 1 1 d . . .
N1 N 0.1580(3) 0.6374(3) 0.2696(2) 0.0094(4) Uani 1 1 d . . .
C1 C 0.1069(3) 0.4745(3) 0.2078(3) 0.0096(5) Uani 1 1 d . . .
C2 C 0.0992(3) 0.3741(3) 0.2838(3) 0.0112(5) Uani 1 1 d . . .
H2A H 0.0603 0.2595 0.2366 0.013 Uiso 1 1 calc R . .
C3 C 0.1484(3) 0.4417(3) 0.4285(3) 0.0096(5) Uani 1 1 d . . .
C4 C 0.2034(3) 0.6091(3) 0.4921(3) 0.0098(5) Uani 1 1 d . . .
H4A H 0.2393 0.6600 0.5907 0.012 Uiso 1 1 calc R . .
C5 C 0.2058(3) 0.7021(3) 0.4111(3) 0.0082(5) Uani 1 1 d . . .
C6 C 0.2728(3) 0.8820(3) 0.4727(3) 0.0086(5) Uani 1 1 d . . .
C7 C 0.3401(3) 0.9760(3) 0.6124(3) 0.0102(5) Uani 1 1 d . . .
H7A H 0.3369 0.9250 0.6793 0.012 Uiso 1 1 calc R . .
C8 C 0.4127(3) 1.1464(3) 0.6532(3) 0.0090(5) Uani 1 1 d . . .
C9 C 0.4180(3) 1.2205(3) 0.5547(3) 0.0097(5) Uani 1 1 d . . .
H9A H 0.4671 1.3368 0.5812 0.012 Uiso 1 1 calc R . .
C10 C 0.3495(3) 1.1189(3) 0.4170(3) 0.0087(5) Uani 1 1 d . . .
N2 N 0.2782(3) 0.9545(3) 0.3799(2) 0.0083(4) Uani 1 1 d . . .
C11 C 0.3516(3) 1.1706(3) 0.2922(3) 0.0102(5) Uani 1 1 d . . .
O1 O 0.2723(2) 1.0531(2) 0.1765(2) 0.0147(4) Uani 1 1 d . . .
O2 O 0.4327(2) 1.3187(2) 0.3079(2) 0.0138(4) Uani 1 1 d . . .
C12 C 0.4922(3) 1.2459(3) 0.8049(3) 0.0115(5) Uani 1 1 d . . .
O3 O 0.5027(2) 1.3872(2) 0.85477(19) 0.0135(4) Uani 1 1 d . . .
O4 O 0.5438(3) 1.1811(2) 0.8720(2) 0.0166(4) Uani 1 1 d . . .
Sr1 Sr 0.59020(3) 1.40115(3) 1.11836(2) 0.01066(7) Uani 1 1 d . . .
C13 C 0.1391(3) 0.3349(3) 0.5147(3) 0.0108(5) Uani 1 1 d . . .
O5 O 0.2008(2) 0.4080(2) 0.64408(19) 0.0134(4) Uani 1 1 d . . .
O6 O 0.0685(2) 0.1833(2) 0.4520(2) 0.0153(4) Uani 1 1 d . . .
C14 C 0.0596(3) 0.4017(3) 0.0497(3) 0.0099(5) Uani 1 1 d . . .
O7 O -0.0766(2) 0.2681(2) 0.00440(19) 0.0123(4) Uani 1 1 d . . .
O8 O 0.1473(2) 0.4688(2) -0.02318(19) 0.0128(4) Uani 1 1 d . . .
O1W O -0.0626(2) 0.8587(2) 0.2532(2) 0.0145(4) Uani 1 1 d D . .
H1W1 H -0.022(4) 0.952(2) 0.314(3) 0.017 Uiso 1 1 d D . .
H2W1 H -0.102(4) 0.794(3) 0.293(3) 0.017 Uiso 1 1 d D . .
O2W O 0.2686(3) 1.2221(3) 1.0083(2) 0.0243(5) Uani 1 1 d D . .
H1W2 H 0.205(4) 1.181(4) 0.931(2) 0.029 Uiso 1 1 d D . .
H2W2 H 0.233(4) 1.151(4) 1.049(3) 0.029 Uiso 1 1 d D . .
O3W O 0.6562(3) 1.1672(3) 1.1396(2) 0.0202(4) Uani 1 1 d D . .
H2W3 H 0.599(4) 1.068(2) 1.117(4) 0.024 Uiso 1 1 d D . .
H1W3 H 0.734(3) 1.181(4) 1.099(4) 0.024 Uiso 1 1 d 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'
Cu Cu 0.3201 1.2651 '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'
Sr Sr -1.5307 3.2498 '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
O7 Cu1 N2 170.34(8) 2_565 . ?
O7 Cu1 O1 90.04(8) 2_565 . ?
N2 Cu1 O1 80.31(8) . . ?
O7 Cu1 N1 110.79(8) 2_565 . ?
N2 Cu1 N1 78.72(8) . . ?
O1 Cu1 N1 155.26(8) . . ?
O7 Cu1 O1W 92.24(8) 2_565 . ?
N2 Cu1 O1W 87.20(8) . . ?
O1 Cu1 O1W 89.54(8) . . ?
N1 Cu1 O1W 102.35(8) . . ?
C1 N1 C5 117.0(2) . . ?
C1 N1 Cu1 132.76(17) . . ?
C5 N1 Cu1 110.21(16) . . ?
N1 C1 C2 122.5(2) . . ?
N1 C1 C14 117.6(2) . . ?
C2 C1 C14 119.9(2) . . ?
C3 C2 C1 120.0(2) . . ?
C3 C2 H2A 120.0 . . ?
C1 C2 H2A 120.0 . . ?
C4 C3 C2 117.7(2) . . ?
C4 C3 C13 121.0(2) . . ?
C2 C3 C13 121.3(2) . . ?
C3 C4 C5 119.6(2) . . ?
C3 C4 H4A 120.2 . . ?
C5 C4 H4A 120.2 . . ?
N1 C5 C4 123.2(2) . . ?
N1 C5 C6 115.0(2) . . ?
C4 C5 C6 121.6(2) . . ?
N2 C6 C7 120.2(2) . . ?
N2 C6 C5 114.3(2) . . ?
C7 C6 C5 125.3(2) . . ?
C6 C7 C8 118.8(2) . . ?
C6 C7 H7A 120.6 . . ?
C8 C7 H7A 120.6 . . ?
C7 C8 C9 120.4(2) . . ?
C7 C8 C12 117.7(2) . . ?
C9 C8 C12 121.9(2) . . ?
C10 C9 C8 117.6(2) . . ?
C10 C9 H9A 121.2 . . ?
C8 C9 H9A 121.2 . . ?
N2 C10 C9 121.2(2) . . ?
N2 C10 C11 111.7(2) . . ?
C9 C10 C11 127.0(2) . . ?
C6 N2 C10 121.9(2) . . ?
C6 N2 Cu1 120.32(17) . . ?
C10 N2 Cu1 117.70(17) . . ?
O2 C11 O1 126.0(2) . . ?
O2 C11 C10 119.1(2) . . ?
O1 C11 C10 114.9(2) . . ?
O1 C11 Sr1 90.31(15) . 1_554 ?
C10 C11 Sr1 144.98(17) . 1_554 ?
C11 O1 Cu1 114.83(16) . . ?
C11 O2 Sr1 120.07(17) . 1_554 ?
O4 C12 O3 124.8(2) . . ?
O4 C12 C8 117.3(2) . . ?
O3 C12 C8 117.8(2) . . ?
O4 C12 Sr1 60.54(14) . . ?
O3 C12 Sr1 65.37(14) . . ?
C8 C12 Sr1 169.05(18) . . ?
C12 O3 Sr1 155.26(18) . 2_687 ?
C12 O3 Sr1 89.92(15) . . ?
Sr1 O3 Sr1 106.76(7) 2_687 . ?
C12 O4 Sr1 94.86(16) . . ?
O3 Sr1 O2 89.44(6) 2_687 1_556 ?
O3 Sr1 O8 98.90(6) 2_687 2_676 ?
O2 Sr1 O8 153.80(6) 1_556 2_676 ?
O3 Sr1 O4 121.16(6) 2_687 . ?
O2 Sr1 O4 121.08(6) 1_556 . ?
O8 Sr1 O4 75.40(6) 2_676 . ?
O3 Sr1 O5 88.78(6) 2_687 2_677 ?
O2 Sr1 O5 75.04(6) 1_556 2_677 ?
O8 Sr1 O5 80.33(6) 2_676 2_677 ?
O4 Sr1 O5 143.68(6) . 2_677 ?
O3 Sr1 O3W 166.69(7) 2_687 . ?
O2 Sr1 O3W 77.32(7) 1_556 . ?
O8 Sr1 O3W 92.54(7) 2_676 . ?
O4 Sr1 O3W 68.30(6) . . ?
O5 Sr1 O3W 86.44(6) 2_677 . ?
O3 Sr1 O2W 76.88(7) 2_687 . ?
O2 Sr1 O2W 70.72(7) 1_556 . ?
O8 Sr1 O2W 135.32(7) 2_676 . ?
O4 Sr1 O2W 69.87(7) . . ?
O5 Sr1 O2W 142.78(7) 2_677 . ?
O3W Sr1 O2W 99.69(7) . . ?
O3 Sr1 O3 73.24(7) 2_687 . ?
O2 Sr1 O3 134.74(6) 1_556 . ?
O8 Sr1 O3 71.38(6) 2_676 . ?
O4 Sr1 O3 49.05(6) . . ?
O5 Sr1 O3 143.16(6) 2_677 . ?
O3W Sr1 O3 117.27(6) . . ?
O2W Sr1 O3 64.78(6) . . ?
O3 Sr1 C12 96.75(7) 2_687 . ?
O2 Sr1 C12 129.62(7) 1_556 . ?
O8 Sr1 C12 74.28(7) 2_676 . ?
O4 Sr1 C12 24.59(6) . . ?
O5 Sr1 C12 154.55(7) 2_677 . ?
O3W Sr1 C12 92.87(7) . . ?
O2W Sr1 C12 62.39(7) . . ?
O3 Sr1 C12 24.71(6) . . ?
O3 Sr1 C11 103.11(6) 2_687 1_556 ?
O2 Sr1 C11 18.65(6) 1_556 1_556 ?
O8 Sr1 C11 154.90(6) 2_676 1_556 ?
O4 Sr1 C11 102.72(6) . 1_556 ?
O5 Sr1 C11 88.17(6) 2_677 1_556 ?
O3W Sr1 C11 64.35(7) . 1_556 ?
O2W Sr1 C11 62.76(7) . 1_556 ?
O3 Sr1 C11 126.67(6) . 1_556 ?
C12 Sr1 C11 114.43(7) . 1_556 ?
O3 Sr1 Sr1 38.74(4) 2_687 2_687 ?
O2 Sr1 Sr1 117.01(5) 1_556 2_687 ?
O8 Sr1 Sr1 83.27(4) 2_676 2_687 ?
O4 Sr1 Sr1 82.98(4) . 2_687 ?
O5 Sr1 Sr1 120.69(4) 2_677 2_687 ?
O3W Sr1 Sr1 151.06(5) . 2_687 ?
O2W Sr1 Sr1 65.62(5) . 2_687 ?
O3 Sr1 Sr1 34.50(4) . 2_687 ?
C12 Sr1 Sr1 58.38(5) . 2_687 ?
C11 Sr1 Sr1 121.63(4) 1_556 2_687 ?
O3 Sr1 H1W3 173.9(6) 2_687 . ?
O2 Sr1 H1W3 92.8(5) 1_556 . ?
O8 Sr1 H1W3 76.7(4) 2_676 . ?
O4 Sr1 H1W3 62.1(7) . . ?
O5 Sr1 H1W3 86.4(7) 2_677 . ?
O3W Sr1 H1W3 16.1(4) . . ?
O2W Sr1 H1W3 109.2(6) . . ?
O3 Sr1 H1W3 108.8(7) . . ?
C12 Sr1 H1W3 86.1(7) . . ?
C11 Sr1 H1W3 80.4(5) 1_556 . ?
Sr1 Sr1 H1W3 143.0(6) 2_687 . ?
O6 C13 O5 125.9(2) . . ?
O6 C13 C3 116.9(2) . . ?
O5 C13 C3 117.2(2) . . ?
C13 O5 Sr1 162.46(18) . 2_677 ?
O8 C14 O7 125.8(2) . . ?
O8 C14 C1 120.8(2) . . ?
O7 C14 C1 113.4(2) . . ?
C14 O7 Cu1 119.41(17) . 2_565 ?
C14 O8 Sr1 158.15(18) . 2_676 ?
Cu1 O1W H1W1 104(2) . . ?
Cu1 O1W H2W1 103(2) . . ?
H1W1 O1W H2W1 107(3) . . ?
Sr1 O2W H1W2 140(3) . . ?
Sr1 O2W H2W2 105(2) . . ?
H1W2 O2W H2W2 107(3) . . ?
Sr1 O3W H2W3 132(3) . . ?
Sr1 O3W H1W3 101(3) . . ?
H2W3 O3W H1W3 107(3) . . ?
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 O7 1.9014(19) 2_565 ?
Cu1 N2 1.911(2) . ?
Cu1 O1 2.0279(19) . ?
Cu1 N1 2.166(2) . ?
Cu1 O1W 2.386(2) . ?
N1 C1 1.348(3) . ?
N1 C5 1.358(3) . ?
C1 C2 1.395(4) . ?
C1 C14 1.514(4) . ?
C2 C3 1.389(4) . ?
C2 H2A 0.9500 . ?
C3 C4 1.383(3) . ?
C3 C13 1.524(3) . ?
C4 C5 1.387(3) . ?
C4 H4A 0.9500 . ?
C5 C6 1.472(3) . ?
C6 N2 1.329(3) . ?
C6 C7 1.383(3) . ?
C7 C8 1.391(3) . ?
C7 H7A 0.9500 . ?
C8 C9 1.391(4) . ?
C8 C12 1.508(3) . ?
C9 C10 1.381(3) . ?
C9 H9A 0.9500 . ?
C10 N2 1.343(3) . ?
C10 C11 1.502(4) . ?
C11 O2 1.246(3) . ?
C11 O1 1.276(3) . ?
C11 Sr1 3.374(3) 1_554 ?
O2 Sr1 2.5723(19) 1_554 ?
C12 O4 1.256(3) . ?
C12 O3 1.257(3) . ?
C12 Sr1 3.006(3) . ?
O3 Sr1 2.4737(19) 2_687 ?
O3 Sr1 2.7329(19) . ?
O4 Sr1 2.6272(19) . ?
Sr1 O3 2.4737(19) 2_687 ?
Sr1 O2 2.5723(19) 1_556 ?
Sr1 O8 2.5800(19) 2_676 ?
Sr1 O5 2.6290(19) 2_677 ?
Sr1 O3W 2.635(2) . ?
Sr1 O2W 2.688(2) . ?
Sr1 C11 3.374(3) 1_556 ?
Sr1 Sr1 4.1818(5) 2_687 ?
Sr1 H1W3 2.91(3) . ?
C13 O6 1.244(3) . ?
C13 O5 1.267(3) . ?
O5 Sr1 2.6290(19) 2_677 ?
C14 O8 1.229(3) . ?
C14 O7 1.286(3) . ?
O7 Cu1 1.9014(18) 2_565 ?
O8 Sr1 2.5800(19) 2_676 ?
O1W H1W1 0.827(17) . ?
O1W H2W1 0.809(18) . ?
O2W H1W2 0.841(18) . ?
O2W H2W2 0.855(18) . ?
O3W H2W3 0.821(18) . ?
O3W H1W3 0.822(18) . ?
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
O1W H1W1 O6 0.827(17) 2.015(18) 2.840(3) 175(3) 1_565
O1W H2W1 O5 0.809(18) 2.074(18) 2.870(3) 168(3) 2_566
O2W H1W2 O1W 0.841(18) 2.090(19) 2.912(3) 166(4) 2_576
O2W H2W2 O1 0.855(18) 1.94(2) 2.712(3) 150(3) 1_556
O3W H2W3 O4 0.821(18) 2.22(2) 3.014(3) 162(3) 2_677
O3W H1W3 O7 0.822(18) 2.009(19) 2.810(3) 165(4) 1_666
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
O7 Cu1 N1 C1 4.6(3) 2_565 . . . ?
N2 Cu1 N1 C1 -173.6(2) . . . . ?
O1 Cu1 N1 C1 -141.1(2) . . . . ?
O1W Cu1 N1 C1 101.8(2) . . . . ?
O7 Cu1 N1 C5 -172.12(16) 2_565 . . . ?
N2 Cu1 N1 C5 9.68(17) . . . . ?
O1 Cu1 N1 C5 42.2(3) . . . . ?
O1W Cu1 N1 C5 -74.89(17) . . . . ?
C5 N1 C1 C2 1.3(4) . . . . ?
Cu1 N1 C1 C2 -175.25(19) . . . . ?
C5 N1 C1 C14 -177.6(2) . . . . ?
Cu1 N1 C1 C14 5.9(4) . . . . ?
N1 C1 C2 C3 -1.3(4) . . . . ?
C14 C1 C2 C3 177.6(2) . . . . ?
C1 C2 C3 C4 0.3(4) . . . . ?
C1 C2 C3 C13 179.1(2) . . . . ?
C2 C3 C4 C5 0.7(4) . . . . ?
C13 C3 C4 C5 -178.1(2) . . . . ?
C1 N1 C5 C4 -0.3(4) . . . . ?
Cu1 N1 C5 C4 177.0(2) . . . . ?
C1 N1 C5 C6 175.4(2) . . . . ?
Cu1 N1 C5 C6 -7.3(3) . . . . ?
C3 C4 C5 N1 -0.7(4) . . . . ?
C3 C4 C5 C6 -176.1(2) . . . . ?
N1 C5 C6 N2 -0.8(3) . . . . ?
C4 C5 C6 N2 174.9(2) . . . . ?
N1 C5 C6 C7 -174.9(2) . . . . ?
C4 C5 C6 C7 0.8(4) . . . . ?
N2 C6 C7 C8 0.2(4) . . . . ?
C5 C6 C7 C8 173.9(2) . . . . ?
C6 C7 C8 C9 -0.4(4) . . . . ?
C6 C7 C8 C12 -177.2(2) . . . . ?
C7 C8 C9 C10 -0.1(4) . . . . ?
C12 C8 C9 C10 176.5(2) . . . . ?
C8 C9 C10 N2 0.9(4) . . . . ?
C8 C9 C10 C11 -175.2(2) . . . . ?
C7 C6 N2 C10 0.6(4) . . . . ?
C5 C6 N2 C10 -173.8(2) . . . . ?
C7 C6 N2 Cu1 -175.16(19) . . . . ?
C5 C6 N2 Cu1 10.4(3) . . . . ?
C9 C10 N2 C6 -1.2(4) . . . . ?
C11 C10 N2 C6 175.5(2) . . . . ?
C9 C10 N2 Cu1 174.71(19) . . . . ?
C11 C10 N2 Cu1 -8.6(3) . . . . ?
O1 Cu1 N2 C6 -178.0(2) . . . . ?
N1 Cu1 N2 C6 -11.2(2) . . . . ?
O1W Cu1 N2 C6 92.0(2) . . . . ?
O1 Cu1 N2 C10 6.06(19) . . . . ?
N1 Cu1 N2 C10 172.9(2) . . . . ?
O1W Cu1 N2 C10 -83.96(19) . . . . ?
N2 C10 C11 O2 -170.5(2) . . . . ?
C9 C10 C11 O2 5.9(4) . . . . ?
N2 C10 C11 O1 6.8(3) . . . . ?
C9 C10 C11 O1 -176.7(3) . . . . ?
N2 C10 C11 Sr1 -125.4(3) . . . 1_554 ?
C9 C10 C11 Sr1 51.1(4) . . . 1_554 ?
O2 C11 O1 Cu1 175.0(2) . . . . ?
C10 C11 O1 Cu1 -2.1(3) . . . . ?
Sr1 C11 O1 Cu1 152.70(11) 1_554 . . . ?
O7 Cu1 O1 C11 177.62(19) 2_565 . . . ?
N2 Cu1 O1 C11 -1.86(19) . . . . ?
N1 Cu1 O1 C11 -34.2(3) . . . . ?
O1W Cu1 O1 C11 85.38(19) . . . . ?
O1 C11 O2 Sr1 -35.1(4) . . . 1_554 ?
C10 C11 O2 Sr1 141.93(19) . . . 1_554 ?
C7 C8 C12 O4 26.3(4) . . . . ?
C9 C8 C12 O4 -150.4(3) . . . . ?
C7 C8 C12 O3 -154.0(2) . . . . ?
C9 C8 C12 O3 29.4(4) . . . . ?
C7 C8 C12 Sr1 -49.7(10) . . . . ?
C9 C8 C12 Sr1 133.6(9) . . . . ?
O4 C12 O3 Sr1 -145.3(3) . . . 2_687 ?
C8 C12 O3 Sr1 35.0(6) . . . 2_687 ?
Sr1 C12 O3 Sr1 -133.3(4) . . . 2_687 ?
O4 C12 O3 Sr1 -12.0(3) . . . . ?
C8 C12 O3 Sr1 168.3(2) . . . . ?
O3 C12 O4 Sr1 12.5(3) . . . . ?
C8 C12 O4 Sr1 -167.8(2) . . . . ?
C12 O4 Sr1 O3 7.63(18) . . . 2_687 ?
C12 O4 Sr1 O2 118.18(16) . . . 1_556 ?
C12 O4 Sr1 O8 -84.05(16) . . . 2_676 ?
C12 O4 Sr1 O5 -133.70(16) . . . 2_677 ?
C12 O4 Sr1 O3W 177.15(18) . . . . ?
C12 O4 Sr1 O2W 67.35(16) . . . . ?
C12 O4 Sr1 O3 -6.22(15) . . . . ?
C12 O4 Sr1 C11 121.72(16) . . . 1_556 ?
C12 O4 Sr1 Sr1 0.79(15) . . . 2_687 ?
C12 O3 Sr1 O3 -161.46(19) . . . 2_687 ?
Sr1 O3 Sr1 O3 0.0 2_687 . . 2_687 ?
C12 O3 Sr1 O2 -89.68(17) . . . 1_556 ?
Sr1 O3 Sr1 O2 71.77(10) 2_687 . . 1_556 ?
C12 O3 Sr1 O8 92.77(16) . . . 2_676 ?
Sr1 O3 Sr1 O8 -105.78(8) 2_687 . . 2_676 ?
C12 O3 Sr1 O4 6.19(15) . . . . ?
Sr1 O3 Sr1 O4 167.65(11) 2_687 . . . ?
C12 O3 Sr1 O5 134.58(16) . . . 2_677 ?
Sr1 O3 Sr1 O5 -63.96(12) 2_687 . . 2_677 ?
C12 O3 Sr1 O3W 9.72(18) . . . . ?
Sr1 O3 Sr1 O3W 171.17(7) 2_687 . . . ?
C12 O3 Sr1 O2W -78.36(16) . . . . ?
Sr1 O3 Sr1 O2W 83.10(9) 2_687 . . . ?
Sr1 O3 Sr1 C12 161.46(19) 2_687 . . . ?
C12 O3 Sr1 C11 -67.38(17) . . . 1_556 ?
Sr1 O3 Sr1 C11 94.07(8) 2_687 . . 1_556 ?
C12 O3 Sr1 Sr1 -161.46(19) . . . 2_687 ?
O4 C12 Sr1 O3 -173.43(16) . . . 2_687 ?
O3 C12 Sr1 O3 17.86(19) . . . 2_687 ?
C8 C12 Sr1 O3 -91.6(10) . . . 2_687 ?
O4 C12 Sr1 O2 -78.55(18) . . . 1_556 ?
O3 C12 Sr1 O2 112.74(15) . . . 1_556 ?
C8 C12 Sr1 O2 3.3(10) . . . 1_556 ?
O4 C12 Sr1 O8 89.18(16) . . . 2_676 ?
O3 C12 Sr1 O8 -79.53(16) . . . 2_676 ?
C8 C12 Sr1 O8 171.0(10) . . . 2_676 ?
O3 C12 Sr1 O4 -168.7(3) . . . . ?
C8 C12 Sr1 O4 81.8(9) . . . . ?
O4 C12 Sr1 O5 85.1(2) . . . 2_677 ?
O3 C12 Sr1 O5 -83.6(2) . . . 2_677 ?
C8 C12 Sr1 O5 166.9(9) . . . 2_677 ?
O4 C12 Sr1 O3W -2.65(17) . . . . ?
O3 C12 Sr1 O3W -171.36(16) . . . . ?
C8 C12 Sr1 O3W 79.2(10) . . . . ?
O4 C12 Sr1 O2W -102.08(17) . . . . ?
O3 C12 Sr1 O2W 89.21(16) . . . . ?
C8 C12 Sr1 O2W -20.3(9) . . . . ?
O4 C12 Sr1 O3 168.7(3) . . . . ?
C8 C12 Sr1 O3 -109.5(10) . . . . ?
O4 C12 Sr1 C11 -65.70(17) . . . 1_556 ?
O3 C12 Sr1 C11 125.59(15) . . . 1_556 ?
C8 C12 Sr1 C11 16.1(10) . . . 1_556 ?
O4 C12 Sr1 Sr1 -179.08(18) . . . 2_687 ?
O3 C12 Sr1 Sr1 12.21(13) . . . 2_687 ?
C8 C12 Sr1 Sr1 -97.2(10) . . . 2_687 ?
C4 C3 C13 O6 170.8(2) . . . . ?
C2 C3 C13 O6 -8.0(4) . . . . ?
C4 C3 C13 O5 -7.8(4) . . . . ?
C2 C3 C13 O5 173.4(2) . . . . ?
O6 C13 O5 Sr1 120.6(5) . . . 2_677 ?
C3 C13 O5 Sr1 -60.9(7) . . . 2_677 ?
N1 C1 C14 O8 46.4(4) . . . . ?
C2 C1 C14 O8 -132.6(3) . . . . ?
N1 C1 C14 O7 -133.6(2) . . . . ?
C2 C1 C14 O7 47.5(3) . . . . ?
O8 C14 O7 Cu1 -8.2(4) . . . 2_565 ?
C1 C14 O7 Cu1 171.71(16) . . . 2_565 ?
O7 C14 O8 Sr1 -126.1(4) . . . 2_676 ?
C1 C14 O8 Sr1 54.0(6) . . . 2_676 ?
