#------------------------------------------------------------------------------
#$Date: 2016-03-25 13:00:48 +0200 (Fri, 25 Mar 2016) $
#$Revision: 179821 $
#$URL: svn://www.crystallography.net/cod/cif/7/01/17/7011779.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_7011779
loop_
_publ_author_name
'Czerwieniec, Rafal'
'Kapturkiewicz, Andrzej'
'Anulewicz-Ostrowska, Romana'
'Nowacki, Jacek'
_publ_section_title
;
 ReI(CO)3+ complexes with N???O??? bidentate ligands
;
_journal_issue                   18
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              3434
_journal_paper_doi               10.1039/b204020D
_journal_year                    2002
_chemical_formula_sum            'C23 H18 Cl2 N3 O4 Re'
_chemical_formula_weight         657.50
_chemical_name_systematic
; 
? 
;
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL
_cell_angle_alpha                90.00
_cell_angle_beta                 107.96(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   14.878(3)
_cell_length_b                   15.228(3)
_cell_length_c                   11.207(2)
_cell_measurement_temperature    293(2)
_cell_volume                     2415.4(9)
_computing_cell_refinement       'KUMA CCD RED'
_computing_data_collection       'KUMA CCD'
_computing_data_reduction        'KUMA CCD RED'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-86 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_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  0.0901
_diffrn_reflns_av_sigmaI/netI    0.0883
_diffrn_reflns_limit_h_max       20
_diffrn_reflns_limit_h_min       -19
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       15
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            14280
_diffrn_reflns_theta_max         22.50
_diffrn_reflns_theta_min         3.17
_exptl_absorpt_coefficient_mu    5.286
_exptl_absorpt_correction_T_max  0.713
_exptl_absorpt_correction_T_min  0.465
_exptl_absorpt_correction_type   numerical
_exptl_crystal_density_diffrn    1.808
_exptl_crystal_F_000             1272
_exptl_crystal_size_max          0.2
_exptl_crystal_size_mid          0.1
_exptl_crystal_size_min          0.1
_refine_diff_density_max         0.773
_refine_diff_density_min         -0.566
_refine_diff_density_rms         0.125
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_all   0.958
_refine_ls_goodness_of_fit_obs   1.022
_refine_ls_matrix_type           full
_refine_ls_number_parameters     316
_refine_ls_number_reflns         3136
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.957
_refine_ls_restrained_S_obs      1.022
_refine_ls_R_factor_all          0.0828
_refine_ls_R_factor_obs          0.0461
_refine_ls_shift/esd_max         0.380
_refine_ls_shift/esd_mean        0.008
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0302P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_all         0.0915
_refine_ls_wR_factor_obs         0.0795
_reflns_number_observed          2176
_reflns_number_total             3142
_reflns_observed_criterion       >2sigma(I)
_cod_data_source_file            b204020D.txt
_cod_data_source_block           Re(CO)3(BIP)pyr
_cod_depositor_comments
;
The following automatic conversions were performed:

'_refine_ls_weighting_scheme' value 'calc
w=1/[\s^2^(Fo^2^)+(0.0302P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3' was
changed to 'calc'. New tag '_refine_ls_weighting_details' was
created. The value of the new tag was set to
'w=1/[\s^2^(Fo^2^)+(0.0302P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'.

Automatic conversion script
Id: cif_fix_values 3143 2015-03-26 13:38:13Z robertas 
;
_cod_original_cell_volume        2415.4(8)
_cod_original_sg_symbol_H-M      P2(1)/c
_cod_database_code               7011779
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, y+1/2, -z+1/2'
'-x, -y, -z'
'x, -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_thermal_displace_type
_atom_site_occupancy
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_group
Re Re 0.31166(3) 0.51148(3) 0.25056(4) 0.0487(2) Uani 1 d . .
C1 C 0.3012(7) 0.4355(7) -0.0089(9) 0.046(3) Uani 1 d . .
N1 N 0.3254(6) 0.4489(5) -0.1177(7) 0.042(2) Uani 1 d . .
C2 C 0.3758(7) 0.5253(7) -0.1032(9) 0.044(3) Uani 1 d . .
C3 C 0.4168(8) 0.5682(8) -0.1835(11) 0.057(3) Uani 1 d . .
H3 H 0.4136(8) 0.5454(8) -0.2617(11) 0.181(76) Uiso 1 calc R .
C4 C 0.4687(8) 0.6799(8) -0.0261(11) 0.061(4) Uani 1 d . .
H4 H 0.5004(8) 0.7327(8) -0.0016(11) 0.065(36) Uiso 1 calc R .
C5 C 0.4623(8) 0.6456(9) -0.1406(12) 0.064(3) Uani 1 d . .
H5 H 0.4900(8) 0.6761(9) -0.1921(12) 0.062(34) Uiso 1 calc R .
C6 C 0.4286(7) 0.6374(7) 0.0549(10) 0.049(3) Uani 1 d . .
H6 H 0.4323(7) 0.6606(7) 0.1330(10) 0.051(31) Uiso 1 calc R .
C7 C 0.3831(7) 0.5588(7) 0.0137(9) 0.044(3) Uani 1 d . .
N2 N 0.3343(5) 0.5023(5) 0.0704(7) 0.041(2) Uani 1 d . .
C8 C 0.2930(11) 0.3993(9) -0.2363(11) 0.070(4) Uani 1 d . .
H81 H 0.2592(11) 0.3479(9) -0.2245(11) 0.165(74) Uiso 1 calc R .
H82 H 0.3466(11) 0.3820(9) -0.2613(11) 0.109(53) Uiso 1 calc R .
H83 H 0.2520(11) 0.4356(9) -0.3002(11) 0.167(78) Uiso 1 calc R .
C9 C 0.2444(7) 0.3645(6) 0.0131(9) 0.041(3) Uani 1 d . .
C10 C 0.2469(9) 0.2809(7) -0.0364(10) 0.056(3) Uani 1 d . .
H10 H 0.2891(9) 0.2698(7) -0.0809(10) 0.018(23) Uiso 1 calc R .
C11 C 0.1897(10) 0.2152(8) -0.0217(12) 0.071(4) Uani 1 d . .
H11 H 0.1935(10) 0.1597(8) -0.0545(12) 0.121(56) Uiso 1 calc R .
C12 C 0.1263(10) 0.2317(8) 0.0422(12) 0.069(4) Uani 1 d . .
H12 H 0.0838(10) 0.1885(8) 0.0486(12) 0.051(34) Uiso 1 calc R .
C13 C 0.1258(9) 0.3113(8) 0.0959(10) 0.061(3) Uani 1 d . .
H13 H 0.0844(9) 0.3205(8) 0.1420(10) 0.011(22) Uiso 1 calc R .
C14 C 0.1844(8) 0.3799(7) 0.0852(10) 0.045(3) Uani 1 d . .
O1 O 0.1815(5) 0.4548(5) 0.1411(6) 0.053(2) Uani 1 d . .
N3 N 0.2404(6) 0.6374(5) 0.1744(8) 0.045(2) Uani 1 d . .
C15 C 0.1843(8) 0.6436(8) 0.0603(11) 0.054(3) Uani 1 d . .
H15 H 0.1729(8) 0.5935(8) 0.0104(11) 0.031(26) Uiso 1 calc R .
C16 C 0.1407(9) 0.7213(8) 0.0090(14) 0.069(4) Uani 1 d . .
H16 H 0.1002(9) 0.7231(8) -0.0729(14) 0.128(62) Uiso 1 calc R .
C17 C 0.1584(10) 0.7946(9) 0.0810(15) 0.073(4) Uani 1 d . .
H17 H 0.1308(10) 0.8480(9) 0.0495(15) 0.115(53) Uiso 1 calc R .
C18 C 0.2176(9) 0.7884(9) 0.2004(15) 0.077(4) Uani 1 d . .
H18 H 0.2311(9) 0.8383(9) 0.2505(15) 0.059(34) Uiso 1 calc R .
C19 C 0.2574(9) 0.7102(8) 0.2476(13) 0.061(3) Uani 1 d . .
H19 H 0.2963(9) 0.7068(8) 0.3302(13) 0.084(46) Uiso 1 calc R .
C20 C 0.2793(9) 0.5217(7) 0.4030(10) 0.067(4) Uani 1 d . .
O2 O 0.2613(7) 0.5276(6) 0.4943(8) 0.100(3) Uani 1 d . .
C21 C 0.3670(8) 0.3999(8) 0.3049(9) 0.053(3) Uani 1 d . .
O3 O 0.4010(7) 0.3331(5) 0.3375(8) 0.080(3) Uani 1 d . .
C22 C 0.4261(10) 0.5629(9) 0.3330(11) 0.068(4) Uani 1 d . .
O4 O 0.5034(7) 0.5921(6) 0.3851(8) 0.085(3) Uani 1 d . .
Cl1 Cl 0.0141(4) 0.6321(3) 0.2504(5) 0.140(2) Uani 1 d . .
Cl2 Cl -0.0535(5) 0.4588(4) 0.2617(6) 0.187(2) Uani 1 d . .
C99 C -0.0002(20) 0.5312(10) 0.1849(23) 0.146(8) Uani 1 d . .
H991 H 0.0611(20) 0.5082(10) 0.1869(23) 0.549(246) Uiso 1 calc R .
H992 H -0.0386(20) 0.5358(10) 0.0978(23) 0.430(244) Uiso 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'
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'
Re Re -1.0185 7.2310 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cl Cl 0.1484 0.1585 '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
C22 Re C21 88.7(5) . . ?
C22 Re C20 88.0(5) . . ?
C21 Re C20 89.4(4) . . ?
C22 Re O1 175.3(4) . . ?
C21 Re O1 92.8(4) . . ?
C20 Re O1 96.5(4) . . ?
C22 Re N2 96.3(4) . . ?
C21 Re N2 93.7(4) . . ?
C20 Re N2 174.7(4) . . ?
O1 Re N2 79.1(3) . . ?
C22 Re N3 94.8(4) . . ?
C21 Re N3 175.9(4) . . ?
C20 Re N3 92.9(4) . . ?
O1 Re N3 83.5(3) . . ?
N2 Re N3 83.7(3) . . ?
N2 C1 N1 109.2(9) . . ?
N2 C1 C9 124.8(9) . . ?
N1 C1 C9 125.9(10) . . ?
C2 N1 C1 107.6(8) . . ?
C2 N1 C8 124.0(9) . . ?
C1 N1 C8 127.9(10) . . ?
N1 C2 C7 107.9(9) . . ?
N1 C2 C3 130.9(10) . . ?
C7 C2 C3 121.2(11) . . ?
C5 C3 C2 116.3(11) . . ?
C5 C3 H3 121.8(7) . . ?
C2 C3 H3 121.8(7) . . ?
C5 C4 C6 121.2(12) . . ?
C5 C4 H4 119.4(8) . . ?
C6 C4 H4 119.4(7) . . ?
C4 C5 C3 123.0(12) . . ?
C4 C5 H5 118.5(8) . . ?
C3 C5 H5 118.5(7) . . ?
C7 C6 C4 116.8(11) . . ?
C7 C6 H6 121.6(7) . . ?
C4 C6 H6 121.6(7) . . ?
C2 C7 C6 121.6(11) . . ?
C2 C7 N2 107.8(9) . . ?
C6 C7 N2 130.5(10) . . ?
C1 N2 C7 107.5(8) . . ?
C1 N2 Re 122.7(7) . . ?
C7 N2 Re 129.8(7) . . ?
N1 C8 H81 109.5(6) . . ?
N1 C8 H82 109.5(7) . . ?
H81 C8 H82 109.5 . . ?
N1 C8 H83 109.5(7) . . ?
H81 C8 H83 109.5 . . ?
H82 C8 H83 109.5 . . ?
C10 C9 C14 118.9(10) . . ?
C10 C9 C1 121.9(10) . . ?
C14 C9 C1 119.2(9) . . ?
C11 C10 C9 122.1(12) . . ?
C11 C10 H10 118.9(8) . . ?
C9 C10 H10 118.9(7) . . ?
C10 C11 C12 119.1(13) . . ?
C10 C11 H11 120.5(8) . . ?
C12 C11 H11 120.5(8) . . ?
C13 C12 C11 119.6(13) . . ?
C13 C12 H12 120.2(9) . . ?
C11 C12 H12 120.2(8) . . ?
C12 C13 C14 123.1(13) . . ?
C12 C13 H13 118.5(9) . . ?
C14 C13 H13 118.5(7) . . ?
O1 C14 C13 120.0(11) . . ?
O1 C14 C9 123.0(10) . . ?
C13 C14 C9 117.0(11) . . ?
C14 O1 Re 118.1(7) . . ?
C15 N3 C19 118.7(10) . . ?
C15 N3 Re 121.7(8) . . ?
C19 N3 Re 119.6(8) . . ?
N3 C15 C16 123.2(12) . . ?
N3 C15 H15 118.4(7) . . ?
C16 C15 H15 118.4(8) . . ?
C17 C16 C15 118.4(13) . . ?
C17 C16 H16 120.8(9) . . ?
C15 C16 H16 120.8(8) . . ?
C16 C17 C18 118.5(13) . . ?
C16 C17 H17 120.8(9) . . ?
C18 C17 H17 120.8(8) . . ?
C17 C18 C19 121.0(13) . . ?
C17 C18 H18 119.5(8) . . ?
C19 C18 H18 119.5(8) . . ?
N3 C19 C18 120.1(12) . . ?
N3 C19 H19 119.9(7) . . ?
C18 C19 H19 119.9(8) . . ?
O2 C20 Re 179.2(12) . . ?
O3 C21 Re 179.4(11) . . ?
O4 C22 Re 176.1(12) . . ?
Cl1 C99 Cl2 112.2(9) . . ?
Cl1 C99 H991 109.3(9) . . ?
Cl2 C99 H991 109.3(9) . . ?
Cl1 C99 H992 109.1(10) . . ?
Cl2 C99 H992 109.0(10) . . ?
H991 C99 H992 107.9 . . ?
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
Re C22 1.84(2) . ?
Re C21 1.905(13) . ?
Re C20 1.919(12) . ?
Re O1 2.130(7) . ?
Re N2 2.151(7) . ?
Re N3 2.230(8) . ?
C1 N2 1.342(11) . ?
C1 N1 1.388(12) . ?
C1 C9 1.440(14) . ?
N1 C2 1.366(12) . ?
N1 C8 1.475(12) . ?
C2 C7 1.379(12) . ?
C2 C3 1.395(13) . ?
C3 C5 1.371(15) . ?
C3 H3 0.93 . ?
C4 C5 1.361(14) . ?
C4 C6 1.390(13) . ?
C4 H4 0.93 . ?
C5 H5 0.93 . ?
C6 C7 1.383(13) . ?
C6 H6 0.93 . ?
C7 N2 1.398(12) . ?
C8 H81 0.96 . ?
C8 H82 0.96 . ?
C8 H83 0.96 . ?
C9 C10 1.394(13) . ?
C9 C14 1.397(13) . ?
C10 C11 1.355(15) . ?
C10 H10 0.93 . ?
C11 C12 1.37(2) . ?
C11 H11 0.93 . ?
C12 C13 1.354(14) . ?
C12 H12 0.93 . ?
C13 C14 1.389(14) . ?
C13 H13 0.93 . ?
C14 O1 1.308(11) . ?
N3 C15 1.297(12) . ?
N3 C19 1.356(13) . ?
C15 C16 1.387(14) . ?
C15 H15 0.93 . ?
C16 C17 1.36(2) . ?
C16 H16 0.93 . ?
C17 C18 1.36(2) . ?
C17 H17 0.93 . ?
C18 C19 1.362(15) . ?
C18 H18 0.93 . ?
C19 H19 0.93 . ?
C20 O2 1.139(12) . ?
C21 O3 1.145(12) . ?
C22 O4 1.203(14) . ?
Cl1 C99 1.688(14) . ?
Cl2 C99 1.734(14) . ?
C99 H991 0.97 . ?
C99 H992 0.97 . ?
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
N2 C1 N1 C2 1.0(10) . . . . ?
C9 C1 N1 C2 177.2(10) . . . . ?
N2 C1 N1 C8 -170.8(10) . . . . ?
C9 C1 N1 C8 5.4(17) . . . . ?
C1 N1 C2 C7 0.2(10) . . . . ?
C8 N1 C2 C7 172.4(10) . . . . ?
C1 N1 C2 C3 179.6(11) . . . . ?
C8 N1 C2 C3 -8.1(17) . . . . ?
N1 C2 C3 C5 179.1(10) . . . . ?
C7 C2 C3 C5 -1.5(16) . . . . ?
C6 C4 C5 C3 0.0(19) . . . . ?
C2 C3 C5 C4 0.5(17) . . . . ?
C5 C4 C6 C7 0.5(16) . . . . ?
N1 C2 C7 C6 -178.4(9) . . . . ?
C3 C2 C7 C6 2.0(16) . . . . ?
N1 C2 C7 N2 -1.2(11) . . . . ?
C3 C2 C7 N2 179.3(9) . . . . ?
C4 C6 C7 C2 -1.5(15) . . . . ?
C4 C6 C7 N2 -178.0(10) . . . . ?
N1 C1 N2 C7 -1.7(11) . . . . ?
C9 C1 N2 C7 -177.9(9) . . . . ?
N1 C1 N2 Re 178.8(6) . . . . ?
C9 C1 N2 Re 2.5(13) . . . . ?
C2 C7 N2 C1 1.8(11) . . . . ?
C6 C7 N2 C1 178.7(10) . . . . ?
C2 C7 N2 Re -178.7(6) . . . . ?
C6 C7 N2 Re -1.8(15) . . . . ?
C22 Re N2 C1 145.4(8) . . . . ?
C21 Re N2 C1 56.3(8) . . . . ?
C20 Re N2 C1 -70.0(42) . . . . ?
O1 Re N2 C1 -35.8(7) . . . . ?
N3 Re N2 C1 -120.4(8) . . . . ?
C22 Re N2 C7 -34.0(9) . . . . ?
C21 Re N2 C7 -123.1(8) . . . . ?
C20 Re N2 C7 110.6(40) . . . . ?
O1 Re N2 C7 144.7(8) . . . . ?
N3 Re N2 C7 60.1(8) . . . . ?
N2 C1 C9 C10 -150.4(10) . . . . ?
N1 C1 C9 C10 34.0(16) . . . . ?
N2 C1 C9 C14 30.2(15) . . . . ?
N1 C1 C9 C14 -145.4(10) . . . . ?
C14 C9 C10 C11 3.1(17) . . . . ?
C1 C9 C10 C11 -176.3(11) . . . . ?
C9 C10 C11 C12 1.0(19) . . . . ?
C10 C11 C12 C13 -4.0(20) . . . . ?
C11 C12 C13 C14 2.9(19) . . . . ?
C12 C13 C14 O1 -178.9(10) . . . . ?
C12 C13 C14 C9 1.2(17) . . . . ?
C10 C9 C14 O1 176.0(10) . . . . ?
C1 C9 C14 O1 -4.6(15) . . . . ?
C10 C9 C14 C13 -4.2(15) . . . . ?
C1 C9 C14 C13 175.3(9) . . . . ?
C13 C14 O1 Re 131.2(9) . . . . ?
C9 C14 O1 Re -49.0(12) . . . . ?
C22 Re O1 C14 73.4(52) . . . . ?
C21 Re O1 C14 -34.9(7) . . . . ?
C20 Re O1 C14 -124.7(7) . . . . ?
N2 Re O1 C14 58.3(7) . . . . ?
N3 Re O1 C14 143.1(7) . . . . ?
C22 Re N3 C15 138.3(9) . . . . ?
C21 Re N3 C15 -9.1(56) . . . . ?
C20 Re N3 C15 -133.4(9) . . . . ?
O1 Re N3 C15 -37.3(8) . . . . ?
N2 Re N3 C15 42.5(8) . . . . ?
C22 Re N3 C19 -40.0(8) . . . . ?
C21 Re N3 C19 172.6(51) . . . . ?
C20 Re N3 C19 48.2(9) . . . . ?
O1 Re N3 C19 144.4(8) . . . . ?
N2 Re N3 C19 -135.9(8) . . . . ?
C19 N3 C15 C16 0.0(17) . . . . ?
Re N3 C15 C16 -178.4(9) . . . . ?
N3 C15 C16 C17 1.0(19) . . . . ?
C15 C16 C17 C18 -0.5(19) . . . . ?
C16 C17 C18 C19 -0.9(21) . . . . ?
C15 N3 C19 C18 -1.3(16) . . . . ?
Re N3 C19 C18 177.0(9) . . . . ?
C17 C18 C19 N3 1.8(20) . . . . ?
C22 Re C20 O2 -34.6(690) . . . . ?
C21 Re C20 O2 54.1(690) . . . . ?
O1 Re C20 O2 146.8(690) . . . . ?
N2 Re C20 O2 -179.5(1000) . . . . ?
N3 Re C20 O2 -129.3(690) . . . . ?
C22 Re C21 O3 -34.9(894) . . . . ?
C20 Re C21 O3 -122.9(894) . . . . ?
O1 Re C21 O3 140.6(894) . . . . ?
N2 Re C21 O3 61.4(894) . . . . ?
N3 Re C21 O3 112.6(886) . . . . ?
C21 Re C22 O4 33.9(144) . . . . ?
C20 Re C22 O4 123.4(144) . . . . ?
O1 Re C22 O4 -74.6(160) . . . . ?
N2 Re C22 O4 -59.7(144) . . . . ?
N3 Re C22 O4 -143.9(144) . . . . ?
