#------------------------------------------------------------------------------
#$Date: 2016-02-21 02:03:34 +0200 (Sun, 21 Feb 2016) $
#$Revision: 176798 $
#$URL: svn://www.crystallography.net/cod/cif/2/23/89/2238916.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2238916
loop_
_publ_author_name
'Maaloui, Ahlem'
'Toumi, Samah Akriche'
'Rzaigui, Mohamed'
_publ_section_title
;
 Bis(4-aminopyridinium)
 μ₆-oxido-dodeca-μ₂-oxido-hexaoxido[rhenium(VII)tetratungsten(VI)vanadium(V)]ate
 heptahydrate
;
_journal_coeditor_code           RZ5088
_journal_issue                   12
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m661
_journal_page_last               m662
_journal_paper_doi               10.1107/S1600536813030687
_journal_volume                  69
_journal_year                    2013
_chemical_formula_iupac          '(C5 H7 N2)2 [Re V W4 O19], 7H2 O'
_chemical_formula_moiety         '2(C5 H7 N2 +), O19 Re V W4 2-, 7(H2 O)'
_chemical_formula_sum            'C10 H28 N4 O26 Re V W4'
_chemical_formula_weight         1592.90
_chemical_name_systematic
;Bis(4-aminopyridinium)
μ₆-oxido-dodeca-μ₂-oxido-hexaoxido[rhenium(VII)tetratungsten(VI)vanadium(V)]ate heptahydrate
;
_space_group_IT_number           51
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2a 2a'
_symmetry_space_group_name_H-M   'P m m a'
_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                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   17.837(2)
_cell_length_b                   9.163(4)
_cell_length_c                   10.552(3)
_cell_measurement_reflns_used    25
_cell_measurement_temperature    298
_cell_measurement_theta_max      11
_cell_measurement_theta_min      9
_cell_volume                     1724.6(9)
_computing_cell_refinement       'CAD-4 EXPRESS (Enraf--Nonius, 1994)'
_computing_data_collection       'CAD-4 EXPRESS (Enraf--Nonius, 1994)'
_computing_data_reduction        'XCAD4 (Harms & Wocadlo, 1996)'
_computing_molecular_graphics
;
ORTEP-3 for Windows (Farrugia, 2012) and DIAMOND (Brandenburg & Putz,
2005)
;
_computing_publication_material
;
WinGX (Farrugia, 2012)
;
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      298
_diffrn_measured_fraction_theta_full 0.965
_diffrn_measured_fraction_theta_max 0.965
_diffrn_measurement_device       'κ-geometry diffractometer'
_diffrn_measurement_device_type  'Enraf--Nonius CAD-4'
_diffrn_measurement_method       'non-profiled omega scans'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           AgK\a
_diffrn_radiation_wavelength     0.56087
_diffrn_reflns_av_R_equivalents  0.0516
_diffrn_reflns_av_sigmaI/netI    0.0825
_diffrn_reflns_limit_h_max       2
_diffrn_reflns_limit_h_min       -29
_diffrn_reflns_limit_k_max       15
_diffrn_reflns_limit_k_min       -2
_diffrn_reflns_limit_l_max       2
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            6539
_diffrn_reflns_theta_full        27.96
_diffrn_reflns_theta_max         27.96
_diffrn_reflns_theta_min         2.32
_diffrn_standards_decay_%        0
_diffrn_standards_interval_time  120
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    9.224
_exptl_absorpt_correction_T_max  0.3058
_exptl_absorpt_correction_T_min  0.0999
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '(Blessing, 1995)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    3.068
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             1436
_exptl_crystal_size_max          0.43
_exptl_crystal_size_mid          0.27
_exptl_crystal_size_min          0.15
_refine_diff_density_max         2.941
_refine_diff_density_min         -2.825
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.025
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     138
_refine_ls_number_reflns         4385
_refine_ls_number_restraints     17
_refine_ls_restrained_S_all      1.063
_refine_ls_R_factor_all          0.1631
_refine_ls_R_factor_gt           0.0691
_refine_ls_shift/su_max          0.003
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0813P)²+4.9537P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1544
_refine_ls_wR_factor_ref         0.1924
_reflns_number_gt                2083
_reflns_number_total             4385
_reflns_threshold_expression     I>2sigma(I)
_cod_data_source_file            rz5088.cif
_cod_data_source_block           I
_cod_original_cell_volume        1724.5(9)
_cod_database_code               2238916
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x+1/2, -y, z'
'x+1/2, -y, -z'
'-x, y, -z'
'-x, -y, -z'
'x-1/2, y, -z'
'-x-1/2, y, z'
'x, -y, z'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_disorder_group
W W1 0.37770(3) 0.0000 0.34550(7) 0.03479(18) Uani d S 1 2 .
W W2 0.2500 0.17748(8) 0.18441(8) 0.0497(2) Uani d S 1 2 .
Re Re1 0.2500 0.18032(13) 0.49071(13) 0.0505(3) Uani d SP 0.50 2 1
V V1 0.2500 0.18032(13) 0.49071(13) 0.0505(3) Uani d SP 0.50 2 2
O O1C 0.2500 0.0000 0.3367(12) 0.023(2) Uani d S 1 4 .
O O1E 0.2500 0.3071(16) 0.6049(16) 0.068(4) Uani d SD 1 2 .
O O2E 0.2500 0.3115(18) 0.0720(17) 0.081(5) Uani d S 1 2 .
O O3E 0.4740(6) 0.0000 0.3427(13) 0.050(3) Uani d S 1 2 .
O O1 0.2500 0.0000 0.0922(13) 0.048(4) Uani d S 1 4 .
O O2 0.3545(4) 0.1420(9) 0.2154(9) 0.0466(19) Uani d . 1 1 .
O O3 0.2500 0.2888(11) 0.3345(12) 0.042(3) Uani d S 1 2 .
O O4 0.3529(3) 0.1446(8) 0.4650(8) 0.0375(16) Uani d . 1 1 .
O O5 0.2500 0.0000 0.5902(15) 0.039(3) Uani d S 1 4 .
N N1 0.3903(7) 0.5000 0.6867(14) 0.057(4) Uani d SD 1 2 .
H H1A 0.3422 0.5000 0.6901 0.068 Uiso calc SRD 1 2 .
N N2 0.6091(7) 0.5000 0.6435(17) 0.057(4) Uani d SD 1 2 .
H H2A 0.6343 0.4198 0.649 0.069 Uiso calc RD 1 1 .
C C1 0.4219(6) 0.6284(14) 0.6845(14) 0.056(3) Uani d D 1 1 .
H H1 0.3939 0.7134 0.6938 0.067 Uiso calc R 1 1 .
C C2 0.4963(6) 0.6327(12) 0.6681(13) 0.043(3) Uani d . 1 1 .
H H2 0.5214 0.7216 0.6642 0.052 Uiso calc R 1 1 .
C C3 0.5363(7) 0.5000 0.6570(16) 0.038(3) Uani d SD 1 2 .
O O1W 0.2500 0.5000 0.8564(14) 0.063(6) Uani d SD 1 4 .
H H1W1 0.2500 0.4226 0.8198 0.095 Uiso calc SD 1 2 .
O O2W 0.3772(8) 0.0000 0.7518(15) 0.079(5) Uani d SD 1 2 .
H H1W2 0.410 0.0000 0.694 0.119 Uiso calc SD 1 2 .
H H2W2 0.332 0.0000 0.727 0.119 Uiso calc SD 1 2 .
O O3W 0.553(3) 0.5000 0.960(5) 0.27(3) Uiso d S 1 2 .
H H1W3 0.5644 0.5876 0.9741 0.402 Uiso calc D 1 1 .
O O4W 0.429(4) 0.0000 0.962(6) 0.34(3) Uiso d SD 1 2 .
H H1W4 0.386 0.0000 0.928 0.510 Uiso calc SD 1 2 .
H H2W4 0.466 0.0000 0.910 0.510 Uiso calc SD 1 2 .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
C C 0.0015 0.0009 '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 0.0030 0.0019 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0056 0.0036 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Re Re -0.4693 4.8944 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
V V 0.2276 0.3376 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
W W -0.4201 4.6430 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
loop_
_diffrn_standard_refln_index_h
_diffrn_standard_refln_index_k
_diffrn_standard_refln_index_l
-2 3 -8
-2 -3 -8
loop_
_geom_angle_atom_site_label_1
_geom_angle_atom_site_label_2
_geom_angle_atom_site_label_3
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
W1 O1C W1 . 2 175.3(6)
W1 O1C W2 . 2 91.6(2)
W1 O1C W2 2 2 91.6(2)
W1 O1C W2 . . 91.6(2)
W1 O1C W2 2 . 91.6(2)
W2 O1C W2 2 . 90.7(4)
W1 O1C Re1 . . 88.4(2)
W1 O1C Re1 2 . 88.4(2)
W2 O1C Re1 2 . 179.9(4)
W2 O1C Re1 . . 89.19(5)
W1 O1C V1 . 2 88.4(2)
W1 O1C V1 2 2 88.4(2)
W2 O1C V1 2 2 89.19(5)
W2 O1C V1 . 2 179.9(4)
Re1 O1C V1 . 2 90.9(4)
W1 O1C Re1 . 2 88.4(2)
W1 O1C Re1 2 2 88.4(2)
W2 O1C Re1 2 2 89.19(5)
W2 O1C Re1 . 2 179.9(4)
Re1 O1C Re1 . 2 90.9(4)
W2 O3 Re1 . . 116.1(5)
W1 O4 Re1 . . 116.6(4)
V1 O5 Re1 2 . 115.1(8)
Re1 O5 Re1 2 . 115.1(8)
W2 O2 W1 . . 116.2(4)
W2 O1 W2 . 2 118.2(7)
N2 C3 C2 . 8_565 120.6(6)
N2 C3 C2 . . 120.6(6)
C2 C3 C2 8_565 . 118.6(12)
C1 C2 C3 . . 119.0(11)
C1 C2 H2 . . 120.5
C3 C2 H2 . . 120.5
N1 C1 C2 . . 117.1(12)
N1 C1 H1 . . 121.4
C2 C1 H1 . . 121.4
C1 N1 C1 8_565 . 128.8(14)
C1 N1 H1A 8_565 . 115.6
C1 N1 H1A . . 115.6
O3E W1 O4 . . 104.2(4)
O3E W1 O4 . 8 104.2(4)
O4 W1 O4 . 8 89.5(5)
O3E W1 O2 . 8 101.6(4)
O4 W1 O2 . 8 154.0(3)
O4 W1 O2 8 8 87.3(4)
O3E W1 O2 . . 101.6(4)
O4 W1 O2 . . 87.3(4)
O4 W1 O2 8 . 154.0(3)
O2 W1 O2 8 . 84.4(5)
O3E W1 O1C . . 176.7(6)
O4 W1 O1C . . 78.1(3)
O4 W1 O1C 8 . 78.1(3)
O2 W1 O1C 8 . 76.0(3)
O2 W1 O1C . . 76.0(3)
O3E W1 Re1 . 2 136.0(3)
O4 W1 Re1 . 2 82.9(2)
O4 W1 Re1 8 2 31.75(19)
O2 W1 Re1 8 2 80.8(2)
O2 W1 Re1 . 2 122.3(2)
O1C W1 Re1 . 2 46.3(2)
O3E W1 Re1 . . 136.0(3)
O4 W1 Re1 . . 31.75(19)
O4 W1 Re1 8 . 82.9(2)
O2 W1 Re1 8 . 122.3(2)
O2 W1 Re1 . . 80.8(2)
O1C W1 Re1 . . 46.3(2)
Re1 W1 Re1 2 . 62.09(5)
O2E W2 O3 . . 101.2(8)
O2E W2 O1 . . 105.1(8)
O3 W2 O1 . . 153.7(5)
O2E W2 O2 . . 103.9(3)
O3 W2 O2 . . 87.1(3)
O1 W2 O2 . . 86.7(3)
O2E W2 O2 . 7_655 103.9(3)
O3 W2 O2 . 7_655 87.1(3)
O1 W2 O2 . 7_655 86.7(3)
O2 W2 O2 . 7_655 152.2(5)
O2E W2 O1C . . 179.4(7)
O3 W2 O1C . . 78.1(4)
O1 W2 O1C . . 75.6(4)
O2 W2 O1C . . 76.1(3)
O2 W2 O1C 7_655 . 76.1(3)
O2E W2 Re1 . . 133.6(7)
O3 W2 Re1 . . 32.3(3)
O1 W2 Re1 . . 121.4(4)
O2 W2 Re1 . . 80.3(3)
O2 W2 Re1 7_655 . 80.3(3)
O1C W2 Re1 . . 45.8(2)
O1E Re1 O4 . . 102.9(2)
O1E Re1 O4 . 7_655 102.9(2)
O4 Re1 O4 . 7_655 154.0(4)
O1E Re1 O3 . . 105.0(7)
O4 Re1 O3 . . 88.1(3)
O4 Re1 O3 7_655 . 88.1(3)
O1E Re1 O5 . . 101.5(7)
O4 Re1 O5 . . 86.0(3)
O4 Re1 O5 7_655 . 86.0(3)
O3 Re1 O5 . . 153.5(5)
O1E Re1 O1C . . 178.5(7)
O4 Re1 O1C . . 77.0(2)
O4 Re1 O1C 7_655 . 77.0(2)
O3 Re1 O1C . . 76.6(4)
O5 Re1 O1C . . 77.0(4)
O1E Re1 W1 . 2 134.60(4)
O4 Re1 W1 . 2 122.3(2)
O4 Re1 W1 7_655 2 31.7(2)
O3 Re1 W1 . 2 81.8(2)
O5 Re1 W1 . 2 79.7(3)
O1C Re1 W1 . 2 45.33(2)
O1E Re1 W1 . . 134.60(4)
O4 Re1 W1 . . 31.7(2)
O4 Re1 W1 7_655 . 122.3(2)
O3 Re1 W1 . . 81.8(2)
O5 Re1 W1 . . 79.7(3)
O1C Re1 W1 . . 45.33(2)
W1 Re1 W1 2 . 90.62(4)
O1E Re1 W2 . . 136.5(6)
O4 Re1 W2 . . 81.7(3)
O4 Re1 W2 7_655 . 81.7(3)
O3 Re1 W2 . . 31.5(3)
O5 Re1 W2 . . 122.0(4)
O1C Re1 W2 . . 45.0(2)
W1 Re1 W2 2 . 61.16(3)
W1 Re1 W2 . . 61.16(3)
C3 N2 H2A . . 121
H1W2 O2W H2W2 . . 116
H1W4 O4W H2W4 . . 116
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
O1C W1 . 2.2796(8)
O1C W1 2 2.2796(8)
O1C W2 2 2.286(9)
O1C W2 . 2.286(9)
O1C Re1 . 2.318(9)
O1C V1 2 2.318(9)
O1C Re1 2 2.318(9)
O3 W2 . 1.883(12)
O3 Re1 . 1.925(12)
O1E Re1 . 1.674(14)
O4 W1 . 1.882(7)
O4 Re1 . 1.885(6)
O5 V1 2 1.958(9)
O5 Re1 2 1.958(9)
O5 Re1 . 1.958(9)
O3E W1 . 1.718(10)
O2 W2 . 1.921(8)
O2 W1 . 1.936(9)
O1 W2 . 1.895(7)
O1 W2 2 1.895(7)
C3 N2 . 1.307(17)
C3 C2 8_565 1.414(12)
C3 C2 . 1.414(12)
C2 C1 . 1.339(15)
C2 H2 . 0.9300
C1 N1 . 1.305(13)
C1 H1 . 0.9300
N1 C1 8_565 1.305(13)
N1 H1A . 0.8600
O2E W2 . 1.707(12)
W1 O4 8 1.882(7)
W1 O2 8 1.936(9)
W1 Re1 2 3.2040(11)
W1 Re1 . 3.2040(11)
W2 O2 7_655 1.921(8)
W2 Re1 . 3.2322(18)
Re1 O4 7_655 1.885(6)
Re1 W1 2 3.2040(11)
N2 H2A . 0.8600
O1W H1W1 . 0.81
O2W H1W2 . 0.85
O2W H2W2 . 0.85
O3W H1W3 . 0.84
O4W H1W4 . 0.85
O4W H2W4 . 0.85
loop_
_geom_hbond_atom_site_label_D
_geom_hbond_atom_site_label_H
_geom_hbond_atom_site_label_A
_geom_hbond_site_symmetry_A
_geom_hbond_distance_DH
_geom_hbond_distance_HA
_geom_hbond_distance_DA
_geom_hbond_angle_DHA
N1 H1A O1W . 0.86 2.40 3.078(14) 136
N1 H1A O1E . 0.86 2.58 3.184(14) 129
N2 H2A O3 6_656 0.86 2.39 3.181(12) 152
O1W H1W1 O1E . 0.81 2.50 3.188(18) 144
O2W H1W2 O3E 5_656 0.85 2.10 2.836(18) 144
O4W H1W4 O2W . 0.85 1.87 2.40(7) 119
O4W H2W4 O4W 5_657 0.85 2.31 2.65(15) 106
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_site_symmetry_1
_geom_torsion_site_symmetry_4
_geom_torsion
N2 C3 C2 C1 . . -178.7(16)
C2 C3 C2 C1 8_565 . -2(3)
C3 C2 C1 N1 . . -1(2)
C2 C1 N1 C1 . 8_565 6(3)
Re1 O4 W1 O3E . . 178.3(5)
Re1 O4 W1 O4 . 8 -77.1(5)
Re1 O4 W1 O2 . 8 5.6(11)
Re1 O4 W1 O2 . . 77.0(5)
Re1 O4 W1 O1C . . 0.7(4)
Re1 O4 W1 Re1 . 2 -46.0(4)
W2 O2 W1 O3E . . 179.7(5)
W2 O2 W1 O4 . . -76.3(5)
W2 O2 W1 O4 . 8 6.9(12)
W2 O2 W1 O2 . 8 78.9(5)
W2 O2 W1 O1C . . 2.0(4)
W2 O2 W1 Re1 . 2 3.5(6)
W2 O2 W1 Re1 . . -45.1(4)
W2 O1C W1 O4 2 . 179.3(4)
W2 O1C W1 O4 . . 88.6(3)
Re1 O1C W1 O4 . . -0.5(3)
V1 O1C W1 O4 2 . -91.5(4)
Re1 O1C W1 O4 2 . -91.5(4)
W2 O1C W1 O4 2 8 -88.6(3)
W2 O1C W1 O4 . 8 -179.3(4)
Re1 O1C W1 O4 . 8 91.5(4)
V1 O1C W1 O4 2 8 0.5(3)
Re1 O1C W1 O4 2 8 0.5(3)
W2 O1C W1 O2 2 8 1.5(3)
W2 O1C W1 O2 . 8 -89.2(4)
Re1 O1C W1 O2 . 8 -178.3(4)
V1 O1C W1 O2 2 8 90.7(3)
Re1 O1C W1 O2 2 8 90.7(3)
W2 O1C W1 O2 2 . 89.2(4)
W2 O1C W1 O2 . . -1.5(3)
Re1 O1C W1 O2 . . -90.7(3)
V1 O1C W1 O2 2 . 178.3(4)
Re1 O1C W1 O2 2 . 178.3(4)
W2 O1C W1 Re1 2 2 -89.14(5)
W2 O1C W1 Re1 . 2 -179.9(4)
Re1 O1C W1 Re1 . 2 91.0(4)
V1 O1C W1 Re1 2 2 0.0
W2 O1C W1 Re1 2 . 179.9(4)
W2 O1C W1 Re1 . . 89.14(5)
V1 O1C W1 Re1 2 . -91.0(4)
Re1 O1C W1 Re1 2 . -91.0(4)
Re1 O3 W2 O2 . . -76.4(2)
Re1 O3 W2 O2 . 7_655 76.4(2)
W2 O1 W2 O2 2 . 76.5(3)
W2 O1 W2 O2 2 7_655 -76.5(3)
W1 O2 W2 O2E . . 177.3(8)
W1 O2 W2 O3 . . 76.5(6)
W1 O2 W2 O1 . . -78.0(6)
W1 O2 W2 O2 . 7_655 -1.5(16)
W1 O2 W2 O1C . . -2.0(4)
W1 O2 W2 Re1 . . 44.6(4)
W1 O1C W2 O2 . . 1.5(3)
W1 O1C W2 O2 2 . 178.2(4)
Re1 O1C W2 O2 . . 89.9(3)
W1 O1C W2 O2 . 7_655 -178.2(4)
W1 O1C W2 O2 2 7_655 -1.5(3)
Re1 O1C W2 O2 . 7_655 -89.9(3)
W1 O4 Re1 O1E . . 177.7(7)
W1 O4 Re1 O4 . 7_655 4.3(15)
W1 O4 Re1 O3 . . -77.4(5)
W1 O4 Re1 O5 . . 76.8(6)
W1 O4 Re1 O1C . . -0.7(4)
W1 O4 Re1 W1 . 2 1.6(6)
W1 O4 Re1 W2 . . -46.3(4)
W2 O3 Re1 O4 . . 77.1(2)
W2 O3 Re1 O4 . 7_655 -77.1(2)
W2 O3 Re1 W1 . 2 -45.92(4)
W2 O3 Re1 W1 . . 45.92(4)
V1 O5 Re1 O4 2 . -77.6(2)
Re1 O5 Re1 O4 2 . -77.6(2)
V1 O5 Re1 O4 2 7_655 77.6(2)
Re1 O5 Re1 O4 2 7_655 77.6(2)
V1 O5 Re1 W1 2 2 46.26(5)
Re1 O5 Re1 W1 2 2 46.26(5)
V1 O5 Re1 W1 2 . -46.26(5)
Re1 O5 Re1 W1 2 . -46.26(5)
W1 O1C Re1 O4 . . 0.5(3)
W1 O1C Re1 O4 2 . 177.2(4)
V1 O1C Re1 O4 2 . 88.9(3)
Re1 O1C Re1 O4 2 . 88.9(3)
W1 O1C Re1 O4 . 7_655 -177.2(4)
W1 O1C Re1 O4 2 7_655 -0.5(3)
V1 O1C Re1 O4 2 7_655 -88.9(3)
Re1 O1C Re1 O4 2 7_655 -88.9(3)
W1 O1C Re1 O5 . . -88.3(2)
W1 O1C Re1 O5 2 . 88.3(2)
W1 O1C Re1 W1 . 2 -176.7(4)
V1 O1C Re1 W1 2 2 -88.3(2)
Re1 O1C Re1 W1 2 2 -88.3(2)
W1 O1C Re1 W1 2 . 176.7(4)
V1 O1C Re1 W1 2 . 88.3(2)
Re1 O1C Re1 W1 2 . 88.3(2)
W1 O1C Re1 W2 . . 91.7(2)
W1 O1C Re1 W2 2 . -91.7(2)
O3E W1 Re1 O1E . . -5.6(10)
O4 W1 Re1 O1E . . -3.2(10)
O4 W1 Re1 O1E 8 . 97.6(9)
O2 W1 Re1 O1E . . -102.8(9)
O1C W1 Re1 O1E . . 177.8(9)
Re1 W1 Re1 O1E 2 . 122.9(9)
O3E W1 Re1 O4 . . -2.4(7)
O4 W1 Re1 O4 8 . 100.7(7)
O2 W1 Re1 O4 8 . -177.1(6)
O2 W1 Re1 O4 . . -99.7(6)
O1C W1 Re1 O4 . . -179.0(6)
Re1 W1 Re1 O4 2 . 126.1(5)
O3E W1 Re1 O4 . 7_655 179.8(6)
O4 W1 Re1 O4 . 7_655 -177.8(8)
O4 W1 Re1 O4 8 7_655 -77.05(19)
O2 W1 Re1 O4 8 7_655 5.1(4)
O2 W1 Re1 O4 . 7_655 82.5(4)
O1C W1 Re1 O4 . 7_655 3.2(4)
Re1 W1 Re1 O4 2 7_655 -51.7(3)
O3E W1 Re1 O3 . . 97.4(5)
O4 W1 Re1 O3 . . 99.8(5)
O4 W1 Re1 O3 8 . -159.5(3)
O2 W1 Re1 O3 8 . -77.3(4)
O2 W1 Re1 O3 . . 0.1(3)
O1C W1 Re1 O3 . . -79.2(4)
Re1 W1 Re1 O3 2 . -134.1(2)
O3E W1 Re1 O5 . . -101.6(6)
O4 W1 Re1 O5 . . -99.2(6)
O4 W1 Re1 O5 8 . 1.5(4)
O2 W1 Re1 O5 8 . 83.7(4)
O2 W1 Re1 O5 . . 161.1(4)
O1C W1 Re1 O5 . . 81.8(4)
Re1 W1 Re1 O5 2 . 26.9(3)
O3E W1 Re1 O1C . . 176.6(6)
O4 W1 Re1 O1C . . 179.0(6)
O4 W1 Re1 O1C 8 . -80.3(4)
O2 W1 Re1 O1C 8 . 1.9(4)
O2 W1 Re1 O1C . . 79.3(4)
Re1 W1 Re1 O1C 2 . -54.9(3)
O3E W1 Re1 W1 . 2 179.0(5)
O4 W1 Re1 W1 . 2 -178.6(5)
O4 W1 Re1 W1 8 2 -77.9(2)
O2 W1 Re1 W1 8 2 4.3(3)
O2 W1 Re1 W1 . 2 81.7(3)
O1C W1 Re1 W1 . 2 2.4(3)
Re1 W1 Re1 W1 2 2 -52.53(4)
O3E W1 Re1 W2 . . 122.8(5)
O4 W1 Re1 W2 . . 125.2(5)
O4 W1 Re1 W2 8 . -134.1(2)
O2 W1 Re1 W2 8 . -51.9(3)
O2 W1 Re1 W2 . . 25.5(3)
O1C W1 Re1 W2 . . -53.8(3)
Re1 W1 Re1 W2 2 . -108.71(2)
O2 W2 Re1 O1E . . 100.0(3)
O2 W2 Re1 O1E 7_655 . -100.0(3)
O2E W2 Re1 O4 . . -100.0(2)
O3 W2 Re1 O4 . . -100.0(2)
O1 W2 Re1 O4 . . 80.0(2)
O2 W2 Re1 O4 . . -0.1(3)
O2 W2 Re1 O4 7_655 . 160.0(3)
O1C W2 Re1 O4 . . 80.0(2)
O2E W2 Re1 O4 . 7_655 100.0(2)
O3 W2 Re1 O4 . 7_655 100.0(2)
O1 W2 Re1 O4 . 7_655 -80.0(2)
O2 W2 Re1 O4 . 7_655 -160.0(3)
O2 W2 Re1 O4 7_655 7_655 0.1(3)
O1C W2 Re1 O4 . 7_655 -80.0(2)
O2E W2 Re1 O3 . . 0.000(2)
O1 W2 Re1 O3 . . 180.000(2)
O2 W2 Re1 O3 . . 100.0(3)
O2 W2 Re1 O3 7_655 . -100.0(3)
O1C W2 Re1 O3 . . 180.000(2)
O2E W2 Re1 O5 . . 180.0000(10)
O3 W2 Re1 O5 . . 180.0000(10)
O1 W2 Re1 O5 . . 0.0000(10)
O2 W2 Re1 O5 . . -80.0(3)
O2 W2 Re1 O5 7_655 . 80.0(3)
O1C W2 Re1 O5 . . 0.0000(10)
O2E W2 Re1 O1C . . 180.0
O3 W2 Re1 O1C . . 180.0
O1 W2 Re1 O1C . . 0.0
O2 W2 Re1 O1C . . -80.0(3)
O2 W2 Re1 O1C 7_655 . 80.0(3)
O2E W2 Re1 W1 . 2 125.752(18)
O3 W2 Re1 W1 . 2 125.752(18)
O1 W2 Re1 W1 . 2 -54.248(18)
O2 W2 Re1 W1 . 2 -134.3(3)
O2 W2 Re1 W1 7_655 2 25.8(3)
O1C W2 Re1 W1 . 2 -54.248(18)
O2E W2 Re1 W1 . . -125.752(18)
O3 W2 Re1 W1 . . -125.752(18)
O1 W2 Re1 W1 . . 54.248(18)
O2 W2 Re1 W1 . . -25.8(3)
O2 W2 Re1 W1 7_655 . 134.3(3)
O1C W2 Re1 W1 . . 54.248(18)
