#------------------------------------------------------------------------------
#$Date: 2019-11-23 10:18:28 +0200 (Sat, 23 Nov 2019) $
#$Revision: 232841 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/34/82/4348241.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_4348241
loop_
_publ_author_name
'Pan, Yin-Yin'
'Yang, Yan'
'Long, La-Sheng'
'Huang, Rong-Bin'
'Zheng, Lan-Sun'
_publ_section_title
;
 One-dimensional GdIII--MII (M = Mn, Co) acetate chains exhibiting a large
 cryogenic magnetocaloric effect at ΔH = 3 T
;
_journal_issue                   8
_journal_name_full               'Inorg. Chem. Front.'
_journal_page_first              649
_journal_paper_doi               10.1039/C4QI00078A
_journal_volume                  1
_journal_year                    2014
_chemical_formula_sum            'C8 H22 Co0.5 Gd N0 O13'
_chemical_formula_weight         512.97
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_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                111.699(6)
_cell_angle_beta                 108.094(5)
_cell_angle_gamma                92.947(5)
_cell_formula_units_Z            2
_cell_length_a                   8.1656(5)
_cell_length_b                   10.2359(7)
_cell_length_c                   11.3405(6)
_cell_measurement_reflns_used    4464
_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      28.5080
_cell_measurement_theta_min      3.2820
_cell_volume                     822.18(10)
_computing_cell_refinement       'CrysAlis CCD, Oxford Diffraction Ltd.'
_computing_data_collection       'CrysAlis CCD, Oxford Diffraction Ltd.'
_computing_data_reduction        'CrysAlis CCD, Oxford Diffraction Ltd.'
_computing_molecular_graphics    'SHELXL-97 (Sheldrick, 1997)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      173(2)
_diffrn_detector_area_resol_mean 16.1903
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Xcalibur, Sapphire3, Gemini ultra'
_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  0.0245
_diffrn_reflns_av_sigmaI/netI    0.0346
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       -13
_diffrn_reflns_number            5394
_diffrn_reflns_theta_full        25.99
_diffrn_reflns_theta_max         25.99
_diffrn_reflns_theta_min         3.12
_exptl_absorpt_coefficient_mu    4.581
_exptl_absorpt_correction_T_max  0.6573
_exptl_absorpt_correction_T_min  0.4610
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            pink
_exptl_crystal_density_diffrn    2.072
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       cubic
_exptl_crystal_F_000             503
_exptl_crystal_size_max          0.20
_exptl_crystal_size_mid          0.10
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.697
_refine_diff_density_min         -0.817
_refine_diff_density_rms         0.117
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.030
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     220
_refine_ls_number_reflns         3218
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.030
_refine_ls_R_factor_all          0.0213
_refine_ls_R_factor_gt           0.0203
_refine_ls_shift/su_max          0.023
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0257P)²+0.5179P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0516
_refine_ls_wR_factor_ref         0.0521
_reflns_number_gt                3096
_reflns_number_total             3218
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4qi00078a2.cif
_cod_data_source_block           complex2
_cod_original_cell_volume        822.17(8)
_cod_original_sg_symbol_H-M      P-1
_cod_original_formula_sum        'C8 H22 Co0.50 Gd N0 O13'
_cod_database_code               4348241
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
Gd1 Gd 0.913170(17) 0.581643(14) 0.168524(12) 0.00961(6) Uani 1 1 d .
Co1 Co 1.0000 0.5000 0.5000 0.00975(12) Uani 1 2 d S
O10 O 0.7157(3) 0.6070(2) -0.0296(2) 0.0171(5) Uani 1 1 d .
H10A H 0.7686 0.6023 -0.0845 0.026 Uiso 1 1 d R
H10B H 0.6840 0.6876 -0.0045 0.026 Uiso 1 1 d R
O4 O 0.8580(3) 0.2736(2) 0.6314(2) 0.0206(5) Uani 1 1 d .
O9 O 0.8817(3) 0.8303(3) 0.2437(3) 0.0283(6) Uani 1 1 d .
H9A H 0.8825 0.8604 0.3246 0.042 Uiso 1 1 d R
H9B H 0.7849 0.8372 0.1919 0.042 Uiso 1 1 d R
O8 O 1.1052(3) 0.6335(2) 0.0692(2) 0.0167(5) Uani 1 1 d .
O12 O 0.6989(3) 0.9440(3) 0.0792(3) 0.0339(6) Uani 1 1 d G
H12A H 0.6658 1.0238 0.1067 0.051 Uiso 1 1 d G
H12B H 0.6198 0.8856 0.0062 0.051 Uiso 1 1 d G
O1 O 0.6149(3) 0.5829(2) 0.1947(2) 0.0173(5) Uani 1 1 d .
O7 O 1.2694(3) 0.6579(2) -0.0433(2) 0.0183(5) Uani 1 1 d .
O11 O 0.6031(3) 0.2083(3) 0.1726(2) 0.0222(5) Uani 1 1 d G
H11A H 0.6679 0.2430 0.2561 0.033 Uiso 1 1 d G
H11B H 0.6501 0.2412 0.1297 0.033 Uiso 1 1 d G
O5 O 1.0648(3) 0.3359(2) 0.3571(2) 0.0162(5) Uani 1 1 d .
O2 O 0.8320(3) 0.5513(2) 0.3463(2) 0.0139(4) Uani 1 1 d .
O6 O 1.1047(3) 0.4232(2) 0.2119(2) 0.0166(5) Uani 1 1 d .
O3 O 0.7924(3) 0.3378(2) 0.4563(2) 0.0157(4) Uani 1 1 d .
C3 C 0.6209(5) 0.1281(4) 0.4326(3) 0.0268(8) Uani 1 1 d .
H3A H 0.6603 0.0507 0.3723 0.040 Uiso 1 1 calc R
H3B H 0.5195 0.1538 0.3783 0.040 Uiso 1 1 calc R
H3C H 0.5877 0.0960 0.4948 0.040 Uiso 1 1 calc R
O13 O 0.0989(4) 0.0981(3) 0.4366(3) 0.0334(6) Uani 1 1 d G
H13A H 0.0326 0.0217 0.3728 0.050 Uiso 1 1 d G
H13B H 0.0746 0.1692 0.4174 0.050 Uiso 1 1 d G
C8 C 1.2274(4) 0.7066(3) 0.0603(3) 0.0146(6) Uani 1 1 d .
C4 C 0.7684(4) 0.2575(3) 0.5137(3) 0.0137(6) Uani 1 1 d .
C1 C 0.5560(4) 0.5627(4) 0.3821(3) 0.0242(8) Uani 1 1 d .
H1A H 0.5318 0.4659 0.3776 0.036 Uiso 1 1 calc R
H1B H 0.4454 0.5902 0.3431 0.036 Uiso 1 1 calc R
H1C H 0.6145 0.6301 0.4770 0.036 Uiso 1 1 calc R
C6 C 1.0984(4) 0.3243(3) 0.2532(3) 0.0142(6) Uani 1 1 d .
C2 C 0.6721(4) 0.5657(3) 0.3036(3) 0.0137(6) Uani 1 1 d .
C7 C 1.3258(5) 0.8455(4) 0.1734(4) 0.0285(8) Uani 1 1 d .
H7A H 1.4421 0.8334 0.2224 0.043 Uiso 1 1 calc R
H7B H 1.2615 0.8780 0.2357 0.043 Uiso 1 1 calc R
H7C H 1.3389 0.9168 0.1368 0.043 Uiso 1 1 calc R
C5 C 1.1365(6) 0.1832(4) 0.1740(4) 0.0368(10) Uani 1 1 d .
H5A H 1.2597 0.1795 0.2162 0.055 Uiso 1 1 calc R
H5B H 1.1139 0.1724 0.0805 0.055 Uiso 1 1 calc R
H5C H 1.0608 0.1054 0.1736 0.055 Uiso 1 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'
Gd Gd -0.1653 3.9035 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Co Co 0.3494 0.9721 '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
O4 Gd1 O8 82.49(7) 2_766 .
O4 Gd1 O6 75.68(8) 2_766 .
O8 Gd1 O6 83.17(7) . .
O4 Gd1 O9 68.32(8) 2_766 .
O8 Gd1 O9 88.21(8) . .
O6 Gd1 O9 143.77(8) . .
O4 Gd1 O2 75.56(7) 2_766 .
O8 Gd1 O2 155.90(7) . .
O6 Gd1 O2 81.89(7) . .
O9 Gd1 O2 92.76(8) . .
O4 Gd1 O10 137.30(7) 2_766 .
O8 Gd1 O10 77.41(7) . .
O6 Gd1 O10 137.11(7) . .
O9 Gd1 O10 73.73(8) . .
O2 Gd1 O10 125.91(7) . .
O4 Gd1 O7 143.49(8) 2_766 2_765
O8 Gd1 O7 114.52(7) . 2_765
O6 Gd1 O7 74.79(8) . 2_765
O9 Gd1 O7 139.63(8) . 2_765
O2 Gd1 O7 79.45(7) . 2_765
O10 Gd1 O7 79.16(7) . 2_765
O4 Gd1 O1 112.88(8) 2_766 .
O8 Gd1 O1 149.66(7) . .
O6 Gd1 O1 125.06(7) . .
O9 Gd1 O1 74.81(8) . .
O2 Gd1 O1 52.18(7) . .
O10 Gd1 O1 73.81(7) . .
O7 Gd1 O1 69.19(7) 2_765 .
O4 Gd1 O8 134.25(8) 2_766 2_765
O8 Gd1 O8 65.12(8) . 2_765
O6 Gd1 O8 69.42(7) . 2_765
O9 Gd1 O8 136.71(8) . 2_765
O2 Gd1 O8 125.64(7) . 2_765
O10 Gd1 O8 67.74(7) . 2_765
O7 Gd1 O8 49.41(6) 2_765 2_765
O1 Gd1 O8 111.16(7) . 2_765
O4 Gd1 C2 94.14(8) 2_766 .
O8 Gd1 C2 170.76(8) . .
O6 Gd1 C2 104.40(8) . .
O9 Gd1 C2 82.55(9) . .
O2 Gd1 C2 26.23(8) . .
O10 Gd1 C2 99.76(8) . .
O7 Gd1 C2 73.12(8) 2_765 .
O1 Gd1 C2 25.96(8) . .
O8 Gd1 C2 122.23(7) 2_765 .
O4 Gd1 C8 146.88(8) 2_766 2_765
O8 Gd1 C8 90.26(8) . 2_765
O6 Gd1 C8 71.38(8) . 2_765
O9 Gd1 C8 144.02(8) . 2_765
O2 Gd1 C8 102.68(7) . 2_765
O10 Gd1 C8 70.87(8) . 2_765
O7 Gd1 C8 24.30(7) 2_765 2_765
O1 Gd1 C8 89.26(8) . 2_765
O8 Gd1 C8 25.15(7) 2_765 2_765
C2 Gd1 C8 97.15(8) . 2_765
O5 Co1 O5 180.000(1) . 2_766
O5 Co1 O3 96.80(8) . 2_766
O5 Co1 O3 83.20(8) 2_766 2_766
O5 Co1 O3 83.20(8) . .
O5 Co1 O3 96.80(8) 2_766 .
O3 Co1 O3 180.0 2_766 .
O5 Co1 O2 88.85(8) . 2_766
O5 Co1 O2 91.15(8) 2_766 2_766
O3 Co1 O2 88.14(8) 2_766 2_766
O3 Co1 O2 91.86(8) . 2_766
O5 Co1 O2 91.15(8) . .
O5 Co1 O2 88.85(8) 2_766 .
O3 Co1 O2 91.86(8) 2_766 .
O3 Co1 O2 88.14(8) . .
O2 Co1 O2 180.0 2_766 .
C4 O4 Gd1 145.8(2) . 2_766
C8 O8 Gd1 156.5(2) . .
C8 O8 Gd1 88.53(17) . 2_765
Gd1 O8 Gd1 114.88(8) . 2_765
C2 O1 Gd1 91.94(17) . .
C8 O7 Gd1 102.48(18) . 2_765
C6 O5 Co1 133.7(2) . .
C2 O2 Co1 138.77(18) . .
C2 O2 Gd1 97.01(17) . .
Co1 O2 Gd1 124.01(9) . .
C6 O6 Gd1 134.32(19) . .
C4 O3 Co1 133.9(2) . .
O7 C8 O8 119.4(3) . .
O7 C8 C7 120.0(3) . .
O8 C8 C7 120.6(3) . .
O7 C8 Gd1 53.21(15) . 2_765
O8 C8 Gd1 66.32(16) . 2_765
C7 C8 Gd1 170.7(2) . 2_765
O4 C4 O3 125.7(3) . .
O4 C4 C3 116.6(3) . .
O3 C4 C3 117.7(3) . .
O5 C6 O6 124.9(3) . .
O5 C6 C5 117.1(3) . .
O6 C6 C5 118.0(3) . .
O1 C2 O2 118.8(3) . .
O1 C2 C1 120.7(3) . .
O2 C2 C1 120.5(3) . .
O1 C2 Gd1 62.10(15) . .
O2 C2 Gd1 56.76(14) . .
C1 C2 Gd1 176.4(2) . .
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Gd1 O4 2.330(2) 2_766
Gd1 O8 2.337(2) .
Gd1 O6 2.385(2) .
Gd1 O9 2.422(2) .
Gd1 O2 2.424(2) .
Gd1 O10 2.437(2) .
Gd1 O7 2.446(2) 2_765
Gd1 O1 2.544(2) .
Gd1 O8 2.732(2) 2_765
Gd1 C2 2.877(3) .
Gd1 C8 2.982(3) 2_765
Co1 O5 2.083(2) .
Co1 O5 2.083(2) 2_766
Co1 O3 2.111(2) 2_766
Co1 O3 2.111(2) .
Co1 O2 2.112(2) 2_766
Co1 O2 2.112(2) .
O4 C4 1.251(4) .
O4 Gd1 2.330(2) 2_766
O8 C8 1.268(3) .
O8 Gd1 2.732(2) 2_765
O1 C2 1.260(4) .
O7 C8 1.257(4) .
O7 Gd1 2.446(2) 2_765
O5 C6 1.256(4) .
O2 C2 1.281(4) .
O6 C6 1.269(4) .
O3 C4 1.264(4) .
C3 C4 1.516(4) .
C8 C7 1.486(4) .
C8 Gd1 2.982(3) 2_765
C1 C2 1.494(4) .
C6 C5 1.500(5) .
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 H10A O6 0.85 1.98 2.824(3) 175.5 2_765
O11 H11B O7 0.85 1.88 2.720(3) 169.2 2_765
O10 H10B O12 0.85 2.42 3.232(4) 160.0 .
O9 H9B O12 0.85 1.97 2.668(4) 138.8 .
O12 H12A O11 0.85 1.92 2.768(4) 177.2 1_565
O12 H12B O11 0.85 2.11 2.933(3) 164.4 2_665
O11 H11A O3 0.85 1.99 2.836(3) 172.0 .
O13 H13A O9 0.85 2.00 2.846(4) 171.4 1_445
O13 H13B O5 0.85 2.06 2.890(3) 166.8 1_455
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_4
O4 Gd1 O8 C8 -28.6(5) 2_766 .
O6 Gd1 O8 C8 -105.0(5) . .
O9 Gd1 O8 C8 39.7(5) . .
O2 Gd1 O8 C8 -53.0(6) . .
O10 Gd1 O8 C8 113.4(5) . .
O7 Gd1 O8 C8 -174.8(5) 2_765 .
O1 Gd1 O8 C8 94.8(5) . .
O8 Gd1 O8 C8 -175.5(6) 2_765 .
C2 Gd1 O8 C8 40.4(8) . .
C8 Gd1 O8 C8 -176.2(5) 2_765 .
O4 Gd1 O8 Gd1 146.82(10) 2_766 2_765
O6 Gd1 O8 Gd1 70.44(9) . 2_765
O9 Gd1 O8 Gd1 -144.81(10) . 2_765
O2 Gd1 O8 Gd1 122.43(16) . 2_765
O10 Gd1 O8 Gd1 -71.08(9) . 2_765
O7 Gd1 O8 Gd1 0.63(12) 2_765 2_765
O1 Gd1 O8 Gd1 -89.73(16) . 2_765
O8 Gd1 O8 Gd1 0.0 2_765 2_765
C2 Gd1 O8 Gd1 -144.1(4) . 2_765
C8 Gd1 O8 Gd1 -0.77(10) 2_765 2_765
O4 Gd1 O1 C2 -46.53(19) 2_766 .
O8 Gd1 O1 C2 -162.65(17) . .
O6 Gd1 O1 C2 41.6(2) . .
O9 Gd1 O1 C2 -104.52(18) . .
O2 Gd1 O1 C2 1.38(16) . .
O10 Gd1 O1 C2 178.39(19) . .
O7 Gd1 O1 C2 94.08(18) 2_765 .
O8 Gd1 O1 C2 120.76(17) 2_765 .
C8 Gd1 O1 C2 108.12(18) 2_765 .
O5 Co1 O5 C6 -8(100) 2_766 .
O3 Co1 O5 C6 -50.5(3) 2_766 .
O3 Co1 O5 C6 129.5(3) . .
O2 Co1 O5 C6 -138.4(3) 2_766 .
O2 Co1 O5 C6 41.6(3) . .
O5 Co1 O2 C2 125.5(3) . .
O5 Co1 O2 C2 -54.5(3) 2_766 .
O3 Co1 O2 C2 -137.7(3) 2_766 .
O3 Co1 O2 C2 42.3(3) . .
O2 Co1 O2 C2 -58(100) 2_766 .
O5 Co1 O2 Gd1 -48.01(12) . .
O5 Co1 O2 Gd1 131.99(12) 2_766 .
O3 Co1 O2 Gd1 48.84(12) 2_766 .
O3 Co1 O2 Gd1 -131.16(12) . .
O2 Co1 O2 Gd1 128(100) 2_766 .
O4 Gd1 O2 C2 133.72(18) 2_766 .
O8 Gd1 O2 C2 158.73(19) . .
O6 Gd1 O2 C2 -149.07(18) . .
O9 Gd1 O2 C2 66.94(18) . .
O10 Gd1 O2 C2 -4.9(2) . .
O7 Gd1 O2 C2 -73.14(17) 2_765 .
O1 Gd1 O2 C2 -1.37(16) . .
O8 Gd1 O2 C2 -91.70(18) 2_765 .
C8 Gd1 O2 C2 -80.33(18) 2_765 .
O4 Gd1 O2 Co1 -50.62(11) 2_766 .
O8 Gd1 O2 Co1 -25.6(3) . .
O6 Gd1 O2 Co1 26.59(11) . .
O9 Gd1 O2 Co1 -117.40(12) . .
O10 Gd1 O2 Co1 170.74(9) . .
O7 Gd1 O2 Co1 102.53(12) 2_765 .
O1 Gd1 O2 Co1 174.29(16) . .
O8 Gd1 O2 Co1 83.97(12) 2_765 .
C2 Gd1 O2 Co1 175.7(2) . .
C8 Gd1 O2 Co1 95.33(12) 2_765 .
O4 Gd1 O6 C6 106.6(3) 2_766 .
O8 Gd1 O6 C6 -169.4(3) . .
O9 Gd1 O6 C6 113.1(3) . .
O2 Gd1 O6 C6 29.6(3) . .
O10 Gd1 O6 C6 -106.3(3) . .
O7 Gd1 O6 C6 -51.6(3) 2_765 .
O1 Gd1 O6 C6 -1.5(3) . .
O8 Gd1 O6 C6 -103.5(3) 2_765 .
C2 Gd1 O6 C6 16.0(3) . .
C8 Gd1 O6 C6 -76.8(3) 2_765 .
O5 Co1 O3 C4 98.6(3) . .
O5 Co1 O3 C4 -81.4(3) 2_766 .
O3 Co1 O3 C4 -161(100) 2_766 .
O2 Co1 O3 C4 10.0(3) 2_766 .
O2 Co1 O3 C4 -170.0(3) . .
Gd1 O7 C8 O8 -5.0(3) 2_765 .
Gd1 O7 C8 C7 172.3(3) 2_765 .
Gd1 O8 C8 O7 -179.8(3) . .
Gd1 O8 C8 O7 4.3(3) 2_765 .
Gd1 O8 C8 C7 3.0(7) . .
Gd1 O8 C8 C7 -172.9(3) 2_765 .
Gd1 O8 C8 Gd1 175.9(5) . 2_765
Gd1 O4 C4 O3 3.9(6) 2_766 .
Gd1 O4 C4 C3 -177.5(3) 2_766 .
Co1 O3 C4 O4 13.8(5) . .
Co1 O3 C4 C3 -164.8(2) . .
Co1 O5 C6 O6 2.2(5) . .
Co1 O5 C6 C5 -178.8(3) . .
Gd1 O6 C6 O5 -50.5(4) . .
Gd1 O6 C6 C5 130.6(3) . .
Gd1 O1 C2 O2 -2.4(3) . .
Gd1 O1 C2 C1 177.4(3) . .
Co1 O2 C2 O1 -172.0(2) . .
Gd1 O2 C2 O1 2.5(3) . .
Co1 O2 C2 C1 8.2(5) . .
Gd1 O2 C2 C1 -177.2(3) . .
Co1 O2 C2 Gd1 -174.5(3) . .
O4 Gd1 C2 O1 137.90(18) 2_766 .
O8 Gd1 C2 O1 69.7(5) . .
O6 Gd1 C2 O1 -145.84(17) . .
O9 Gd1 C2 O1 70.42(18) . .
O2 Gd1 C2 O1 -177.5(3) . .
O10 Gd1 C2 O1 -1.57(18) . .
O7 Gd1 C2 O1 -77.00(18) 2_765 .
O8 Gd1 C2 O1 -71.33(19) 2_765 .
C8 Gd1 C2 O1 -73.29(18) 2_765 .
O4 Gd1 C2 O2 -44.57(17) 2_766 .
O8 Gd1 C2 O2 -112.8(5) . .
O6 Gd1 C2 O2 31.69(18) . .
O9 Gd1 C2 O2 -112.05(18) . .
O10 Gd1 C2 O2 175.96(17) . .
O7 Gd1 C2 O2 100.53(18) 2_765 .
O1 Gd1 C2 O2 177.5(3) . .
O8 Gd1 C2 O2 106.20(17) 2_765 .
C8 Gd1 C2 O2 104.23(17) 2_765 .
O4 Gd1 C2 C1 -3(4) 2_766 .
O8 Gd1 C2 C1 -71(4) . .
O6 Gd1 C2 C1 73(4) . .
O9 Gd1 C2 C1 -71(4) . .
O2 Gd1 C2 C1 42(4) . .
O10 Gd1 C2 C1 -143(4) . .
O7 Gd1 C2 C1 142(4) 2_765 .
O1 Gd1 C2 C1 -141(4) . .
O8 Gd1 C2 C1 148(4) 2_765 .
C8 Gd1 C2 C1 146(4) 2_765 .
