#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:06:12 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179093 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/55/4305528.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_4305528
loop_
_publ_author_name
'Yi Liu'
'Ling Chen'
'Long-Hua Li'
'Li-Ming Wu'
'Oksana Ya. Zelinska'
'Arthur Mar'
_publ_contact_author_address
; Department of Chemistry
  University of Alberta
  Edmonton, AB
  Canada  T6G 2G2
;
_publ_contact_author_email       arthur.mar@ualberta.ca
_publ_contact_author_fax         '(780) 492-8231'
_publ_contact_author_name        'Dr. Arthur Mar'
_publ_contact_author_phone       '(780) 492-5592'
_publ_section_title
;
Structures and Physical Properties of Rare-Earth Zinc Antimonides
Pr6Zn1+xSb14+yandRE6Zn1+xSb14 (RE= Sm, Gd-Ho)
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              11930
_journal_page_last               11941
_journal_paper_doi               10.1021/ic800524d
_journal_volume                  47
_journal_year                    2008
_chemical_formula_sum            'Gd12 Sb28 Zn3.42'
_chemical_formula_weight         5519.57
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           71
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-I 2 2'
_symmetry_space_group_name_H-M   'I m m m'
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           'by CrystalClear-SM 1.3.6 SP3 rc4'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            1
_cell_length_a                   4.1543(12)
_cell_length_b                   15.025(5)
_cell_length_c                   18.757(6)
_cell_measurement_reflns_used    1740
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.4410
_cell_measurement_theta_min      2.7111
_cell_volume                     1170.8(6)
_computing_cell_refinement       'CrystalClear (Rigaku/MSC Inc., 2005)'
_computing_data_collection       'CrystalClear (Rigaku/MSC Inc., 2005)'
_computing_data_reduction        'CrystalClear (Rigaku/MSC Inc., 2005)'
_computing_molecular_graphics    'Bruker SHELXTL'
_computing_publication_material  'Bruker SHELXTL'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 0.995
_diffrn_measured_fraction_theta_max 0.995
_diffrn_measurement_device_type  'Bruker P4'
_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  0.0290
_diffrn_reflns_av_sigmaI/netI    0.0195
_diffrn_reflns_limit_h_max       5
_diffrn_reflns_limit_h_min       -5
_diffrn_reflns_limit_k_max       19
_diffrn_reflns_limit_k_min       -19
_diffrn_reflns_limit_l_max       24
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            4654
_diffrn_reflns_theta_full        27.44
_diffrn_reflns_theta_max         27.44
_diffrn_reflns_theta_min         2.17
_exptl_absorpt_coefficient_mu    34.250
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.6443
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            grey
_exptl_crystal_density_diffrn    7.828
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Prism
_exptl_crystal_F_000             2299
_exptl_crystal_size_max          0.0800
_exptl_crystal_size_mid          0.0400
_exptl_crystal_size_min          0.0300
_refine_diff_density_max         3.211
_refine_diff_density_min         -1.976
_refine_diff_density_rms         0.286
_refine_ls_extinction_coef       0.00029(2)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.192
_refine_ls_matrix_type           full
_refine_ls_number_parameters     43
_refine_ls_number_reflns         820
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.192
_refine_ls_R_factor_all          0.0241
_refine_ls_R_factor_gt           0.0198
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0135P)²+34.5709P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0408
_refine_ls_wR_factor_ref         0.0493
_reflns_number_gt                748
_reflns_number_total             820
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic800524d_si_001_2.cif
_cod_data_source_block           Gd
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'Orthorhombic' changed to 'orthorhombic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from
2010-06-29.

'_exptl_absorpt_correction_type' value 'Multi-scan' changed
to 'multi-scan' 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_database_code               4305528
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, z'
'-x, y, -z'
'x, -y, -z'
'x+1/2, y+1/2, z+1/2'
'-x+1/2, -y+1/2, z+1/2'
'-x+1/2, y+1/2, -z+1/2'
'x+1/2, -y+1/2, -z+1/2'
'-x, -y, -z'
'x, y, -z'
'x, -y, z'
'-x, y, z'
'-x+1/2, -y+1/2, -z+1/2'
'x+1/2, y+1/2, -z+1/2'
'x+1/2, -y+1/2, z+1/2'
'-x+1/2, 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_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
Gd1 Gd 0.0000 0.0000 0.32243(4) 0.00925(17) Uani 1 4 d S . .
Gd2 Gd 0.0000 0.13831(3) 0.13640(2) 0.00772(14) Uani 1 2 d S . .
Zn1 Zn 0.0000 0.26247(13) 0.0000 0.0154(7) Uani 0.854(8) 4 d SP . .
Sb1 Sb 0.0000 0.0000 0.0000 0.0284(4) Uani 1 8 d S . .
Sb2 Sb 0.5000 0.5000 0.0000 0.0242(4) Uani 1 8 d S . .
Sb3 Sb 0.0000 0.37020(5) 0.10234(4) 0.01776(18) Uani 1 2 d S . .
Sb4 Sb 0.0000 0.21128(4) 0.30266(3) 0.00895(16) Uani 1 2 d S . .
Sb5 Sb 0.0000 0.34965(6) 0.5000 0.0104(2) Uani 1 4 d S . .
Sb6 Sb 0.5000 0.0000 0.19713(4) 0.00755(19) Uani 1 4 d S . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Zn Zn 0.2839 1.4301 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sb Sb -0.5866 1.5461 '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'
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
Sb6 Gd1 Sb6 82.94(4) 1_455 . ?
Sb6 Gd1 Sb3 139.923(19) 1_455 13 ?
Sb6 Gd1 Sb3 84.25(2) . 13 ?
Sb6 Gd1 Sb3 84.25(2) 1_455 13_455 ?
Sb6 Gd1 Sb3 139.923(19) . 13_455 ?
Sb3 Gd1 Sb3 81.58(3) 13 13_455 ?
Sb6 Gd1 Sb3 84.25(2) 1_455 14_445 ?
Sb6 Gd1 Sb3 139.923(19) . 14_445 ?
Sb3 Gd1 Sb3 127.31(4) 13 14_445 ?
Sb3 Gd1 Sb3 75.67(3) 13_455 14_445 ?
Sb6 Gd1 Sb3 139.923(19) 1_455 14_545 ?
Sb6 Gd1 Sb3 84.25(2) . 14_545 ?
Sb3 Gd1 Sb3 75.67(3) 13 14_545 ?
Sb3 Gd1 Sb3 127.31(4) 13_455 14_545 ?
Sb3 Gd1 Sb3 81.58(3) 14_445 14_545 ?
Sb6 Gd1 Sb4 85.012(13) 1_455 . ?
Sb6 Gd1 Sb4 85.012(13) . . ?
Sb3 Gd1 Sb4 56.100(18) 13 . ?
Sb3 Gd1 Sb4 56.100(18) 13_455 . ?
Sb3 Gd1 Sb4 131.356(18) 14_445 . ?
Sb3 Gd1 Sb4 131.356(18) 14_545 . ?
Sb6 Gd1 Sb4 85.012(13) 1_455 2 ?
Sb6 Gd1 Sb4 85.012(13) . 2 ?
Sb3 Gd1 Sb4 131.356(18) 13 2 ?
Sb3 Gd1 Sb4 131.356(18) 13_455 2 ?
Sb3 Gd1 Sb4 56.100(18) 14_445 2 ?
Sb3 Gd1 Sb4 56.100(18) 14_545 2 ?
Sb4 Gd1 Sb4 166.67(3) . 2 ?
Sb6 Gd1 Sb2 138.529(18) 1_455 5_445 ?
Sb6 Gd1 Sb2 138.529(18) . 5_445 ?
Sb3 Gd1 Sb2 63.653(19) 13 5_445 ?
Sb3 Gd1 Sb2 63.653(19) 13_455 5_445 ?
Sb3 Gd1 Sb2 63.653(19) 14_445 5_445 ?
Sb3 Gd1 Sb2 63.653(19) 14_545 5_445 ?
Sb4 Gd1 Sb2 96.664(16) . 5_445 ?
Sb4 Gd1 Sb2 96.664(16) 2 5_445 ?
Sb6 Gd1 Gd2 49.927(18) 1_455 2 ?
Sb6 Gd1 Gd2 49.927(18) . 2 ?
Sb3 Gd1 Gd2 134.041(18) 13 2 ?
Sb3 Gd1 Gd2 134.041(18) 13_455 2 ?
Sb3 Gd1 Gd2 93.87(2) 14_445 2 ?
Sb3 Gd1 Gd2 93.87(2) 14_545 2 ?
Sb4 Gd1 Gd2 114.11(3) . 2 ?
Sb4 Gd1 Gd2 52.559(16) 2 2 ?
Sb2 Gd1 Gd2 149.223(14) 5_445 2 ?
Sb6 Gd1 Gd2 49.927(18) 1_455 . ?
Sb6 Gd1 Gd2 49.927(18) . . ?
Sb3 Gd1 Gd2 93.87(2) 13 . ?
Sb3 Gd1 Gd2 93.87(2) 13_455 . ?
Sb3 Gd1 Gd2 134.041(18) 14_445 . ?
Sb3 Gd1 Gd2 134.041(18) 14_545 . ?
Sb4 Gd1 Gd2 52.559(16) . . ?
Sb4 Gd1 Gd2 114.11(3) 2 . ?
Sb2 Gd1 Gd2 149.223(14) 5_445 . ?
Gd2 Gd1 Gd2 61.55(3) 2 . ?
Sb6 Gd2 Sb6 82.47(3) 1_455 . ?
Sb6 Gd2 Zn1 132.89(2) 1_455 . ?
Sb6 Gd2 Zn1 132.89(2) . . ?
Sb6 Gd2 Sb4 138.32(3) 1_455 13 ?
Sb6 Gd2 Sb4 84.88(3) . 13 ?
Zn1 Gd2 Sb4 82.85(3) . 13 ?
Sb6 Gd2 Sb4 84.88(3) 1_455 13_455 ?
Sb6 Gd2 Sb4 138.32(3) . 13_455 ?
Zn1 Gd2 Sb4 82.85(3) . 13_455 ?
Sb4 Gd2 Sb4 78.72(3) 13 13_455 ?
Sb6 Gd2 Sb1 82.23(2) 1_455 . ?
Sb6 Gd2 Sb1 82.23(2) . . ?
Zn1 Gd2 Sb1 75.18(4) . . ?
Sb4 Gd2 Sb1 134.901(15) 13 . ?
Sb4 Gd2 Sb1 134.901(15) 13_455 . ?
Sb6 Gd2 Sb5 84.35(2) 1_455 13_455 ?
Sb6 Gd2 Sb5 136.99(2) . 13_455 ?
Zn1 Gd2 Sb5 48.80(2) . 13_455 ?
Sb4 Gd2 Sb5 129.18(2) 13 13_455 ?
Sb4 Gd2 Sb5 80.42(2) 13_455 13_455 ?
Sb1 Gd2 Sb5 55.45(2) . 13_455 ?
Sb6 Gd2 Sb5 136.99(2) 1_455 13 ?
Sb6 Gd2 Sb5 84.35(2) . 13 ?
Zn1 Gd2 Sb5 48.80(2) . 13 ?
Sb4 Gd2 Sb5 80.42(2) 13 13 ?
Sb4 Gd2 Sb5 129.18(2) 13_455 13 ?
Sb1 Gd2 Sb5 55.45(2) . 13 ?
Sb5 Gd2 Sb5 78.00(3) 13_455 13 ?
Sb6 Gd2 Sb4 82.98(2) 1_455 . ?
Sb6 Gd2 Sb4 82.98(2) . . ?
Zn1 Gd2 Sb4 124.53(4) . . ?
Sb4 Gd2 Sb4 56.077(17) 13 . ?
Sb4 Gd2 Sb4 56.077(17) 13_455 . ?
Sb1 Gd2 Sb4 160.29(2) . . ?
Sb5 Gd2 Sb4 135.489(18) 13_455 . ?
Sb5 Gd2 Sb4 135.489(18) 13 . ?
Sb6 Gd2 Sb3 135.548(14) 1_455 . ?
Sb6 Gd2 Sb3 135.548(14) . . ?
Zn1 Gd2 Sb3 43.51(3) . . ?
Sb4 Gd2 Sb3 51.997(19) 13 . ?
Sb4 Gd2 Sb3 51.997(19) 13_455 . ?
Sb1 Gd2 Sb3 118.69(2) . . ?
Sb5 Gd2 Sb3 78.83(2) 13_455 . ?
Sb5 Gd2 Sb3 78.83(2) 13 . ?
Sb4 Gd2 Sb3 81.02(2) . . ?
Sb6 Gd2 Gd1 49.609(16) 1_455 . ?
Sb6 Gd2 Gd1 49.609(16) . . ?
Zn1 Gd2 Gd1 174.68(3) . . ?
Sb4 Gd2 Gd1 93.05(2) 13 . ?
Sb4 Gd2 Gd1 93.05(2) 13_455 . ?
Sb1 Gd2 Gd1 110.14(3) . . ?
Sb5 Gd2 Gd1 133.953(18) 13_455 . ?
Sb5 Gd2 Gd1 133.953(18) 13 . ?
Sb4 Gd2 Gd1 50.15(2) . . ?
Sb3 Gd2 Gd1 131.168(19) . . ?
Sb3 Zn1 Sb3 99.72(8) . 10 ?
Sb3 Zn1 Sb5 113.958(17) . 13_455 ?
Sb3 Zn1 Sb5 113.957(17) 10 13_455 ?
Sb3 Zn1 Sb5 113.957(17) . 13 ?
Sb3 Zn1 Sb5 113.957(17) 10 13 ?
Sb5 Zn1 Sb5 101.92(8) 13_455 13 ?
Sb3 Zn1 Gd2 175.96(7) . 10 ?
Sb3 Zn1 Gd2 76.24(3) 10 10 ?
Sb5 Zn1 Gd2 68.22(3) 13_455 10 ?
Sb5 Zn1 Gd2 68.22(3) 13 10 ?
Sb3 Zn1 Gd2 76.24(3) . . ?
Sb3 Zn1 Gd2 175.96(7) 10 . ?
Sb5 Zn1 Gd2 68.22(3) 13_455 . ?
Sb5 Zn1 Gd2 68.22(3) 13 . ?
Gd2 Zn1 Gd2 107.81(6) 10 . ?
Sb5 Sb1 Sb5 180.00(2) 13 5_444 ?
Sb5 Sb1 Sb5 85.20(3) 13 13_455 ?
Sb5 Sb1 Sb5 94.80(3) 5_444 13_455 ?
Sb5 Sb1 Sb5 94.80(3) 13 5_544 ?
Sb5 Sb1 Sb5 85.20(3) 5_444 5_544 ?
Sb5 Sb1 Sb5 180.00(2) 13_455 5_544 ?
Sb5 Sb1 Gd2 117.653(15) 13 9 ?
Sb5 Sb1 Gd2 62.347(15) 5_444 9 ?
Sb5 Sb1 Gd2 117.653(15) 13_455 9 ?
Sb5 Sb1 Gd2 62.347(15) 5_544 9 ?
Sb5 Sb1 Gd2 62.347(15) 13 . ?
Sb5 Sb1 Gd2 117.653(15) 5_444 . ?
Sb5 Sb1 Gd2 62.347(15) 13_455 . ?
Sb5 Sb1 Gd2 117.653(15) 5_544 . ?
Gd2 Sb1 Gd2 180.000(15) 9 . ?
Sb5 Sb1 Gd2 62.347(15) 13 10 ?
Sb5 Sb1 Gd2 117.653(15) 5_444 10 ?
Sb5 Sb1 Gd2 62.347(15) 13_455 10 ?
Sb5 Sb1 Gd2 117.653(14) 5_544 10 ?
Gd2 Sb1 Gd2 78.17(3) 9 10 ?
Gd2 Sb1 Gd2 101.83(3) . 10 ?
Sb5 Sb1 Gd2 117.653(15) 13 2 ?
Sb5 Sb1 Gd2 62.347(15) 5_444 2 ?
Sb5 Sb1 Gd2 117.653(15) 13_455 2 ?
Sb5 Sb1 Gd2 62.347(15) 5_544 2 ?
Gd2 Sb1 Gd2 101.83(3) 9 2 ?
Gd2 Sb1 Gd2 78.17(3) . 2 ?
Gd2 Sb1 Gd2 180.000(15) 10 2 ?
Gd1 Sb2 Gd1 180.0 5_554 13 ?
Zn1 Sb3 Sb4 101.02(4) . 13 ?
Zn1 Sb3 Sb4 101.02(4) . 13_455 ?
Sb4 Sb3 Sb4 87.71(3) 13 13_455 ?
Zn1 Sb3 Gd1 137.282(19) . 13 ?
Sb4 Sb3 Gd1 62.23(2) 13 13 ?
Sb4 Sb3 Gd1 116.06(3) 13_455 13 ?
Zn1 Sb3 Gd1 137.282(19) . 13_455 ?
Sb4 Sb3 Gd1 116.06(3) 13 13_455 ?
Sb4 Sb3 Gd1 62.23(2) 13_455 13_455 ?
Gd1 Sb3 Gd1 81.58(3) 13 13_455 ?
Zn1 Sb3 Gd2 60.25(4) . . ?
Sb4 Sb3 Gd2 59.412(18) 13 . ?
Sb4 Sb3 Gd2 59.412(18) 13_455 . ?
Gd1 Sb3 Gd2 121.55(2) 13 . ?
Gd1 Sb3 Gd2 121.55(2) 13_455 . ?
Sb3 Sb4 Sb3 87.71(3) 13 13_455 ?
Sb3 Sb4 Sb4 176.63(3) 13 13_455 ?
Sb3 Sb4 Sb4 93.89(2) 13_455 13_455 ?
Sb3 Sb4 Sb4 93.89(2) 13 13 ?
Sb3 Sb4 Sb4 176.63(3) 13_455 13 ?
Sb4 Sb4 Sb4 84.36(4) 13_455 13 ?
Sb3 Sb4 Gd1 61.67(2) 13 . ?
Sb3 Sb4 Gd1 61.67(2) 13_455 . ?
Sb4 Sb4 Gd1 116.59(3) 13_455 . ?
Sb4 Sb4 Gd1 116.59(3) 13 . ?
Sb3 Sb4 Gd2 68.59(3) 13 13 ?
Sb3 Sb4 Gd2 120.91(3) 13_455 13 ?
Sb4 Sb4 Gd2 112.90(3) 13_455 13 ?
Sb4 Sb4 Gd2 62.45(2) 13 13 ?
Gd1 Sb4 Gd2 130.15(2) . 13 ?
Sb3 Sb4 Gd2 120.91(3) 13 13_455 ?
Sb3 Sb4 Gd2 68.59(3) 13_455 13_455 ?
Sb4 Sb4 Gd2 62.45(2) 13_455 13_455 ?
Sb4 Sb4 Gd2 112.90(3) 13 13_455 ?
Gd1 Sb4 Gd2 130.15(2) . 13_455 ?
Gd2 Sb4 Gd2 78.72(3) 13 13_455 ?
Sb3 Sb4 Gd2 115.17(3) 13 . ?
Sb3 Sb4 Gd2 115.17(3) 13_455 . ?
Sb4 Sb4 Gd2 61.47(3) 13_455 . ?
Sb4 Sb4 Gd2 61.47(3) 13 . ?
Gd1 Sb4 Gd2 77.29(2) . . ?
Gd2 Sb4 Gd2 123.923(17) 13 . ?
Gd2 Sb4 Gd2 123.923(17) 13_455 . ?
Zn1 Sb5 Zn1 101.92(8) 13_455 13 ?
Zn1 Sb5 Sb1 171.64(4) 13_455 5 ?
Zn1 Sb5 Sb1 86.44(4) 13 5 ?
Zn1 Sb5 Sb1 86.44(4) 13_455 5_455 ?
Zn1 Sb5 Sb1 171.64(4) 13 5_455 ?
Sb1 Sb5 Sb1 85.20(3) 5 5_455 ?
Zn1 Sb5 Gd2 121.56(3) 13_455 6 ?
Zn1 Sb5 Gd2 62.98(2) 13 6 ?
Sb1 Sb5 Gd2 62.204(15) 5 6 ?
Sb1 Sb5 Gd2 112.68(2) 5_455 6 ?
Zn1 Sb5 Gd2 62.98(2) 13_455 13_455 ?
Zn1 Sb5 Gd2 121.56(3) 13 13_455 ?
Sb1 Sb5 Gd2 112.68(2) 5 13_455 ?
Sb1 Sb5 Gd2 62.204(15) 5_455 13_455 ?
Gd2 Sb5 Gd2 173.71(3) 6 13_455 ?
Zn1 Sb5 Gd2 62.98(2) 13_455 6_455 ?
Zn1 Sb5 Gd2 121.56(3) 13 6_455 ?
Sb1 Sb5 Gd2 112.68(2) 5 6_455 ?
Sb1 Sb5 Gd2 62.204(15) 5_455 6_455 ?
Gd2 Sb5 Gd2 78.00(3) 6 6_455 ?
Gd2 Sb5 Gd2 101.64(3) 13_455 6_455 ?
Zn1 Sb5 Gd2 121.56(3) 13_455 13 ?
Zn1 Sb5 Gd2 62.98(2) 13 13 ?
Sb1 Sb5 Gd2 62.204(15) 5 13 ?
Sb1 Sb5 Gd2 112.68(2) 5_455 13 ?
Gd2 Sb5 Gd2 101.64(3) 6 13 ?
Gd2 Sb5 Gd2 78.00(3) 13_455 13 ?
Gd2 Sb5 Gd2 173.71(3) 6_455 13 ?
Gd1 Sb6 Gd1 82.94(4) 1_655 . ?
Gd1 Sb6 Gd2 135.020(19) 1_655 2 ?
Gd1 Sb6 Gd2 80.46(2) . 2 ?
Gd1 Sb6 Gd2 80.46(2) 1_655 1_655 ?
Gd1 Sb6 Gd2 135.020(19) . 1_655 ?
Gd2 Sb6 Gd2 137.62(4) 2 1_655 ?
Gd1 Sb6 Gd2 80.46(2) 1_655 2_655 ?
Gd1 Sb6 Gd2 135.020(19) . 2_655 ?
Gd2 Sb6 Gd2 82.47(3) 2 2_655 ?
Gd2 Sb6 Gd2 82.52(3) 1_655 2_655 ?
Gd1 Sb6 Gd2 135.020(19) 1_655 . ?
Gd1 Sb6 Gd2 80.46(2) . . ?
Gd2 Sb6 Gd2 82.52(3) 2 . ?
Gd2 Sb6 Gd2 82.47(3) 1_655 . ?
Gd2 Sb6 Gd2 137.62(4) 2_655 . ?
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
Gd1 Sb6 3.1365(11) 1_455 ?
Gd1 Sb6 3.1365(11) . ?
Gd1 Sb3 3.1795(9) 13 ?
Gd1 Sb3 3.1795(9) 13_455 ?
Gd1 Sb3 3.1795(9) 14_445 ?
Gd1 Sb3 3.1795(9) 14_545 ?
Gd1 Sb4 3.1962(12) . ?
Gd1 Sb4 3.1962(12) 2 ?
Gd1 Sb2 3.3307(13) 5_445 ?
Gd1 Gd2 4.0613(13) 2 ?
Gd1 Gd2 4.0613(13) . ?
Gd2 Sb6 3.1513(8) 1_455 ?
Gd2 Sb6 3.1513(8) . ?
Gd2 Zn1 3.1664(14) . ?
Gd2 Sb4 3.2754(9) 13 ?
Gd2 Sb4 3.2754(9) 13_455 ?
Gd2 Sb1 3.2961(9) . ?
Gd2 Sb5 3.3005(8) 13_455 ?
Gd2 Sb5 3.3005(8) 13 ?
Gd2 Sb4 3.3055(12) . ?
Gd2 Sb3 3.5423(14) . ?
Zn1 Sb3 2.5110(16) . ?
Zn1 Sb3 2.5110(16) 10 ?
Zn1 Sb5 2.6744(15) 13_455 ?
Zn1 Sb5 2.6744(15) 13 ?
Zn1 Gd2 3.1664(14) 10 ?
Sb1 Sb5 3.0689(9) 13 ?
Sb1 Sb5 3.0689(9) 5_444 ?
Sb1 Sb5 3.0689(9) 13_455 ?
Sb1 Sb5 3.0689(9) 5_544 ?
Sb1 Gd2 3.2961(9) 9 ?
Sb1 Gd2 3.2961(9) 10 ?
Sb1 Gd2 3.2961(9) 2 ?
Sb2 Gd1 3.3307(13) 5_554 ?
Sb2 Gd1 3.3307(13) 13 ?
Sb3 Sb4 2.9982(9) 13 ?
Sb3 Sb4 2.9982(9) 13_455 ?
Sb3 Gd1 3.1795(9) 13 ?
Sb3 Gd1 3.1795(9) 13_455 ?
Sb4 Sb3 2.9982(9) 13 ?
Sb4 Sb3 2.9982(9) 13_455 ?
Sb4 Sb4 3.0936(11) 13_455 ?
Sb4 Sb4 3.0936(11) 13 ?
Sb4 Gd2 3.2754(9) 13 ?
Sb4 Gd2 3.2754(9) 13_455 ?
Sb5 Zn1 2.6744(15) 13_455 ?
Sb5 Zn1 2.6744(15) 13 ?
Sb5 Sb1 3.0689(9) 5 ?
Sb5 Sb1 3.0689(9) 5_455 ?
Sb5 Gd2 3.3005(8) 6 ?
Sb5 Gd2 3.3005(8) 13_455 ?
Sb5 Gd2 3.3005(8) 6_455 ?
Sb5 Gd2 3.3005(8) 13 ?
Sb6 Gd1 3.1365(11) 1_655 ?
Sb6 Gd2 3.1513(8) 2 ?
Sb6 Gd2 3.1513(8) 1_655 ?
Sb6 Gd2 3.1513(8) 2_655 ?
