#------------------------------------------------------------------------------
#$Date: 2016-03-23 00:06:12 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179093 $
#$URL: svn://www.crystallography.net/cod/cif/4/30/55/4305527.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_4305527
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            'Sb28 Sm12 Zn2.73'
_chemical_formula_weight         5391.66
_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 SP2 r1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            1
_cell_length_a                   4.1838(13)
_cell_length_b                   15.039(5)
_cell_length_c                   18.832(6)
_cell_measurement_reflns_used    1753
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      27.4680
_cell_measurement_theta_min      3.4665
_cell_volume                     1184.9(7)
_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 14.6306
_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    0.0196
_diffrn_reflns_limit_h_max       4
_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       -19
_diffrn_reflns_number            4558
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_diffrn_reflns_theta_min         2.71
_exptl_absorpt_coefficient_mu    31.577
_exptl_absorpt_correction_T_max  1.0000
_exptl_absorpt_correction_T_min  0.5415
_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            Gray
_exptl_crystal_density_diffrn    7.556
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Chunk
_exptl_crystal_F_000             2254
_exptl_crystal_size_max          0.1000
_exptl_crystal_size_mid          0.1000
_exptl_crystal_size_min          0.0500
_refine_diff_density_max         9.969
_refine_diff_density_min         -6.767
_refine_diff_density_rms         0.654
_refine_ls_extinction_coef       0.00081(7)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.073
_refine_ls_matrix_type           full
_refine_ls_number_parameters     43
_refine_ls_number_reflns         826
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.073
_refine_ls_R_factor_all          0.0418
_refine_ls_R_factor_gt           0.0398
_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)+(0.0448P)²+156.8994P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0958
_refine_ls_wR_factor_ref         0.0971
_reflns_number_gt                780
_reflns_number_total             826
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic800524d_si_001_1.cif
_cod_data_source_block           Sm
_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_original_cell_volume        1184.9(6)
_cod_database_code               4305527
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
Sm1 Sm 0.0000 0.0000 0.32419(6) 0.0075(3) Uani 1 4 d S . .
Sm2 Sm 0.0000 0.13852(5) 0.13599(4) 0.0055(2) Uani 1 2 d S . .
Zn1 Zn 0.0000 0.2623(2) 0.0000 0.0103(13) Uani 0.682(14) 4 d SP . .
Sb1 Sb 0.0000 0.0000 0.0000 0.0593(15) Uani 1 8 d S . .
Sb2 Sb 0.5000 0.5000 0.0000 0.0324(7) Uani 1 8 d S . .
Sb3 Sb 0.0000 0.36691(8) 0.10157(7) 0.0180(3) Uani 1 2 d S . .
Sb4 Sb 0.0000 0.21172(6) 0.30213(5) 0.0069(3) Uani 1 2 d S . .
Sb5 Sb 0.0000 0.34745(10) 0.5000 0.0085(3) Uani 1 4 d S . .
Sb6 Sb 0.5000 0.0000 0.19826(7) 0.0057(3) 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'
Sm Sm -0.1638 3.4418 '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 Sm1 Sb6 82.83(5) 1_455 . ?
Sb6 Sm1 Sb4 84.43(2) 1_455 2 ?
Sb6 Sm1 Sb4 84.43(2) . 2 ?
Sb6 Sm1 Sb4 84.43(2) 1_455 . ?
Sb6 Sm1 Sb4 84.43(2) . . ?
Sb4 Sm1 Sb4 165.13(5) 2 . ?
Sb6 Sm1 Sb3 139.16(3) 1_455 13 ?
Sb6 Sm1 Sb3 84.01(3) . 13 ?
Sb4 Sm1 Sb3 132.35(3) 2 13 ?
Sb4 Sm1 Sb3 55.87(3) . 13 ?
Sb6 Sm1 Sb3 84.01(3) 1_455 14_445 ?
Sb6 Sm1 Sb3 139.16(3) . 14_445 ?
Sb4 Sm1 Sb3 55.87(3) 2 14_445 ?
Sb4 Sm1 Sb3 132.35(3) . 14_445 ?
Sb3 Sm1 Sb3 128.45(6) 13 14_445 ?
Sb6 Sm1 Sb3 139.16(3) 1_455 14_545 ?
Sb6 Sm1 Sb3 84.01(3) . 14_545 ?
Sb4 Sm1 Sb3 55.87(3) 2 14_545 ?
Sb4 Sm1 Sb3 132.35(3) . 14_545 ?
Sb3 Sm1 Sb3 77.01(4) 13 14_545 ?
Sb3 Sm1 Sb3 81.18(4) 14_445 14_545 ?
Sb6 Sm1 Sb3 84.01(3) 1_455 13_455 ?
Sb6 Sm1 Sb3 139.16(3) . 13_455 ?
Sb4 Sm1 Sb3 132.35(3) 2 13_455 ?
Sb4 Sm1 Sb3 55.87(3) . 13_455 ?
Sb3 Sm1 Sb3 81.18(4) 13 13_455 ?
Sb3 Sm1 Sb3 77.01(4) 14_445 13_455 ?
Sb3 Sm1 Sb3 128.45(6) 14_545 13_455 ?
Sb6 Sm1 Sb2 138.58(2) 1_455 5_445 ?
Sb6 Sm1 Sb2 138.58(2) . 5_445 ?
Sb4 Sm1 Sb2 97.43(3) 2 5_445 ?
Sb4 Sm1 Sb2 97.43(3) . 5_445 ?
Sb3 Sm1 Sb2 64.23(3) 13 5_445 ?
Sb3 Sm1 Sb2 64.23(3) 14_445 5_445 ?
Sb3 Sm1 Sb2 64.23(3) 14_545 5_445 ?
Sb3 Sm1 Sb2 64.23(3) 13_455 5_445 ?
Zn1 Sm2 Sb6 133.17(3) . 1_455 ?
Zn1 Sm2 Sb6 133.17(3) . . ?
Sb6 Sm2 Sb6 82.37(3) 1_455 . ?
Zn1 Sm2 Sb4 83.33(5) . 13 ?
Sb6 Sm2 Sb4 137.52(4) 1_455 13 ?
Sb6 Sm2 Sb4 84.23(3) . 13 ?
Zn1 Sm2 Sb4 83.33(5) . 13_455 ?
Sb6 Sm2 Sb4 84.23(3) 1_455 13_455 ?
Sb6 Sm2 Sb4 137.52(4) . 13_455 ?
Sb4 Sm2 Sb4 79.04(3) 13 13_455 ?
Zn1 Sm2 Sb1 75.14(6) . . ?
Sb6 Sm2 Sb1 82.68(3) 1_455 . ?
Sb6 Sm2 Sb1 82.68(3) . . ?
Sb4 Sm2 Sb1 135.02(2) 13 . ?
Sb4 Sm2 Sb1 135.02(2) 13_455 . ?
Zn1 Sm2 Sb5 48.50(4) . 13_455 ?
Sb6 Sm2 Sb5 84.91(3) 1_455 13_455 ?
Sb6 Sm2 Sb5 137.97(4) . 13_455 ?
Sb4 Sm2 Sb5 129.20(4) 13 13_455 ?
Sb4 Sm2 Sb5 80.13(3) 13_455 13_455 ?
Sb1 Sm2 Sb5 55.99(3) . 13_455 ?
Zn1 Sm2 Sb5 48.50(4) . 13 ?
Sb6 Sm2 Sb5 137.97(4) 1_455 13 ?
Sb6 Sm2 Sb5 84.91(3) . 13 ?
Sb4 Sm2 Sb5 80.13(3) 13 13 ?
Sb4 Sm2 Sb5 129.20(4) 13_455 13 ?
Sb1 Sm2 Sb5 55.99(3) . 13 ?
Sb5 Sm2 Sb5 78.30(3) 13_455 13 ?
Zn1 Sm2 Sb4 124.60(6) . . ?
Sb6 Sm2 Sb4 82.50(3) 1_455 . ?
Sb6 Sm2 Sb4 82.50(3) . . ?
Sb4 Sm2 Sb4 55.82(2) 13 . ?
Sb4 Sm2 Sb4 55.82(2) 13_455 . ?
Sb1 Sm2 Sb4 160.26(3) . . ?
Sb5 Sm2 Sb4 135.07(2) 13_455 . ?
Sb5 Sm2 Sb4 135.07(2) 13 . ?
Zn1 Sm2 Sb3 43.30(6) . . ?
Sb6 Sm2 Sb3 135.470(17) 1_455 . ?
Sb6 Sm2 Sb3 135.470(17) . . ?
Sb4 Sm2 Sb3 52.59(2) 13 . ?
Sb4 Sm2 Sb3 52.59(2) 13_455 . ?
Sb1 Sm2 Sb3 118.44(3) . . ?
Sb5 Sm2 Sb3 78.12(3) 13_455 . ?
Sb5 Sm2 Sb3 78.12(3) 13 . ?
Sb4 Sm2 Sb3 81.30(3) . . ?
Sb3 Zn1 Sb3 101.12(15) 10 . ?
Sb3 Zn1 Sb5 113.17(2) 10 13_455 ?
Sb3 Zn1 Sb5 113.17(2) . 13_455 ?
Sb3 Zn1 Sb5 113.17(2) 10 13 ?
Sb3 Zn1 Sb5 113.17(2) . 13 ?
Sb5 Zn1 Sb5 103.46(14) 13_455 13 ?
Sb3 Zn1 Sm2 75.45(4) 10 10 ?
Sb3 Zn1 Sm2 176.57(12) . 10 ?
Sb5 Zn1 Sm2 68.64(6) 13_455 10 ?
Sb5 Zn1 Sm2 68.64(6) 13 10 ?
Sb3 Zn1 Sm2 176.57(12) 10 . ?
Sb3 Zn1 Sm2 75.45(4) . . ?
Sb5 Zn1 Sm2 68.64(6) 13_455 . ?
Sb5 Zn1 Sm2 68.64(6) 13 . ?
Sm2 Zn1 Sm2 107.98(11) 10 . ?
Sb5 Sb1 Sb5 180.00(4) 13 5_444 ?
Sb5 Sb1 Sb5 84.72(4) 13 13_455 ?
Sb5 Sb1 Sb5 95.28(4) 5_444 13_455 ?
Sb5 Sb1 Sb5 95.28(4) 13 5_544 ?
Sb5 Sb1 Sb5 84.72(4) 5_444 5_544 ?
Sb5 Sb1 Sb5 180.00(4) 13_455 5_544 ?
Sb5 Sb1 Sm2 117.796(17) 13 9 ?
Sb5 Sb1 Sm2 62.204(17) 5_444 9 ?
Sb5 Sb1 Sm2 117.796(17) 13_455 9 ?
Sb5 Sb1 Sm2 62.204(17) 5_544 9 ?
Sb5 Sb1 Sm2 62.204(17) 13 . ?
Sb5 Sb1 Sm2 117.796(17) 5_444 . ?
Sb5 Sb1 Sm2 62.204(17) 13_455 . ?
Sb5 Sb1 Sm2 117.796(17) 5_544 . ?
Sm2 Sb1 Sm2 180.000(16) 9 . ?
Sb5 Sb1 Sm2 62.204(17) 13 10 ?
Sb5 Sb1 Sm2 117.796(17) 5_444 10 ?
Sb5 Sb1 Sm2 62.204(17) 13_455 10 ?
Sb5 Sb1 Sm2 117.796(17) 5_544 10 ?
Sm2 Sb1 Sm2 78.26(4) 9 10 ?
Sm2 Sb1 Sm2 101.74(4) . 10 ?
Sb5 Sb1 Sm2 117.796(17) 13 2 ?
Sb5 Sb1 Sm2 62.204(17) 5_444 2 ?
Sb5 Sb1 Sm2 117.796(17) 13_455 2 ?
Sb5 Sb1 Sm2 62.204(17) 5_544 2 ?
Sm2 Sb1 Sm2 101.74(4) 9 2 ?
Sm2 Sb1 Sm2 78.26(4) . 2 ?
Sm2 Sb1 Sm2 180.00(2) 10 2 ?
Sm1 Sb2 Sm1 180.0 5_554 13 ?
Zn1 Sb3 Sb4 102.46(6) . 13 ?
Zn1 Sb3 Sb4 102.46(6) . 13_455 ?
Sb4 Sb3 Sb4 88.04(5) 13 13_455 ?
Zn1 Sb3 Sm1 137.00(3) . 13 ?
Sb4 Sb3 Sm1 62.00(3) 13 13 ?
Sb4 Sb3 Sm1 115.77(5) 13_455 13 ?
Zn1 Sb3 Sm1 137.00(3) . 13_455 ?
Sb4 Sb3 Sm1 115.77(5) 13 13_455 ?
Sb4 Sb3 Sm1 62.00(3) 13_455 13_455 ?
Sm1 Sb3 Sm1 81.18(4) 13 13_455 ?
Zn1 Sb3 Sm2 61.25(7) . . ?
Sb4 Sb3 Sm2 60.15(3) 13 . ?
Sb4 Sb3 Sm2 60.15(3) 13_455 . ?
Sm1 Sb3 Sm2 122.08(3) 13 . ?
Sm1 Sb3 Sm2 122.08(3) 13_455 . ?
Sb3 Sb4 Sb3 88.04(5) 13 13_455 ?
Sb3 Sb4 Sb4 177.56(5) 13 13_455 ?
Sb3 Sb4 Sb4 93.36(3) 13_455 13_455 ?
Sb3 Sb4 Sb4 93.36(3) 13 13 ?
Sb3 Sb4 Sb4 177.56(5) 13_455 13 ?
Sb4 Sb4 Sb4 85.17(5) 13_455 13 ?
Sb3 Sb4 Sm1 62.13(3) 13 . ?
Sb3 Sb4 Sm1 62.13(3) 13_455 . ?
Sb4 Sb4 Sm1 116.84(4) 13_455 . ?
Sb4 Sb4 Sm1 116.84(4) 13 . ?
Sb3 Sb4 Sm2 67.26(3) 13 13 ?
Sb3 Sb4 Sm2 119.85(4) 13_455 13 ?
Sb4 Sb4 Sm2 113.61(5) 13_455 13 ?
Sb4 Sb4 Sm2 62.57(3) 13 13 ?
Sm1 Sb4 Sm2 129.31(3) . 13 ?
Sb3 Sb4 Sm2 119.85(4) 13 13_455 ?
Sb3 Sb4 Sm2 67.26(3) 13_455 13_455 ?
Sb4 Sb4 Sm2 62.57(3) 13_455 13_455 ?
Sb4 Sb4 Sm2 113.61(5) 13 13_455 ?
Sm1 Sb4 Sm2 129.31(3) . 13_455 ?
Sm2 Sb4 Sm2 79.04(3) 13 13_455 ?
Sb3 Sb4 Sm2 115.97(4) 13 . ?
Sb3 Sb4 Sm2 115.97(4) 13_455 . ?
Sb4 Sb4 Sm2 61.61(3) 13_455 . ?
Sb4 Sb4 Sm2 61.61(3) 13 . ?
Sm1 Sb4 Sm2 78.05(3) . . ?
Sm2 Sb4 Sm2 124.18(2) 13 . ?
Sm2 Sb4 Sm2 124.18(2) 13_455 . ?
Zn1 Sb5 Zn1 103.46(14) 13_455 13 ?
Zn1 Sb5 Sb1 170.63(8) 13_455 5 ?
Zn1 Sb5 Sb1 85.91(7) 13 5 ?
Zn1 Sb5 Sb1 85.91(7) 13_455 5_455 ?
Zn1 Sb5 Sb1 170.63(8) 13 5_455 ?
Sb1 Sb5 Sb1 84.72(4) 5 5_455 ?
Zn1 Sb5 Sm2 122.35(4) 13_455 6 ?
Zn1 Sb5 Sm2 62.86(4) 13 6 ?
Sb1 Sb5 Sm2 61.81(2) 5 6 ?
Sb1 Sb5 Sm2 112.23(3) 5_455 6 ?
Zn1 Sb5 Sm2 62.86(4) 13_455 13_455 ?
Zn1 Sb5 Sm2 122.35(4) 13 13_455 ?
Sb1 Sb5 Sm2 112.23(3) 5 13_455 ?
Sb1 Sb5 Sm2 61.81(2) 5_455 13_455 ?
Sm2 Sb5 Sm2 172.70(6) 6 13_455 ?
Zn1 Sb5 Sm2 62.86(4) 13_455 6_455 ?
Zn1 Sb5 Sm2 122.35(4) 13 6_455 ?
Sb1 Sb5 Sm2 112.23(3) 5 6_455 ?
Sb1 Sb5 Sm2 61.81(2) 5_455 6_455 ?
Sm2 Sb5 Sm2 78.30(3) 6 6_455 ?
Sm2 Sb5 Sm2 101.23(3) 13_455 6_455 ?
Zn1 Sb5 Sm2 122.35(4) 13_455 13 ?
Zn1 Sb5 Sm2 62.86(4) 13 13 ?
Sb1 Sb5 Sm2 61.81(2) 5 13 ?
Sb1 Sb5 Sm2 112.23(3) 5_455 13 ?
Sm2 Sb5 Sm2 101.23(3) 6 13 ?
Sm2 Sb5 Sm2 78.30(3) 13_455 13 ?
Sm2 Sb5 Sm2 172.70(6) 6_455 13 ?
Sm1 Sb6 Sm1 82.83(5) 1_655 . ?
Sm1 Sb6 Sm2 135.44(3) 1_655 2 ?
Sm1 Sb6 Sm2 80.86(2) . 2 ?
Sm1 Sb6 Sm2 80.86(2) 1_655 1_655 ?
Sm1 Sb6 Sm2 135.44(3) . 1_655 ?
Sm2 Sb6 Sm2 136.67(5) 2 1_655 ?
Sm1 Sb6 Sm2 80.86(2) 1_655 2_655 ?
Sm1 Sb6 Sm2 135.44(3) . 2_655 ?
Sm2 Sb6 Sm2 82.37(3) 2 2_655 ?
Sm2 Sb6 Sm2 81.96(3) 1_655 2_655 ?
Sm1 Sb6 Sm2 135.44(3) 1_655 . ?
Sm1 Sb6 Sm2 80.86(2) . . ?
Sm2 Sb6 Sm2 81.96(3) 2 . ?
Sm2 Sb6 Sm2 82.37(3) 1_655 . ?
Sm2 Sb6 Sm2 136.67(5) 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
Sm1 Sb6 3.1623(15) 1_455 ?
Sm1 Sb6 3.1623(15) . ?
Sm1 Sb4 3.2111(14) 2 ?
Sm1 Sb4 3.2111(14) . ?
Sm1 Sb3 3.2152(12) 13 ?
Sm1 Sb3 3.2151(12) 14_445 ?
Sm1 Sb3 3.2151(12) 14_545 ?
Sm1 Sb3 3.2151(12) 13_455 ?
Sm1 Sb2 3.3107(15) 5_445 ?
Sm2 Zn1 3.166(2) . ?
Sm2 Sb6 3.1767(10) 1_455 ?
Sm2 Sb6 3.1767(10) . ?
Sm2 Sb4 3.2874(11) 13 ?
Sm2 Sb4 3.2874(11) 13_455 ?
Sm2 Sb1 3.3012(10) . ?
Sm2 Sb5 3.3134(9) 13_455 ?
Sm2 Sb5 3.3134(9) 13 ?
Sm2 Sb4 3.3168(15) . ?
Sm2 Sb3 3.4954(18) . ?
Zn1 Sb3 2.477(3) 10 ?
Zn1 Sb3 2.477(3) . ?
Zn1 Sb5 2.665(3) 13_455 ?
Zn1 Sb5 2.665(3) 13 ?
Zn1 Sm2 3.166(2) 10 ?
Sb1 Sb5 3.1048(13) 13 ?
Sb1 Sb5 3.1048(13) 5_444 ?
Sb1 Sb5 3.1048(13) 13_455 ?
Sb1 Sb5 3.1048(13) 5_544 ?
Sb1 Sm2 3.3012(10) 9 ?
Sb1 Sm2 3.3012(10) 10 ?
Sb1 Sm2 3.3012(10) 2 ?
Sb2 Sm1 3.3107(15) 5_554 ?
Sb2 Sm1 3.3107(15) 13 ?
Sb3 Sb4 3.0104(12) 13 ?
Sb3 Sb4 3.0104(12) 13_455 ?
Sb3 Sm1 3.2151(12) 13 ?
Sb3 Sm1 3.2151(12) 13_455 ?
Sb4 Sb3 3.0104(12) 13 ?
Sb4 Sb3 3.0104(12) 13_455 ?
Sb4 Sb4 3.0915(15) 13_455 ?
Sb4 Sb4 3.0915(15) 13 ?
Sb4 Sm2 3.2874(11) 13 ?
Sb4 Sm2 3.2874(11) 13_455 ?
Sb5 Zn1 2.665(3) 13_455 ?
Sb5 Zn1 2.665(3) 13 ?
Sb5 Sb1 3.1048(13) 5 ?
Sb5 Sb1 3.1048(13) 5_455 ?
Sb5 Sm2 3.3134(10) 6 ?
Sb5 Sm2 3.3134(10) 13_455 ?
Sb5 Sm2 3.3134(9) 6_455 ?
Sb5 Sm2 3.3134(10) 13 ?
Sb6 Sm1 3.1623(15) 1_655 ?
Sb6 Sm2 3.1767(10) 2 ?
Sb6 Sm2 3.1767(10) 1_655 ?
Sb6 Sm2 3.1767(10) 2_655 ?
