#------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: svn://www.crystallography.net/cod/cif/2/01/84/2018417.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_2018417
loop_
_publ_author_name
'Schmetterer, Clemens'
'Effenberger, Herta Silvia'
'Marker, Martin C. J.'
'Flandorfer, Hans'
_publ_section_title
;
 Ni~5-{δ~}Sn₄Zn (δ∼ 0.25) from single-crystal data
;
_journal_coeditor_code           KU3063
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first              i9
_journal_page_last               i11
_journal_paper_doi               10.1107/S0108270112000455
_journal_volume                  68
_journal_year                    2012
_chemical_formula_iupac          'Ni3.17 Sn2.67 Zn0.67'
_chemical_formula_moiety         Ni~5-~~\d~,Sn4,Zn
_chemical_formula_sum            'Ni3.17 Sn2.67 Zn0.67'
_chemical_formula_weight         546.00
_chemical_name_systematic
;
pentanickel tetratin zinc
;
_space_group_IT_number           63
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_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            6
_cell_length_a                   4.1520(8)
_cell_length_b                   12.603(3)
_cell_length_c                   11.657(2)
_cell_measurement_reflns_used    4711
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      35
_cell_measurement_theta_min      3.2
_cell_volume                     610.0(2)
_computing_cell_refinement       'COLLECT (Nonius, 2003)'
_computing_data_collection       'COLLECT (Nonius, 2003)'
_computing_data_reduction        'COLLECT (Nonius, 2003)'
_computing_molecular_graphics    'ATOMS (Dowty, 2006)'
_computing_publication_material  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      298(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Nonius KappaCCD'
_diffrn_measurement_method       'φ scan at 10 ω angles'
_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  0.0408
_diffrn_reflns_av_sigmaI/netI    0.0224
_diffrn_reflns_limit_h_max       6
_diffrn_reflns_limit_h_min       -6
_diffrn_reflns_limit_k_max       20
_diffrn_reflns_limit_k_min       -20
_diffrn_reflns_limit_l_max       18
_diffrn_reflns_limit_l_min       -18
_diffrn_reflns_number            4711
_diffrn_reflns_theta_full        35.01
_diffrn_reflns_theta_max         35.01
_diffrn_reflns_theta_min         3.23
_diffrn_standards_decay_%        0
_diffrn_standards_interval_count 0
_diffrn_standards_interval_time  0
_diffrn_standards_number         0
_exptl_absorpt_coefficient_mu    34.104
_exptl_absorpt_correction_T_max  0.71
_exptl_absorpt_correction_T_min  0.6
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   '120 sec., Δ=2, 626 scans, dx=30'
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    8.918
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'irregular crystal chip'
_exptl_crystal_F_000             1452
_exptl_crystal_size_max          0.015
_exptl_crystal_size_mid          0.012
_exptl_crystal_size_min          0.01
_refine_diff_density_max         1.962
_refine_diff_density_min         -2.141
_refine_ls_extinction_coef       0.00075(11)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL97 (Sheldrick, 2008)'
_refine_ls_goodness_of_fit_ref   1.136
_refine_ls_matrix_type           full
_refine_ls_number_parameters     37
_refine_ls_number_reflns         779
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.136
_refine_ls_R_factor_all          0.0318
_refine_ls_R_factor_gt           0.0258
_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[σ²(Fo²)+(0.0360P)²+3.8700P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0666
_refine_ls_wR_factor_ref         0.0705
_reflns_number_gt                693
_reflns_number_total             779
_reflns_threshold_expression     I>2sigma(I)
_cod_data_source_file            ku3063.cif
_cod_data_source_block           I
_cod_database_code               2018417
_cod_database_fobs_code          2018417
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, z+1/2'
'-x, y, -z+1/2'
'x, -y, -z'
'x+1/2, y+1/2, 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'
'-x, -y, -z'
'x, y, -z-1/2'
'x, -y, z-1/2'
'-x, y, z'
'-x+1/2, -y+1/2, -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'
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
Sn Sn1 0.0000 0.02856(4) 0.2500 0.01287(12) Uani d S 1 4
Sn Sn2 0.0000 0.28917(3) 0.2500 0.01126(12) Uani d S 1 4
Sn Sn3 0.0000 0.33899(3) 0.52587(3) 0.01450(12) Uani d S 1 2
Zn Zn1 0.0000 0.0000 0.0000 0.01478(18) Uani d S 1 4
Ni Ni1 0.0000 0.15847(4) 0.62809(6) 0.01168(15) Uani d S 1 2
Ni Ni2 0.0000 0.47745(5) 0.13111(6) 0.0118(2) Uani d SP 0.870(3) 2
Ni Ni3 0.0000 0.65903(6) 0.2500 0.01137(19) Uani d S 1 4
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Ni Ni 0.3393 1.1124 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Zn Zn 0.2839 1.4301 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Sn Sn -0.6537 1.4246 '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_site_symmetry_1
_geom_angle_site_symmetry_3
_geom_angle
Ni2 Sn1 Ni2 5_445 14_546 151.06(4)
Ni2 Sn1 Ni2 5_445 14_446 65.04(3)
Ni2 Sn1 Ni2 14_546 14_446 107.28(3)
Ni2 Sn1 Ni2 5_445 5_545 107.28(3)
Ni2 Sn1 Ni2 14_546 5_545 65.04(3)
Ni2 Sn1 Ni2 14_446 5_545 151.06(4)
Ni2 Sn1 Ni3 5_445 5_545 141.85(2)
Ni2 Sn1 Ni3 14_546 5_545 61.57(2)
Ni2 Sn1 Ni3 14_446 5_545 141.85(2)
Ni2 Sn1 Ni3 5_545 5_545 61.57(2)
Ni2 Sn1 Ni3 5_445 5_445 61.57(2)
Ni2 Sn1 Ni3 14_546 5_445 141.85(2)
Ni2 Sn1 Ni3 14_446 5_445 61.57(2)
Ni2 Sn1 Ni3 5_545 5_445 141.85(2)
Ni3 Sn1 Ni3 5_545 5_445 103.24(4)
Ni2 Sn1 Ni1 5_445 2_554 60.556(17)
Ni2 Sn1 Ni1 14_546 2_554 93.65(2)
Ni2 Sn1 Ni1 14_446 2_554 93.65(2)
Ni2 Sn1 Ni1 5_545 2_554 60.556(17)
Ni3 Sn1 Ni1 5_545 2_554 122.122(15)
Ni3 Sn1 Ni1 5_445 2_554 122.122(15)
Ni2 Sn1 Ni1 5_445 9_556 93.65(2)
Ni2 Sn1 Ni1 14_546 9_556 60.556(17)
Ni2 Sn1 Ni1 14_446 9_556 60.556(17)
Ni2 Sn1 Ni1 5_545 9_556 93.65(2)
Ni3 Sn1 Ni1 5_545 9_556 122.122(15)
Ni3 Sn1 Ni1 5_445 9_556 122.122(15)
Ni1 Sn1 Ni1 2_554 9_556 62.17(3)
Ni2 Sn1 Zn1 5_445 . 55.654(15)
Ni2 Sn1 Zn1 14_546 . 120.194(17)
Ni2 Sn1 Zn1 14_446 . 120.194(17)
Ni2 Sn1 Zn1 5_545 . 55.654(15)
Ni3 Sn1 Zn1 5_545 . 94.365(5)
Ni3 Sn1 Zn1 5_445 . 94.365(5)
Ni1 Sn1 Zn1 2_554 . 51.873(14)
Ni1 Sn1 Zn1 9_556 . 114.04(2)
Ni2 Sn1 Zn1 5_445 2 120.194(17)
Ni2 Sn1 Zn1 14_546 2 55.654(15)
Ni2 Sn1 Zn1 14_446 2 55.654(15)
Ni2 Sn1 Zn1 5_545 2 120.194(17)
Ni3 Sn1 Zn1 5_545 2 94.365(5)
Ni3 Sn1 Zn1 5_445 2 94.365(5)
Ni1 Sn1 Zn1 2_554 2 114.04(2)
Ni1 Sn1 Zn1 9_556 2 51.873(15)
Zn1 Sn1 Zn1 . 2 165.917(18)
Ni2 Sn1 Sn2 5_445 . 104.470(19)
Ni2 Sn1 Sn2 14_546 . 104.470(19)
Ni2 Sn1 Sn2 14_446 . 104.470(19)
Ni2 Sn1 Sn2 5_545 . 104.470(19)
Ni3 Sn1 Sn2 5_545 . 51.620(18)
Ni3 Sn1 Sn2 5_445 . 51.620(18)
Ni1 Sn1 Sn2 2_554 . 148.915(16)
Ni1 Sn1 Sn2 9_556 . 148.915(16)
Zn1 Sn1 Sn2 . . 97.042(9)
Zn1 Sn1 Sn2 2 . 97.042(9)
Ni2 Sn1 Sn2 5_445 5_445 48.521(18)
Ni2 Sn1 Sn2 14_546 5_445 104.52(2)
Ni2 Sn1 Sn2 14_446 5_445 48.521(18)
Ni2 Sn1 Sn2 5_545 5_445 104.52(2)
Ni3 Sn1 Sn2 5_545 5_445 162.91(2)
Ni3 Sn1 Sn2 5_445 5_445 93.85(2)
Ni1 Sn1 Sn2 2_554 5_445 45.129(13)
Ni1 Sn1 Sn2 9_556 5_445 45.129(13)
Zn1 Sn1 Sn2 . 5_445 84.204(8)
Zn1 Sn1 Sn2 2 5_445 84.204(8)
Sn2 Sn1 Sn2 . 5_445 145.468(10)
Ni2 Sn1 Sn2 5_445 5_545 104.52(2)
Ni2 Sn1 Sn2 14_546 5_545 48.521(18)
Ni2 Sn1 Sn2 14_446 5_545 104.52(2)
Ni2 Sn1 Sn2 5_545 5_545 48.521(18)
Ni3 Sn1 Sn2 5_545 5_545 93.85(2)
Ni3 Sn1 Sn2 5_445 5_545 162.91(2)
Ni1 Sn1 Sn2 2_554 5_545 45.129(13)
Ni1 Sn1 Sn2 9_556 5_545 45.129(13)
Zn1 Sn1 Sn2 . 5_545 84.204(8)
Zn1 Sn1 Sn2 2 5_545 84.204(8)
Sn2 Sn1 Sn2 . 5_545 145.468(10)
Sn2 Sn1 Sn2 5_445 5_545 69.063(19)
Ni2 Sn1 Sn3 5_445 13_556 159.439(17)
Ni2 Sn1 Sn3 14_546 13_556 44.542(18)
Ni2 Sn1 Sn3 14_446 13_556 100.57(2)
Ni2 Sn1 Sn3 5_545 13_556 92.302(19)
Ni3 Sn1 Sn3 5_545 13_556 44.446(9)
Ni3 Sn1 Sn3 5_445 13_556 99.114(19)
Ni1 Sn1 Sn3 2_554 13_556 138.129(13)
Ni1 Sn1 Sn3 9_556 13_556 91.237(17)
Zn1 Sn1 Sn3 . 13_556 138.571(10)
Zn1 Sn1 Sn3 2 13_556 50.202(10)
Sn2 Sn1 Sn3 . 13_556 63.426(10)
Sn2 Sn1 Sn3 5_445 13_556 133.152(10)
Sn2 Sn1 Sn3 5_545 13_556 93.046(12)
Ni2 Sn1 Sn3 5_445 6_454 44.542(18)
Ni2 Sn1 Sn3 14_546 6_454 159.439(17)
Ni2 Sn1 Sn3 14_446 6_454 92.302(19)
Ni2 Sn1 Sn3 5_545 6_454 100.57(2)
Ni3 Sn1 Sn3 5_545 6_454 99.114(19)
Ni3 Sn1 Sn3 5_445 6_454 44.446(9)
Ni1 Sn1 Sn3 2_554 6_454 91.237(17)
Ni1 Sn1 Sn3 9_556 6_454 138.129(13)
Zn1 Sn1 Sn3 . 6_454 50.202(10)
Zn1 Sn1 Sn3 2 6_454 138.571(10)
Sn2 Sn1 Sn3 . 6_454 63.426(10)
Sn2 Sn1 Sn3 5_445 6_454 93.046(12)
Sn2 Sn1 Sn3 5_545 6_454 133.152(10)
Sn3 Sn1 Sn3 13_556 6_454 126.851(19)
Ni1 Sn2 Ni1 13_556 6_454 150.61(3)
Ni1 Sn2 Ni1 13_556 6_554 66.24(3)
Ni1 Sn2 Ni1 6_454 6_554 105.91(3)
Ni1 Sn2 Ni1 13_556 13_456 105.91(3)
Ni1 Sn2 Ni1 6_454 13_456 66.24(3)
Ni1 Sn2 Ni1 6_554 13_456 150.61(3)
Ni1 Sn2 Ni3 13_556 5_445 141.588(19)
Ni1 Sn2 Ni3 6_454 5_445 62.029(19)
Ni1 Sn2 Ni3 6_554 5_445 141.588(19)
Ni1 Sn2 Ni3 13_456 5_445 62.029(19)
Ni1 Sn2 Ni3 13_556 5_545 62.029(19)
Ni1 Sn2 Ni3 6_454 5_545 141.588(19)
Ni1 Sn2 Ni3 6_554 5_545 62.029(19)
Ni1 Sn2 Ni3 13_456 5_545 141.588(19)
Ni3 Sn2 Ni3 5_445 5_545 103.38(3)
Ni1 Sn2 Ni2 13_556 10_556 60.355(15)
Ni1 Sn2 Ni2 6_454 10_556 93.24(2)
Ni1 Sn2 Ni2 6_554 10_556 93.24(2)
Ni1 Sn2 Ni2 13_456 10_556 60.355(15)
Ni3 Sn2 Ni2 5_445 10_556 122.366(15)
Ni3 Sn2 Ni2 5_545 10_556 122.366(15)
Ni1 Sn2 Ni2 13_556 . 93.24(2)
Ni1 Sn2 Ni2 6_454 . 60.355(15)
Ni1 Sn2 Ni2 6_554 . 60.355(15)
Ni1 Sn2 Ni2 13_456 . 93.24(2)
Ni3 Sn2 Ni2 5_445 . 122.366(15)
Ni3 Sn2 Ni2 5_545 . 122.366(15)
Ni2 Sn2 Ni2 10_556 . 60.57(3)
Ni1 Sn2 Sn3 13_556 . 54.205(14)
Ni1 Sn2 Sn3 6_454 . 119.187(17)
Ni1 Sn2 Sn3 6_554 . 119.187(17)
Ni1 Sn2 Sn3 13_456 . 54.205(14)
Ni3 Sn2 Sn3 5_445 . 96.823(6)
Ni3 Sn2 Sn3 5_545 . 96.823(6)
Ni2 Sn2 Sn3 10_556 . 48.665(17)
Ni2 Sn2 Sn3 . . 109.24(2)
Ni1 Sn2 Sn3 13_556 10_556 119.187(17)
Ni1 Sn2 Sn3 6_454 10_556 54.205(14)
Ni1 Sn2 Sn3 6_554 10_556 54.205(14)
Ni1 Sn2 Sn3 13_456 10_556 119.187(17)
Ni3 Sn2 Sn3 5_445 10_556 96.823(6)
Ni3 Sn2 Sn3 5_545 10_556 96.823(6)
Ni2 Sn2 Sn3 10_556 10_556 109.24(2)
Ni2 Sn2 Sn3 . 10_556 48.665(17)
Sn3 Sn2 Sn3 . 10_556 157.90(2)
Ni1 Sn2 Sn1 13_556 . 104.696(16)
Ni1 Sn2 Sn1 6_454 . 104.696(16)
Ni1 Sn2 Sn1 6_554 . 104.696(16)
Ni1 Sn2 Sn1 13_456 . 104.696(16)
Ni3 Sn2 Sn1 5_445 . 51.689(17)
Ni3 Sn2 Sn1 5_545 . 51.689(17)
Ni2 Sn2 Sn1 10_556 . 149.713(16)
Ni2 Sn2 Sn1 . . 149.713(17)
Sn3 Sn2 Sn1 . . 101.048(10)
Sn3 Sn2 Sn1 10_556 . 101.048(10)
Ni1 Sn2 Sn1 13_556 5 48.590(16)
Ni1 Sn2 Sn1 6_454 5 104.09(2)
Ni1 Sn2 Sn1 6_554 5 48.590(16)
Ni1 Sn2 Sn1 13_456 5 104.09(2)
Ni3 Sn2 Sn1 5_445 5 162.843(18)
Ni3 Sn2 Sn1 5_545 5 93.78(2)
Ni2 Sn2 Sn1 10_556 5 44.654(13)
Ni2 Sn2 Sn1 . 5 44.654(13)
Sn3 Sn2 Sn1 . 5 80.917(9)
Sn3 Sn2 Sn1 10_556 5 80.917(9)
Sn1 Sn2 Sn1 . 5 145.468(9)
Ni1 Sn2 Sn1 13_556 5_455 104.09(2)
Ni1 Sn2 Sn1 6_454 5_455 48.590(16)
Ni1 Sn2 Sn1 6_554 5_455 104.09(2)
Ni1 Sn2 Sn1 13_456 5_455 48.590(16)
Ni3 Sn2 Sn1 5_445 5_455 93.78(2)
Ni3 Sn2 Sn1 5_545 5_455 162.843(18)
Ni2 Sn2 Sn1 10_556 5_455 44.654(13)
Ni2 Sn2 Sn1 . 5_455 44.654(13)
Sn3 Sn2 Sn1 . 5_455 80.917(9)
Sn3 Sn2 Sn1 10_556 5_455 80.917(9)
Sn1 Sn2 Sn1 . 5_455 145.468(10)
Sn1 Sn2 Sn1 5 5_455 69.063(19)
Ni1 Sn2 Sn3 13_556 6_454 160.481(14)
Ni1 Sn2 Sn3 6_454 6_454 43.824(16)
Ni1 Sn2 Sn3 6_554 6_454 99.93(2)
Ni1 Sn2 Sn3 13_456 6_454 92.787(18)
Ni3 Sn2 Sn3 5_445 6_454 44.808(9)
Ni3 Sn2 Sn3 5_545 6_454 99.746(18)
Ni2 Sn2 Sn3 10_556 6_454 137.024(13)
Ni2 Sn2 Sn3 . 6_454 91.193(18)
Sn3 Sn2 Sn3 . 6_454 140.818(9)
Sn3 Sn2 Sn3 10_556 6_454 52.544(12)
Sn1 Sn2 Sn3 . 6_454 64.171(9)
Sn1 Sn2 Sn3 5 6_454 132.559(10)
Sn1 Sn2 Sn3 5_455 6_454 92.379(12)
Ni1 Sn2 Sn3 13_556 13_556 43.824(16)
Ni1 Sn2 Sn3 6_454 13_556 160.481(14)
Ni1 Sn2 Sn3 6_554 13_556 92.787(18)
Ni1 Sn2 Sn3 13_456 13_556 99.93(2)
Ni3 Sn2 Sn3 5_445 13_556 99.746(18)
Ni3 Sn2 Sn3 5_545 13_556 44.808(9)
Ni2 Sn2 Sn3 10_556 13_556 91.193(18)
Ni2 Sn2 Sn3 . 13_556 137.024(13)
Sn3 Sn2 Sn3 . 13_556 52.544(12)
Sn3 Sn2 Sn3 10_556 13_556 140.818(9)
Sn1 Sn2 Sn3 . 13_556 64.171(9)
Sn1 Sn2 Sn3 5 13_556 92.379(12)
Sn1 Sn2 Sn3 5_455 13_556 132.559(10)
Sn3 Sn2 Sn3 6_454 13_556 128.341(19)
Ni2 Sn3 Ni1 10_556 . 161.28(3)
Ni2 Sn3 Ni3 10_556 9_566 135.82(3)
Ni1 Sn3 Ni3 . 9_566 62.91(2)
Ni2 Sn3 Ni2 10_556 2_565 74.30(3)
Ni1 Sn3 Ni2 . 2_565 124.42(3)
Ni3 Sn3 Ni2 9_566 2_565 61.52(3)
Ni2 Sn3 Ni1 10_556 13_456 61.230(18)
Ni1 Sn3 Ni1 . 13_456 108.282(17)
Ni3 Sn3 Ni1 9_566 13_456 130.830(15)
Ni2 Sn3 Ni1 2_565 13_456 107.223(18)
Ni2 Sn3 Ni1 10_556 13_556 61.230(18)
Ni1 Sn3 Ni1 . 13_556 108.282(17)
Ni3 Sn3 Ni1 9_566 13_556 130.830(15)
Ni2 Sn3 Ni1 2_565 13_556 107.223(18)
Ni1 Sn3 Ni1 13_456 13_556 98.30(3)
Ni2 Sn3 Zn1 10_556 6 56.318(12)
Ni1 Sn3 Zn1 . 6 131.594(11)
Ni3 Sn3 Zn1 9_566 6 95.550(16)
Ni2 Sn3 Zn1 2_565 6 55.541(13)
Ni1 Sn3 Zn1 13_456 6 117.541(19)
Ni1 Sn3 Zn1 13_556 6 52.141(14)
Ni2 Sn3 Zn1 10_556 6_455 56.318(12)
Ni1 Sn3 Zn1 . 6_455 131.594(11)
Ni3 Sn3 Zn1 9_566 6_455 95.550(16)
Ni2 Sn3 Zn1 2_565 6_455 55.541(13)
Ni1 Sn3 Zn1 13_456 6_455 52.141(14)
Ni1 Sn3 Zn1 13_556 6_455 117.541(19)
Zn1 Sn3 Zn1 6 6_455 90.682(18)
Ni2 Sn3 Sn3 10_556 13_456 110.90(2)
Ni1 Sn3 Sn3 . 13_456 56.768(16)
Ni3 Sn3 Sn3 9_566 13_456 101.57(2)
Ni2 Sn3 Sn3 2_565 13_456 136.623(13)
Ni1 Sn3 Sn3 13_456 13_456 51.514(15)
Ni1 Sn3 Sn3 13_556 13_456 112.69(2)
Zn1 Sn3 Sn3 6 13_456 162.67(2)
Zn1 Sn3 Sn3 6_455 13_456 90.378(16)
Ni2 Sn3 Sn3 10_556 13_556 110.90(2)
Ni1 Sn3 Sn3 . 13_556 56.768(16)
Ni3 Sn3 Sn3 9_566 13_556 101.57(2)
Ni2 Sn3 Sn3 2_565 13_556 136.623(13)
Ni1 Sn3 Sn3 13_456 13_556 112.69(2)
Ni1 Sn3 Sn3 13_556 13_556 51.514(15)
Zn1 Sn3 Sn3 6 13_556 90.378(16)
Zn1 Sn3 Sn3 6_455 13_556 162.67(2)
Sn3 Sn3 Sn3 13_456 13_556 83.58(2)
Ni2 Sn3 Sn2 10_556 . 54.69(2)
Ni1 Sn3 Sn2 . . 106.59(2)
Ni3 Sn3 Sn2 9_566 . 169.50(2)
Ni2 Sn3 Sn2 2_565 . 128.98(2)
Ni1 Sn3 Sn2 13_456 . 50.237(15)
Ni1 Sn3 Sn2 13_556 . 50.237(15)
Zn1 Sn3 Sn2 6 . 91.822(11)
Zn1 Sn3 Sn2 6_455 . 91.822(11)
Sn3 Sn3 Sn2 13_456 . 70.851(14)
Sn3 Sn3 Sn2 13_556 . 70.851(14)
Ni2 Sn3 Sn2 10_556 13_556 144.162(10)
Ni1 Sn3 Sn2 . 13_556 44.528(12)
Ni3 Sn3 Sn2 9_566 13_556 45.531(14)
Ni2 Sn3 Sn2 2_565 13_556 93.140(19)
Ni1 Sn3 Sn2 13_456 13_556 152.810(17)
Ni1 Sn3 Sn2 13_556 13_556 92.426(18)
Zn1 Sn3 Sn2 6 13_556 88.707(13)
Zn1 Sn3 Sn2 6_455 13_556 140.719(13)
Sn3 Sn3 Sn2 13_456 13_556 101.296(19)
Sn3 Sn3 Sn2 13_556 13_556 56.605(14)
Sn2 Sn3 Sn2 . 13_556 127.456(12)
Ni2 Sn3 Sn2 10_556 13_456 144.162(10)
Ni1 Sn3 Sn2 . 13_456 44.528(12)
Ni3 Sn3 Sn2 9_566 13_456 45.531(14)
Ni2 Sn3 Sn2 2_565 13_456 93.140(19)
Ni1 Sn3 Sn2 13_456 13_456 92.426(18)
Ni1 Sn3 Sn2 13_556 13_456 152.810(17)
Zn1 Sn3 Sn2 6 13_456 140.719(13)
Zn1 Sn3 Sn2 6_455 13_456 88.707(13)
Sn3 Sn3 Sn2 13_456 13_456 56.605(14)
Sn3 Sn3 Sn2 13_556 13_456 101.296(19)
Sn2 Sn3 Sn2 . 13_456 127.456(12)
Sn2 Sn3 Sn2 13_556 13_456 68.106(15)
Ni2 Sn3 Sn1 10_556 13_556 101.42(2)
Ni1 Sn3 Sn1 . 13_556 94.097(19)
Ni3 Sn3 Sn1 9_566 13_556 45.215(15)
Ni2 Sn3 Sn1 2_565 13_556 43.675(12)
Ni1 Sn3 Sn1 13_456 13_556 150.878(17)
Ni1 Sn3 Sn1 13_556 13_556 91.824(18)
Zn1 Sn3 Sn1 6 13_556 50.623(10)
Zn1 Sn3 Sn1 6_455 13_556 99.039(15)
Sn3 Sn3 Sn1 13_456 13_556 145.941(19)
Sn3 Sn3 Sn1 13_556 13_556 94.987(15)
Sn2 Sn3 Sn1 . 13_556 140.621(10)
Sn2 Sn3 Sn1 13_556 13_556 52.404(15)
Sn2 Sn3 Sn1 13_456 13_556 90.746(17)
Ni2 Sn3 Sn1 10_556 13_456 101.42(2)
Ni1 Sn3 Sn1 . 13_456 94.097(19)
Ni3 Sn3 Sn1 9_566 13_456 45.215(15)
Ni2 Sn3 Sn1 2_565 13_456 43.675(12)
Ni1 Sn3 Sn1 13_456 13_456 91.824(18)
Ni1 Sn3 Sn1 13_556 13_456 150.878(17)
Zn1 Sn3 Sn1 6 13_456 99.039(15)
Zn1 Sn3 Sn1 6_455 13_456 50.623(10)
Sn3 Sn3 Sn1 13_456 13_456 94.987(15)
Sn3 Sn3 Sn1 13_556 13_456 145.941(19)
Sn2 Sn3 Sn1 . 13_456 140.621(9)
Sn2 Sn3 Sn1 13_556 13_456 90.746(17)
Sn2 Sn3 Sn1 13_456 13_456 52.404(15)
Sn1 Sn3 Sn1 13_556 13_456 67.613(15)
Ni1 Zn1 Ni1 10_556 2_554 180.00(3)
Ni1 Zn1 Ni2 10_556 13_455 63.858(17)
Ni1 Zn1 Ni2 2_554 13_455 116.142(17)
Ni1 Zn1 Ni2 10_556 5_545 116.142(17)
Ni1 Zn1 Ni2 2_554 5_545 63.858(17)
Ni2 Zn1 Ni2 13_455 5_545 180.00(4)
Ni1 Zn1 Ni2 10_556 13 63.858(17)
Ni1 Zn1 Ni2 2_554 13 116.142(17)
Ni2 Zn1 Ni2 13_455 13 106.35(3)
Ni2 Zn1 Ni2 5_545 13 73.65(3)
Ni1 Zn1 Ni2 10_556 5_445 116.142(17)
Ni1 Zn1 Ni2 2_554 5_445 63.858(17)
Ni2 Zn1 Ni2 13_455 5_445 73.65(3)
Ni2 Zn1 Ni2 5_545 5_445 106.35(3)
Ni2 Zn1 Ni2 13 5_445 180.00(4)
Ni1 Zn1 Sn3 10_556 14_446 119.667(14)
Ni1 Zn1 Sn3 2_554 14_446 60.333(14)
Ni2 Zn1 Sn3 13_455 14_446 56.352(18)
Ni2 Zn1 Sn3 5_545 14_446 123.648(18)
Ni2 Zn1 Sn3 13 14_446 125.778(18)
Ni2 Zn1 Sn3 5_445 14_446 54.222(18)
Ni1 Zn1 Sn3 10_556 6_554 60.333(14)
Ni1 Zn1 Sn3 2_554 6_554 119.667(14)
Ni2 Zn1 Sn3 13_455 6_554 123.648(18)
Ni2 Zn1 Sn3 5_545 6_554 56.352(18)
Ni2 Zn1 Sn3 13 6_554 54.222(18)
Ni2 Zn1 Sn3 5_445 6_554 125.778(18)
Sn3 Zn1 Sn3 14_446 6_554 180.000(9)
Ni1 Zn1 Sn3 10_556 6_454 60.333(14)
Ni1 Zn1 Sn3 2_554 6_454 119.667(14)
Ni2 Zn1 Sn3 13_455 6_454 54.222(18)
Ni2 Zn1 Sn3 5_545 6_454 125.778(18)
Ni2 Zn1 Sn3 13 6_454 123.648(18)
Ni2 Zn1 Sn3 5_445 6_454 56.352(18)
Sn3 Zn1 Sn3 14_446 6_454 89.318(18)
Sn3 Zn1 Sn3 6_554 6_454 90.682(18)
Ni1 Zn1 Sn3 10_556 14_546 119.667(14)
Ni1 Zn1 Sn3 2_554 14_546 60.333(14)
Ni2 Zn1 Sn3 13_455 14_546 125.778(18)
Ni2 Zn1 Sn3 5_545 14_546 54.222(18)
Ni2 Zn1 Sn3 13 14_546 56.352(18)
Ni2 Zn1 Sn3 5_445 14_546 123.648(18)
Sn3 Zn1 Sn3 14_446 14_546 90.682(18)
Sn3 Zn1 Sn3 6_554 14_546 89.318(18)
Sn3 Zn1 Sn3 6_454 14_546 180.0
Ni1 Zn1 Sn1 10_556 . 119.74(2)
Ni1 Zn1 Sn1 2_554 . 60.26(2)
Ni2 Zn1 Sn1 13_455 . 124.849(15)
Ni2 Zn1 Sn1 5_545 . 55.151(15)
Ni2 Zn1 Sn1 13 . 124.849(15)
Ni2 Zn1 Sn1 5_445 . 55.151(15)
Sn3 Zn1 Sn1 14_446 . 100.824(9)
Sn3 Zn1 Sn1 6_554 . 79.176(9)
Sn3 Zn1 Sn1 6_454 . 79.176(9)
Sn3 Zn1 Sn1 14_546 . 100.824(9)
Ni1 Zn1 Sn1 10_556 9 60.26(2)
Ni1 Zn1 Sn1 2_554 9 119.74(2)
Ni2 Zn1 Sn1 13_455 9 55.151(15)
Ni2 Zn1 Sn1 5_545 9 124.849(15)
Ni2 Zn1 Sn1 13 9 55.151(15)
Ni2 Zn1 Sn1 5_445 9 124.849(15)
Sn3 Zn1 Sn1 14_446 9 79.176(9)
Sn3 Zn1 Sn1 6_554 9 100.824(9)
Sn3 Zn1 Sn1 6_454 9 100.824(9)
Sn3 Zn1 Sn1 14_546 9 79.176(9)
Sn1 Zn1 Sn1 . 9 180.0
Ni1 Zn1 Ni3 10_556 13_455 88.05(2)
Ni1 Zn1 Ni3 2_554 13_455 91.95(2)
Ni2 Zn1 Ni3 13_455 13_455 39.611(18)
Ni2 Zn1 Ni3 5_545 13_455 140.389(18)
Ni2 Zn1 Ni3 13 13_455 92.292(19)
Ni2 Zn1 Ni3 5_445 13_455 87.708(19)
Sn3 Zn1 Ni3 14_446 13_455 39.352(11)
Sn3 Zn1 Ni3 6_554 13_455 140.648(11)
Sn3 Zn1 Ni3 6_454 13_455 93.047(14)
Sn3 Zn1 Ni3 14_546 13_455 86.953(14)
Sn1 Zn1 Ni3 . 13_455 139.919(10)
Sn1 Zn1 Ni3 9 13_455 40.080(10)
Ni1 Zn1 Ni3 10_556 5_545 91.95(2)
Ni1 Zn1 Ni3 2_554 5_545 88.05(2)
Ni2 Zn1 Ni3 13_455 5_545 140.389(18)
Ni2 Zn1 Ni3 5_545 5_545 39.611(18)
Ni2 Zn1 Ni3 13 5_545 87.708(19)
Ni2 Zn1 Ni3 5_445 5_545 92.292(19)
Sn3 Zn1 Ni3 14_446 5_545 140.648(11)
Sn3 Zn1 Ni3 6_554 5_545 39.352(11)
Sn3 Zn1 Ni3 6_454 5_545 86.953(14)
Sn3 Zn1 Ni3 14_546 5_545 93.047(14)
Sn1 Zn1 Ni3 . 5_545 40.081(10)
Sn1 Zn1 Ni3 9 5_545 139.920(10)
Ni3 Zn1 Ni3 13_455 5_545 180.000(19)
Ni1 Zn1 Ni3 10_556 13 88.05(2)
Ni1 Zn1 Ni3 2_554 13 91.95(2)
Ni2 Zn1 Ni3 13_455 13 92.292(19)
Ni2 Zn1 Ni3 5_545 13 87.708(19)
Ni2 Zn1 Ni3 13 13 39.611(18)
Ni2 Zn1 Ni3 5_445 13 140.389(18)
Sn3 Zn1 Ni3 14_446 13 86.953(14)
Sn3 Zn1 Ni3 6_554 13 93.047(14)
Sn3 Zn1 Ni3 6_454 13 140.648(11)
Sn3 Zn1 Ni3 14_546 13 39.352(11)
Sn1 Zn1 Ni3 . 13 139.919(10)
Sn1 Zn1 Ni3 9 13 40.081(10)
Ni3 Zn1 Ni3 13_455 13 60.822(14)
Ni3 Zn1 Ni3 5_545 13 119.178(14)
Zn1 Ni1 Sn3 2 . 115.58(3)
Zn1 Ni1 Sn2 2 13_556 122.029(16)
Sn3 Ni1 Sn2 . 13_556 91.648(19)
Zn1 Ni1 Sn2 2 13_456 122.029(16)
Sn3 Ni1 Sn2 . 13_456 91.648(19)
Sn2 Ni1 Sn2 13_556 13_456 105.91(3)
Zn1 Ni1 Ni2 2 6_455 59.876(19)
Sn3 Ni1 Ni2 . 6_455 124.74(2)
Sn2 Ni1 Ni2 13_556 6_455 140.34(3)
Sn2 Ni1 Ni2 13_456 6_455 62.530(19)
Zn1 Ni1 Ni2 2 6 59.876(19)
Sn3 Ni1 Ni2 . 6 124.74(2)
Sn2 Ni1 Ni2 13_556 6 62.530(19)
Sn2 Ni1 Ni2 13_456 6 140.34(3)
Ni2 Ni1 Ni2 6_455 6 100.93(3)
Zn1 Ni1 Ni3 2 9_566 174.93(3)
Sn3 Ni1 Ni3 . 9_566 59.35(2)
Sn2 Ni1 Ni3 13_556 9_566 59.800(16)
Sn2 Ni1 Ni3 13_456 9_566 59.800(16)
Ni2 Ni1 Ni3 6_455 9_566 122.31(2)
Ni2 Ni1 Ni3 6 9_566 122.31(2)
Zn1 Ni1 Sn3 2 13_456 67.527(17)
Sn3 Ni1 Sn3 . 13_456 71.718(17)
Sn2 Ni1 Sn3 13_556 13_456 163.37(3)
Sn2 Ni1 Sn3 13_456 13_456 75.558(16)
Ni2 Ni1 Sn3 6_455 13_456 55.428(18)
Ni2 Ni1 Sn3 6 13_456 126.82(3)
Ni3 Ni1 Sn3 9_566 13_456 109.503(18)
Zn1 Ni1 Sn3 2 13_556 67.527(17)
Sn3 Ni1 Sn3 . 13_556 71.718(17)
Sn2 Ni1 Sn3 13_556 13_556 75.558(16)
Sn2 Ni1 Sn3 13_456 13_556 163.37(3)
Ni2 Ni1 Sn3 6_455 13_556 126.82(3)
Ni2 Ni1 Sn3 6 13_556 55.428(18)
Ni3 Ni1 Sn3 9_566 13_556 109.503(18)
Sn3 Ni1 Sn3 13_456 13_556 98.30(3)
Zn1 Ni1 Sn1 2 9_556 67.87(2)
Sn3 Ni1 Sn1 . 9_556 176.56(3)
Sn2 Ni1 Sn1 13_556 9_556 86.28(2)
Sn2 Ni1 Sn1 13_456 9_556 86.28(2)
Ni2 Ni1 Sn1 6_455 9_556 56.511(19)
Ni2 Ni1 Sn1 6 9_556 56.511(19)
Ni3 Ni1 Sn1 9_566 9_556 117.20(3)
Sn3 Ni1 Sn1 13_456 9_556 110.341(17)
Sn3 Ni1 Sn1 13_556 9_556 110.341(17)
Zn1 Ni1 Ni1 2 10_557 126.781(17)
Sn3 Ni1 Ni1 . 10_557 117.641(17)
Sn2 Ni1 Ni1 13_556 10_557 56.880(15)
Sn2 Ni1 Ni1 13_456 10_557 56.880(15)
Ni2 Ni1 Ni1 6_455 10_557 89.25(2)
Ni2 Ni1 Ni1 6 10_557 89.25(2)
Ni3 Ni1 Ni1 9_566 10_557 58.289(18)
Sn3 Ni1 Ni1 13_456 10_557 130.841(15)
Sn3 Ni1 Ni1 13_556 10_557 130.841(15)
Sn1 Ni1 Ni1 9_556 10_557 58.915(16)
Zn1 Ni1 Ni2 2 13_556 94.55(2)
Sn3 Ni1 Ni2 . 13_556 136.477(17)
Sn2 Ni1 Ni2 13_556 13_556 44.869(16)
Sn2 Ni1 Ni2 13_456 13_556 98.25(2)
Ni2 Ni1 Ni2 6_455 13_556 97.00(3)
Ni2 Ni1 Ni2 6 13_556 45.45(2)
Ni3 Ni1 Ni2 9_566 13_556 89.73(2)
Sn3 Ni1 Ni2 13_456 13_556 151.76(2)
Sn3 Ni1 Ni2 13_556 13_556 94.206(17)
Sn1 Ni1 Ni2 9_556 13_556 41.417(13)
Ni1 Ni1 Ni2 10_557 13_556 43.797(14)
Zn1 Ni1 Ni2 2 13_456 94.55(2)
Sn3 Ni1 Ni2 . 13_456 136.477(17)
Sn2 Ni1 Ni2 13_556 13_456 98.25(2)
Sn2 Ni1 Ni2 13_456 13_456 44.869(16)
Ni2 Ni1 Ni2 6_455 13_456 45.45(2)
Ni2 Ni1 Ni2 6 13_456 97.00(3)
Ni3 Ni1 Ni2 9_566 13_456 89.73(2)
Sn3 Ni1 Ni2 13_456 13_456 94.206(17)
Sn3 Ni1 Ni2 13_556 13_456 151.76(2)
Sn1 Ni1 Ni2 9_556 13_456 41.417(13)
Ni1 Ni1 Ni2 10_557 13_456 43.797(14)
Ni2 Ni1 Ni2 13_556 13_456 64.53(2)
Zn1 Ni1 Ni1 2 1_655 90.0
Sn3 Ni1 Ni1 . 1_655 90.0
Sn2 Ni1 Ni1 13_556 1_655 37.043(14)
Sn2 Ni1 Ni1 13_456 1_655 142.957(14)
Ni2 Ni1 Ni1 6_455 1_655 140.465(17)
Ni2 Ni1 Ni1 6 1_655 39.535(17)
Ni3 Ni1 Ni1 9_566 1_655 90.0
Sn3 Ni1 Ni1 13_456 1_655 139.152(15)
Sn3 Ni1 Ni1 13_556 1_655 40.848(15)
Sn1 Ni1 Ni1 9_556 1_655 90.0
Ni1 Ni1 Ni1 10_557 1_655 90.0
Ni2 Ni1 Ni1 13_556 1_655 57.736(10)
Ni2 Ni1 Ni1 13_456 1_655 122.264(10)
Zn1 Ni1 Ni1 2 1_455 90.0
Sn3 Ni1 Ni1 . 1_455 90.0
Sn2 Ni1 Ni1 13_556 1_455 142.957(14)
Sn2 Ni1 Ni1 13_456 1_455 37.043(14)
Ni2 Ni1 Ni1 6_455 1_455 39.535(17)
Ni2 Ni1 Ni1 6 1_455 140.465(17)
Ni3 Ni1 Ni1 9_566 1_455 90.0
Sn3 Ni1 Ni1 13_456 1_455 40.848(15)
Sn3 Ni1 Ni1 13_556 1_455 139.152(15)
Sn1 Ni1 Ni1 9_556 1_455 90.0
Ni1 Ni1 Ni1 10_557 1_455 90.0
Ni2 Ni1 Ni1 13_556 1_455 122.264(10)
Ni2 Ni1 Ni1 13_456 1_455 57.736(10)
Ni1 Ni1 Ni1 1_655 1_455 180.00(3)
Sn3 Ni2 Sn1 10_556 5 124.161(17)
Sn3 Ni2 Sn1 10_556 5_455 124.161(17)
Sn1 Ni2 Sn1 5 5_455 107.28(3)
Sn3 Ni2 Zn1 10_556 5_455 69.460(18)
Sn1 Ni2 Zn1 5 5_455 159.08(3)
Sn1 Ni2 Zn1 5_455 5_455 69.195(15)
Sn3 Ni2 Zn1 10_556 5 69.460(18)
Sn1 Ni2 Zn1 5 5 69.195(15)
Sn1 Ni2 Zn1 5_455 5 159.08(3)
Zn1 Ni2 Zn1 5_455 5 106.35(3)
Sn3 Ni2 Sn3 10_556 2_564 105.70(3)
Sn1 Ni2 Sn3 5 2_564 91.78(2)
Sn1 Ni2 Sn3 5_455 2_564 91.78(2)
Zn1 Ni2 Sn3 5_455 2_564 68.107(16)
Zn1 Ni2 Sn3 5 2_564 68.107(16)
Sn3 Ni2 Ni3 10_556 . 164.84(3)
Sn1 Ni2 Ni3 5 . 60.513(18)
Sn1 Ni2 Ni3 5_455 . 60.513(18)
Zn1 Ni2 Ni3 5_455 . 102.21(2)
Zn1 Ni2 Ni3 5 . 102.21(2)
Sn3 Ni2 Ni3 2_564 . 59.14(2)
Sn3 Ni2 Ni1 10_556 6_454 63.34(2)
Sn1 Ni2 Ni1 5 6_454 141.92(3)
Sn1 Ni2 Ni1 5_455 6_454 62.933(19)
Zn1 Ni2 Ni1 5_455 6_454 56.267(16)
Zn1 Ni2 Ni1 5 6_454 132.79(3)
Sn3 Ni2 Ni1 2_564 6_454 123.79(2)
Ni3 Ni2 Ni1 . 6_454 123.45(2)
Sn3 Ni2 Ni1 10_556 6_554 63.34(2)
Sn1 Ni2 Ni1 5 6_554 62.933(19)
Sn1 Ni2 Ni1 5_455 6_554 141.92(3)
Zn1 Ni2 Ni1 5_455 6_554 132.79(3)
Zn1 Ni2 Ni1 5 6_554 56.267(16)
Sn3 Ni2 Ni1 2_564 6_554 123.79(2)
Ni3 Ni2 Ni1 . 6_554 123.45(2)
Ni1 Ni2 Ni1 6_454 6_554 100.93(3)
Sn3 Ni2 Sn2 10_556 . 76.65(3)
Sn1 Ni2 Sn2 5 . 86.83(2)
Sn1 Ni2 Sn2 5_455 . 86.83(2)
Zn1 Ni2 Sn2 5_455 . 113.067(18)
Zn1 Ni2 Sn2 5 . 113.067(18)
Sn3 Ni2 Sn2 2_564 . 177.65(3)
Ni3 Ni2 Sn2 . . 118.51(3)
Ni1 Ni2 Sn2 6_454 . 57.116(19)
Ni1 Ni2 Sn2 6_554 . 57.116(19)
Sn3 Ni2 Ni2 10_556 10_556 136.36(2)
Sn1 Ni2 Ni2 5 10_556 57.479(15)
Sn1 Ni2 Ni2 5_455 10_556 57.479(15)
Zn1 Ni2 Ni2 5_455 10_556 126.107(15)
Zn1 Ni2 Ni2 5 10_556 126.107(15)
Sn3 Ni2 Ni2 2_564 10_556 117.936(18)
Ni3 Ni2 Ni2 . 10_556 58.800(19)
Ni1 Ni2 Ni2 6_454 10_556 90.75(2)
Ni1 Ni2 Ni2 6_554 10_556 90.75(2)
Sn2 Ni2 Ni2 . 10_556 59.713(16)
Sn3 Ni2 Ni2 10_556 9_565 54.17(2)
Sn1 Ni2 Ni2 5 9_565 118.87(2)
Sn1 Ni2 Ni2 5_455 9_565 118.87(2)
Zn1 Ni2 Ni2 5_455 9_565 53.174(15)
Zn1 Ni2 Ni2 5 9_565 53.174(15)
Sn3 Ni2 Ni2 2_564 9_565 51.53(2)
Ni3 Ni2 Ni2 . 9_565 110.67(4)
Ni1 Ni2 Ni2 6_454 9_565 95.94(3)
Ni1 Ni2 Ni2 6_554 9_565 95.94(3)
Sn2 Ni2 Ni2 . 9_565 130.82(4)
Ni2 Ni2 Ni2 10_556 9_565 169.47(3)
Sn3 Ni2 Ni1 10_556 13_556 102.61(3)
Sn1 Ni2 Ni1 5 13_556 44.938(17)
Sn1 Ni2 Ni1 5_455 13_556 98.74(3)
Zn1 Ni2 Ni1 5_455 13_556 154.28(2)
Zn1 Ni2 Ni1 5 13_556 92.655(16)
Sn3 Ni2 Ni1 2_564 13_556 136.662(19)
Ni3 Ni2 Ni1 . 13_556 90.16(2)
Ni1 Ni2 Ni1 6_454 13_556 98.10(3)
Ni1 Ni2 Ni1 6_554 13_556 46.95(2)
Sn2 Ni2 Ni1 . 13_556 41.892(12)
Ni2 Ni2 Ni1 10_556 13_556 43.797(14)
Ni2 Ni2 Ni1 9_565 13_556 142.20(2)
Sn3 Ni2 Ni1 10_556 13_456 102.61(3)
Sn1 Ni2 Ni1 5 13_456 98.74(3)
Sn1 Ni2 Ni1 5_455 13_456 44.938(17)
Zn1 Ni2 Ni1 5_455 13_456 92.655(16)
Zn1 Ni2 Ni1 5 13_456 154.28(2)
Sn3 Ni2 Ni1 2_564 13_456 136.662(19)
Ni3 Ni2 Ni1 . 13_456 90.16(2)
Ni1 Ni2 Ni1 6_454 13_456 46.95(2)
Ni1 Ni2 Ni1 6_554 13_456 98.10(3)
Sn2 Ni2 Ni1 . 13_456 41.892(12)
Ni2 Ni2 Ni1 10_556 13_456 43.797(14)
Ni2 Ni2 Ni1 9_565 13_456 142.20(2)
Ni1 Ni2 Ni1 13_556 13_456 64.53(2)
Sn3 Ni2 Ni2 10_556 1_655 90.0
Sn1 Ni2 Ni2 5 1_655 36.359(15)
Sn1 Ni2 Ni2 5_455 1_655 143.641(15)
Zn1 Ni2 Ni2 5_455 1_655 143.174(15)
Zn1 Ni2 Ni2 5 1_655 36.826(15)
Sn3 Ni2 Ni2 2_564 1_655 90.0
Ni3 Ni2 Ni2 . 1_655 90.0
Ni1 Ni2 Ni2 6_454 1_655 140.465(17)
Ni1 Ni2 Ni2 6_554 1_655 39.535(17)
Sn2 Ni2 Ni2 . 1_655 90.0
Ni2 Ni2 Ni2 10_556 1_655 90.0
Ni2 Ni2 Ni2 9_565 1_655 90.0
Ni1 Ni2 Ni2 13_556 1_655 57.736(10)
Ni1 Ni2 Ni2 13_456 1_655 122.264(10)
Sn3 Ni3 Sn3 2_564 9_566 178.91(4)
Sn3 Ni3 Sn2 2_564 5 89.661(12)
Sn3 Ni3 Sn2 9_566 5 89.661(12)
Sn3 Ni3 Sn2 2_564 5_455 89.661(12)
Sn3 Ni3 Sn2 9_566 5_455 89.661(12)
Sn2 Ni3 Sn2 5 5_455 103.38(3)
Sn3 Ni3 Sn1 2_564 5_455 90.339(12)
Sn3 Ni3 Sn1 9_566 5_455 90.339(12)
Sn2 Ni3 Sn1 5 5_455 179.93(3)
Sn2 Ni3 Sn1 5_455 5_455 76.692(19)
Sn3 Ni3 Sn1 2_564 5 90.339(12)
Sn3 Ni3 Sn1 9_566 5 90.339(12)
Sn2 Ni3 Sn1 5 5 76.692(19)
Sn2 Ni3 Sn1 5_455 5 179.93(3)
Sn1 Ni3 Sn1 5_455 5 103.24(4)
Sn3 Ni3 Ni2 2_564 . 59.35(2)
Sn3 Ni3 Ni2 9_566 . 121.75(3)
Sn2 Ni3 Ni2 5 . 122.024(14)
Sn2 Ni3 Ni2 5_455 . 122.024(14)
Sn1 Ni3 Ni2 5_455 . 57.922(19)
Sn1 Ni3 Ni2 5 . 57.922(19)
Sn3 Ni3 Ni2 2_564 10_556 121.75(3)
Sn3 Ni3 Ni2 9_566 10_556 59.35(2)
Sn2 Ni3 Ni2 5 10_556 122.024(14)
Sn2 Ni3 Ni2 5_455 10_556 122.024(14)
Sn1 Ni3 Ni2 5_455 10_556 57.922(19)
Sn1 Ni3 Ni2 5 10_556 57.922(19)
Ni2 Ni3 Ni2 . 10_556 62.40(4)
Sn3 Ni3 Ni1 2_564 9_566 121.16(3)
Sn3 Ni3 Ni1 9_566 9_566 57.74(2)
Sn2 Ni3 Ni1 5 9_566 58.171(18)
Sn2 Ni3 Ni1 5_455 9_566 58.171(18)
Sn1 Ni3 Ni1 5_455 9_566 121.883(14)
Sn1 Ni3 Ni1 5 9_566 121.883(14)
Ni2 Ni3 Ni1 . 9_566 179.49(3)
Ni2 Ni3 Ni1 10_556 9_566 117.09(3)
Sn3 Ni3 Ni1 2_564 2_564 57.74(2)
Sn3 Ni3 Ni1 9_566 2_564 121.16(3)
Sn2 Ni3 Ni1 5 2_564 58.171(18)
Sn2 Ni3 Ni1 5_455 2_564 58.171(18)
Sn1 Ni3 Ni1 5_455 2_564 121.883(14)
Sn1 Ni3 Ni1 5 2_564 121.883(14)
Ni2 Ni3 Ni1 . 2_564 117.09(3)
Ni2 Ni3 Ni1 10_556 2_564 179.49(3)
Ni1 Ni3 Ni1 9_566 2_564 63.42(4)
Sn3 Ni3 Zn1 2_564 5_455 45.098(11)
Sn3 Ni3 Zn1 9_566 5_455 135.66(2)
Sn2 Ni3 Zn1 5 5_455 134.439(8)
Sn2 Ni3 Zn1 5_455 5_455 84.593(12)
Sn1 Ni3 Zn1 5_455 5_455 45.554(9)
Sn1 Ni3 Zn1 5 5_455 95.36(2)
Ni2 Ni3 Zn1 . 5_455 38.176(11)
Ni2 Ni3 Zn1 10_556 5_455 87.14(2)
Ni1 Ni3 Zn1 9_566 5_455 142.116(16)
Ni1 Ni3 Zn1 2_564 5_455 92.420(17)
Sn3 Ni3 Zn1 2_564 6 135.66(2)
Sn3 Ni3 Zn1 9_566 6 45.098(11)
Sn2 Ni3 Zn1 5 6 84.593(12)
Sn2 Ni3 Zn1 5_455 6 134.439(8)
Sn1 Ni3 Zn1 5_455 6 95.36(2)
Sn1 Ni3 Zn1 5 6 45.554(9)
Ni2 Ni3 Zn1 . 6 87.14(2)
Ni2 Ni3 Zn1 10_556 6 38.176(11)
Ni1 Ni3 Zn1 9_566 6 92.420(17)
Ni1 Ni3 Zn1 2_564 6 142.116(16)
Zn1 Ni3 Zn1 5_455 6 121.49(2)
Sn3 Ni3 Zn1 2_564 5 45.098(11)
Sn3 Ni3 Zn1 9_566 5 135.66(2)
Sn2 Ni3 Zn1 5 5 84.593(12)
Sn2 Ni3 Zn1 5_455 5 134.439(7)
Sn1 Ni3 Zn1 5_455 5 95.36(2)
Sn1 Ni3 Zn1 5 5 45.554(9)
Ni2 Ni3 Zn1 . 5 38.176(11)
Ni2 Ni3 Zn1 10_556 5 87.14(2)
Ni1 Ni3 Zn1 9_566 5 142.116(16)
Ni1 Ni3 Zn1 2_564 5 92.420(17)
Zn1 Ni3 Zn1 5_455 5 60.822(14)
Zn1 Ni3 Zn1 6 5 90.566(18)
Sn3 Ni3 Zn1 2_564 6_455 135.66(2)
Sn3 Ni3 Zn1 9_566 6_455 45.098(11)
Sn2 Ni3 Zn1 5 6_455 134.439(7)
Sn2 Ni3 Zn1 5_455 6_455 84.593(12)
Sn1 Ni3 Zn1 5_455 6_455 45.554(9)
Sn1 Ni3 Zn1 5 6_455 95.36(2)
Ni2 Ni3 Zn1 . 6_455 87.14(2)
Ni2 Ni3 Zn1 10_556 6_455 38.176(11)
Ni1 Ni3 Zn1 9_566 6_455 92.420(17)
Ni1 Ni3 Zn1 2_564 6_455 142.116(16)
Zn1 Ni3 Zn1 5_455 6_455 90.566(18)
Zn1 Ni3 Zn1 6 6_455 60.822(14)
Zn1 Ni3 Zn1 5 6_455 121.49(2)
Sn3 Ni3 Ni3 2_564 1_655 90.0
Sn3 Ni3 Ni3 9_566 1_655 90.0
Sn2 Ni3 Ni3 5 1_655 38.311(17)
Sn2 Ni3 Ni3 5_455 1_655 141.689(17)
Sn1 Ni3 Ni3 5_455 1_655 141.620(18)
Sn1 Ni3 Ni3 5 1_655 38.380(18)
Ni2 Ni3 Ni3 . 1_655 90.0
Ni2 Ni3 Ni3 10_556 1_655 90.0
Ni1 Ni3 Ni3 9_566 1_655 90.0
Ni1 Ni3 Ni3 2_564 1_655 90.0
Zn1 Ni3 Ni3 5_455 1_655 120.411(7)
Zn1 Ni3 Ni3 6 1_655 59.589(7)
Zn1 Ni3 Ni3 5 1_655 59.589(7)
Zn1 Ni3 Ni3 6_455 1_655 120.411(7)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
Sn1 Ni2 5_445 2.5779(6)
Sn1 Ni2 14_546 2.5779(6)
Sn1 Ni2 14_446 2.5779(6)
Sn1 Ni2 5_545 2.5779(6)
Sn1 Ni3 5_545 2.6483(7)
Sn1 Ni3 5_445 2.6483(7)
Sn1 Ni1 2_554 2.7525(8)
Sn1 Ni1 9_556 2.7525(8)
Sn1 Zn1 . 2.9364(6)
Sn1 Zn1 2 2.9364(6)
Sn1 Sn2 . 3.2845(9)
Sn1 Sn2 5_445 3.6623(8)
Sn1 Sn2 5_545 3.6623(8)
Sn1 Sn3 13_556 3.7312(6)
Sn1 Sn3 6_454 3.7312(6)
Sn2 Ni1 13_556 2.6009(5)
Sn2 Ni1 6_454 2.6009(5)
Sn2 Ni1 6_554 2.6009(5)
Sn2 Ni1 13_456 2.6009(5)
Sn2 Ni3 5_445 2.6458(7)
Sn2 Ni3 5_545 2.6458(7)
Sn2 Ni2 10_556 2.7480(9)
Sn2 Ni2 . 2.7480(9)
Sn2 Sn3 . 3.2766(7)
Sn2 Sn3 10_556 3.2766(7)
Sn2 Sn1 5 3.6623(8)
Sn2 Sn1 5_455 3.6623(8)
Sn2 Sn3 6_454 3.7074(6)
Sn2 Sn3 13_556 3.7074(6)
Sn3 Ni2 10_556 2.5286(9)
Sn3 Ni1 . 2.5682(8)
Sn3 Ni3 9_566 2.6127(6)
Sn3 Ni2 2_565 2.6185(9)
Sn3 Ni1 13_456 2.7444(6)
Sn3 Ni1 13_556 2.7444(6)
Sn3 Zn1 6 2.9186(5)
Sn3 Zn1 6_455 2.9186(5)
Sn3 Sn3 13_456 3.1154(6)
Sn3 Sn3 13_556 3.1154(6)
Sn3 Sn2 13_556 3.7074(6)
Sn3 Sn2 13_456 3.7074(6)
Sn3 Sn1 13_556 3.7312(6)
Sn3 Sn1 13_456 3.7312(6)
Zn1 Ni1 10_556 2.4937(7)
Zn1 Ni1 2_554 2.4937(7)
Zn1 Ni2 13_455 2.5935(6)
Zn1 Ni2 5_545 2.5935(6)
Zn1 Ni2 13 2.5935(6)
Zn1 Ni2 5_445 2.5935(6)
Zn1 Sn3 14_446 2.9186(5)
Zn1 Sn3 6_554 2.9186(5)
Zn1 Sn3 6_454 2.9186(5)
Zn1 Sn3 14_546 2.9186(5)
Zn1 Sn1 9 2.9364(6)
Zn1 Ni3 13_455 4.1012(6)
Zn1 Ni3 5_545 4.1012(6)
Zn1 Ni3 13 4.1012(6)
Ni1 Zn1 2 2.4937(7)
Ni1 Sn2 13_556 2.6009(5)
Ni1 Sn2 13_456 2.6009(5)
Ni1 Ni2 6_455 2.6918(7)
Ni1 Ni2 6 2.6918(7)
Ni1 Ni3 9_566 2.7037(10)
Ni1 Sn3 13_456 2.7444(6)
Ni1 Sn3 13_556 2.7444(6)
Ni1 Sn1 9_556 2.7525(8)
Ni1 Ni1 10_557 2.8423(15)
Ni1 Ni2 13_556 3.8889(10)
Ni1 Ni2 13_456 3.8889(10)
Ni1 Ni1 1_655 4.1520(8)
Ni1 Ni1 1_455 4.1520(8)
Ni2 Sn3 10_556 2.5286(9)
Ni2 Sn1 5 2.5779(6)
Ni2 Sn1 5_455 2.5779(6)
Ni2 Zn1 5_455 2.5935(6)
Ni2 Zn1 5 2.5935(6)
Ni2 Sn3 2_564 2.6185(9)
Ni2 Ni3 . 2.6754(10)
Ni2 Ni1 6_454 2.6918(7)
Ni2 Ni1 6_554 2.6918(7)
Ni2 Ni2 10_556 2.7718(15)
Ni2 Ni2 9_565 3.1091(15)
Ni2 Ni1 13_556 3.8889(10)
Ni2 Ni1 13_456 3.8889(10)
Ni2 Ni2 1_655 4.1520(8)
Ni3 Sn3 2_564 2.6127(6)
Ni3 Sn3 9_566 2.6127(6)
Ni3 Sn2 5 2.6458(7)
Ni3 Sn2 5_455 2.6458(7)
Ni3 Sn1 5_455 2.6483(7)
Ni3 Sn1 5 2.6483(7)
Ni3 Ni2 10_556 2.6754(10)
Ni3 Ni1 9_566 2.7036(10)
Ni3 Ni1 2_564 2.7036(10)
Ni3 Zn1 5_455 4.1012(6)
Ni3 Zn1 6 4.1012(6)
Ni3 Zn1 5 4.1012(6)
Ni3 Zn1 6_455 4.1012(6)
Ni3 Ni3 1_655 4.1520(8)
