#------------------------------------------------------------------------------
#$Date: 2018-02-15 09:31:26 +0200 (Thu, 15 Feb 2018) $
#$Revision: 206451 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/02/10/2021012.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_2021012
loop_
_publ_author_name
'Ptashkina, Evgeniya A.'
'Kabanova, Elizaveta G.'
'Tursina, Anna I.'
'Yatsenko, Alexandr V.'
'Kuznetsov, Victor N.'
_publ_section_title
;
 Synthesis and crystal structure of a new Cu₃Au-type ternary phase in
 the Au--In--Pd system: distribution of atoms over crystallographic
 positions
;
_journal_coeditor_code           QP3003
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section C'
_journal_page_first
;
;
_journal_paper_doi               10.1107/S2053229618001973
_journal_volume                  74
_journal_year                    2018
_chemical_formula_iupac          'Au1.23 In0.93 Pd1.84'
_chemical_formula_sum            'Au1.23 In0.93 Pd1.84'
_chemical_formula_weight         545.03
_chemical_name_systematic
;
Gold indium dipalladium
;
_space_group_crystal_system      cubic
_space_group_IT_number           221
_space_group_name_Hall           '-P 4 2 3'
_space_group_name_H-M_alt        'P m -3 m'
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_audit_creation_method           SHELXL-2014/6
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   4.0340(6)
_cell_length_b                   4.0340(6)
_cell_length_c                   4.0340(6)
_cell_measurement_reflns_used    24
_cell_measurement_temperature    295(2)
_cell_measurement_theta_max      23.18
_cell_measurement_theta_min      23.13
_cell_volume                     65.646(17)
_computing_data_collection
;
CAD-4 Diffractometer Control Software (Enraf--Nonius, 1993)
;
_computing_data_reduction
;
PROFIT (Strel'tsov & Zavodnik, 1989)
;
_computing_molecular_graphics
;
DIAMOND (Brandenburg, 2007)
;
_computing_publication_material
;
publCIF (Westrip, 2010)
;
_computing_structure_refinement
;
SHELXL2014 (Sheldrick, 2015)
;
_diffrn_ambient_temperature      295(2)
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Nonius CAD-4'
_diffrn_measurement_method       'profile data from omega scans'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0550
_diffrn_reflns_limit_h_max       8
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       8
_diffrn_reflns_limit_k_min       -8
_diffrn_reflns_limit_l_max       8
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            1152
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         44.809
_diffrn_reflns_theta_min         5.054
_diffrn_standards_decay_%        0
_diffrn_standards_interval_time  120
_diffrn_standards_number         2
_exptl_absorpt_coefficient_mu    88.688
_exptl_absorpt_correction_T_max  0.268
_exptl_absorpt_correction_T_min  0.108
_exptl_absorpt_correction_type   empirical
_exptl_absorpt_process_details
;
[psi-scan (North et al., 1968) followed by multiscan (Blessing,
1995)]
;
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    13.787
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       'irregular block'
_exptl_crystal_F_000             227
_exptl_crystal_size_max          0.045
_exptl_crystal_size_mid          0.040
_exptl_crystal_size_min          0.035
_refine_diff_density_max         2.235
_refine_diff_density_min         -1.836
_refine_ls_extinction_coef       0.019(5)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method
;
SHELXL2014 (Sheldrick, 2015)
;
_refine_ls_goodness_of_fit_ref   1.091
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     7
_refine_ls_number_reflns         79
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.084
_refine_ls_R_factor_all          0.0223
_refine_ls_R_factor_gt           0.0218
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0397P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0711
_refine_ls_wR_factor_ref         0.0713
_reflns_number_gt                74
_reflns_number_total             79
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            qp3003sup1.cif
_cod_data_source_block           1A
_cod_original_cell_volume        65.65(3)
_cod_database_code               2021012
_shelx_space_group_comment
;
The symmetry employed for this shelxl refinement is uniquely defined
by the following loop, which should always be used as a source of
symmetry information in preference to the above space-group names.
They are only intended as comments.
;
_shelx_estimated_absorpt_t_max   0.268
_shelxl_version_number           2014/6
loop_
_space_group_symop_operation_xyz
'x, y, z'
'x, -y, -z'
'-x, -y, z'
'-x, y, -z'
'-y, x, z'
'y, x, -z'
'y, -x, z'
'-y, -x, -z'
'y, z, x'
'-y, -z, x'
'y, -z, -x'
'-y, z, -x'
'-z, y, x'
'-z, -y, -x'
'z, -y, x'
'z, y, -x'
'z, x, y'
'-z, x, -y'
'-z, -x, y'
'z, -x, -y'
'-x, -z, -y'
'-x, z, y'
'x, -z, y'
'x, z, -y'
'-x, -y, -z'
'-x, y, z'
'x, y, -z'
'x, -y, z'
'y, -x, -z'
'-y, -x, z'
'-y, x, -z'
'y, x, z'
'-y, -z, -x'
'y, z, -x'
'-y, z, x'
'y, -z, x'
'z, -y, -x'
'z, y, x'
'-z, y, -x'
'-z, -y, x'
'-z, -x, -y'
'z, -x, y'
'z, x, -y'
'-z, x, y'
'x, z, y'
'x, -z, -y'
'-x, z, -y'
'-x, -z, y'
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_occupancy
Pd Pd2 0.0000 0.0000 0.0000 0.0180(4) Uani d 0.88(7)
In In1 0.0000 0.0000 0.0000 0.0180(4) Uani d 0.12(7)
Au Au3 0.0000 0.5000 0.5000 0.0162(3) Uani d 0.4106
Pd Pd4 0.0000 0.5000 0.5000 0.0162(3) Uani d 0.32(2)
In In5 0.0000 0.5000 0.5000 0.0162(3) Uani d 0.27(2)
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Au Au -2.0133 8.8022 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Pd Pd -0.9988 1.0072 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
In In -0.7276 1.3100 '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
In5 Pd2 Au3 9 . 60.0
In5 Pd2 Pd4 9 . 60.0
Au3 Pd2 Pd4 . . 0.0
In5 Pd2 In5 9 . 60.0
Au3 Pd2 In5 . . 0.0
Pd4 Pd2 In5 . . 0.0
In5 Pd2 Au3 9 1_544 120.0
Au3 Pd2 Au3 . 1_544 180.0
Pd4 Pd2 Au3 . 1_544 180.0
In5 Pd2 Au3 . 1_544 180.0
In5 Pd2 In5 9 9_445 180.0
Au3 Pd2 In5 . 9_445 120.0
Pd4 Pd2 In5 . 9_445 120.0
In5 Pd2 In5 . 9_445 120.0
Au3 Pd2 In5 1_544 9_445 60.0
In5 Pd2 In5 9 5_655 60.0
Au3 Pd2 In5 . 5_655 60.0
Pd4 Pd2 In5 . 5_655 60.0
In5 Pd2 In5 . 5_655 60.0
Au3 Pd2 In5 1_544 5_655 120.0
In5 Pd2 In5 9_445 5_655 120.0
In5 Pd2 Au3 9 5_554 120.0
Au3 Pd2 Au3 . 5_554 120.0
Pd4 Pd2 Au3 . 5_554 120.0
In5 Pd2 Au3 . 5_554 120.0
Au3 Pd2 Au3 1_544 5_554 60.0
In5 Pd2 Au3 9_445 5_554 60.0
In5 Pd2 Au3 5_655 5_554 180.0
In5 Pd2 In5 9 5_554 120.0
Au3 Pd2 In5 . 5_554 120.0
Pd4 Pd2 In5 . 5_554 120.0
In5 Pd2 In5 . 5_554 120.0
Au3 Pd2 In5 1_544 5_554 60.0
In5 Pd2 In5 9_445 5_554 60.0
In5 Pd2 In5 5_655 5_554 180.0
Au3 Pd2 In5 5_554 5_554 0.0
In5 Pd2 In5 9 1_544 120.0
Au3 Pd2 In5 . 1_544 180.0
Pd4 Pd2 In5 . 1_544 180.0
In5 Pd2 In5 . 1_544 180.0
Au3 Pd2 In5 1_544 1_544 0.0
In5 Pd2 In5 9_445 1_544 60.0
In5 Pd2 In5 5_655 1_544 120.0
Au3 Pd2 In5 5_554 1_544 60.0
In5 Pd2 In5 5_554 1_544 60.0
In5 Pd2 Au3 9 5_655 60.0
Au3 Pd2 Au3 . 5_655 60.0
Pd4 Pd2 Au3 . 5_655 60.0
In5 Pd2 Au3 . 5_655 60.0
Au3 Pd2 Au3 1_544 5_655 120.0
In5 Pd2 Au3 9_445 5_655 120.0
In5 Pd2 Au3 5_655 5_655 0.0
Au3 Pd2 Au3 5_554 5_655 180.0
In5 Pd2 Au3 5_554 5_655 180.0
In5 Pd2 Au3 1_544 5_655 120.0
In5 Pd2 Au3 9 9_445 180.0
Au3 Pd2 Au3 . 9_445 120.0
Pd4 Pd2 Au3 . 9_445 120.0
In5 Pd2 Au3 . 9_445 120.0
Au3 Pd2 Au3 1_544 9_445 60.0
In5 Pd2 Au3 9_445 9_445 0.0
In5 Pd2 Au3 5_655 9_445 120.0
Au3 Pd2 Au3 5_554 9_445 60.0
In5 Pd2 Au3 5_554 9_445 60.0
In5 Pd2 Au3 1_544 9_445 60.0
Au3 Pd2 Au3 5_655 9_445 120.0
In5 In1 Au3 9 . 60.0
In5 In1 Pd4 9 . 60.0
Au3 In1 Pd4 . . 0.0
In5 In1 In5 9 . 60.0
Au3 In1 In5 . . 0.0
Pd4 In1 In5 . . 0.0
In5 In1 Au3 9 1_544 120.0
Au3 In1 Au3 . 1_544 180.0
Pd4 In1 Au3 . 1_544 180.0
In5 In1 Au3 . 1_544 180.0
In5 In1 In5 9 9_445 180.0
Au3 In1 In5 . 9_445 120.0
Pd4 In1 In5 . 9_445 120.0
In5 In1 In5 . 9_445 120.0
Au3 In1 In5 1_544 9_445 60.0
In5 In1 In5 9 5_655 60.0
Au3 In1 In5 . 5_655 60.0
Pd4 In1 In5 . 5_655 60.0
In5 In1 In5 . 5_655 60.0
Au3 In1 In5 1_544 5_655 120.0
In5 In1 In5 9_445 5_655 120.0
In5 In1 Au3 9 5_554 120.0
Au3 In1 Au3 . 5_554 120.0
Pd4 In1 Au3 . 5_554 120.0
In5 In1 Au3 . 5_554 120.0
Au3 In1 Au3 1_544 5_554 60.0
In5 In1 Au3 9_445 5_554 60.0
In5 In1 Au3 5_655 5_554 180.0
In5 In1 In5 9 5_554 120.0
Au3 In1 In5 . 5_554 120.0
Pd4 In1 In5 . 5_554 120.0
In5 In1 In5 . 5_554 120.0
Au3 In1 In5 1_544 5_554 60.0
In5 In1 In5 9_445 5_554 60.0
In5 In1 In5 5_655 5_554 180.0
Au3 In1 In5 5_554 5_554 0.0
In5 In1 In5 9 1_544 120.0
Au3 In1 In5 . 1_544 180.0
Pd4 In1 In5 . 1_544 180.0
In5 In1 In5 . 1_544 180.0
Au3 In1 In5 1_544 1_544 0.0
In5 In1 In5 9_445 1_544 60.0
In5 In1 In5 5_655 1_544 120.0
Au3 In1 In5 5_554 1_544 60.0
In5 In1 In5 5_554 1_544 60.0
In5 In1 Au3 9 5_655 60.0
Au3 In1 Au3 . 5_655 60.0
Pd4 In1 Au3 . 5_655 60.0
In5 In1 Au3 . 5_655 60.0
Au3 In1 Au3 1_544 5_655 120.0
In5 In1 Au3 9_445 5_655 120.0
In5 In1 Au3 5_655 5_655 0.0
Au3 In1 Au3 5_554 5_655 180.0
In5 In1 Au3 5_554 5_655 180.0
In5 In1 Au3 1_544 5_655 120.0
In5 In1 Au3 9 9_445 180.0
Au3 In1 Au3 . 9_445 120.0
Pd4 In1 Au3 . 9_445 120.0
In5 In1 Au3 . 9_445 120.0
Au3 In1 Au3 1_544 9_445 60.0
In5 In1 Au3 9_445 9_445 0.0
In5 In1 Au3 5_655 9_445 120.0
Au3 In1 Au3 5_554 9_445 60.0
In5 In1 Au3 5_554 9_445 60.0
In5 In1 Au3 1_544 9_445 60.0
Au3 In1 Au3 5_655 9_445 120.0
In5 Au3 Pd2 9_556 . 120.0
In5 Au3 In1 9_556 . 120.0
Pd2 Au3 In1 . . 0.0
In5 Au3 In5 9_556 9_455 180.0
Pd2 Au3 In5 . 9_455 60.0
In1 Au3 In5 . 9_455 60.0
In5 Au3 In5 9_556 5_665 60.0
Pd2 Au3 In5 . 5_665 120.0
In1 Au3 In5 . 5_665 120.0
In5 Au3 In5 9_455 5_665 120.0
In5 Au3 Pd2 9_556 1_566 60.0
Pd2 Au3 Pd2 . 1_566 180.0
In1 Au3 Pd2 . 1_566 180.0
In5 Au3 Pd2 9_455 1_566 120.0
In5 Au3 Pd2 5_665 1_566 60.0
In5 Au3 In5 9_556 5 120.0
Pd2 Au3 In5 . 5 60.0
In1 Au3 In5 . 5 60.0
In5 Au3 In5 9_455 5 60.0
In5 Au3 In5 5_665 5 180.0
Pd2 Au3 In5 1_566 5 120.0
In5 Au3 Pd4 9_556 9_556 0.0
Pd2 Au3 Pd4 . 9_556 120.0
In1 Au3 Pd4 . 9_556 120.0
In5 Au3 Pd4 9_455 9_556 180.0
In5 Au3 Pd4 5_665 9_556 60.0
Pd2 Au3 Pd4 1_566 9_556 60.0
In5 Au3 Pd4 5 9_556 120.0
In5 Au3 In1 9_556 1_566 60.0
Pd2 Au3 In1 . 1_566 180.0
In1 Au3 In1 . 1_566 180.0
In5 Au3 In1 9_455 1_566 120.0
In5 Au3 In1 5_665 1_566 60.0
Pd2 Au3 In1 1_566 1_566 0.0
In5 Au3 In1 5 1_566 120.0
Pd4 Au3 In1 9_556 1_566 60.0
In5 Au3 Au3 9_556 5 120.0
Pd2 Au3 Au3 . 5 60.0
In1 Au3 Au3 . 5 60.0
In5 Au3 Au3 9_455 5 60.0
In5 Au3 Au3 5_665 5 180.0
Pd2 Au3 Au3 1_566 5 120.0
In5 Au3 Au3 5 5 0.0
Pd4 Au3 Au3 9_556 5 120.0
In1 Au3 Au3 1_566 5 120.0
In5 Au3 Pd4 9_556 9_455 180.0
Pd2 Au3 Pd4 . 9_455 60.0
In1 Au3 Pd4 . 9_455 60.0
In5 Au3 Pd4 9_455 9_455 0.0
In5 Au3 Pd4 5_665 9_455 120.0
Pd2 Au3 Pd4 1_566 9_455 120.0
In5 Au3 Pd4 5 9_455 60.0
Pd4 Au3 Pd4 9_556 9_455 180.0
In1 Au3 Pd4 1_566 9_455 120.0
Au3 Au3 Pd4 5 9_455 60.0
In5 Au3 Pd4 9_556 5_665 60.0
Pd2 Au3 Pd4 . 5_665 120.0
In1 Au3 Pd4 . 5_665 120.0
In5 Au3 Pd4 9_455 5_665 120.0
In5 Au3 Pd4 5_665 5_665 0.0
Pd2 Au3 Pd4 1_566 5_665 60.0
In5 Au3 Pd4 5 5_665 180.0
Pd4 Au3 Pd4 9_556 5_665 60.0
In1 Au3 Pd4 1_566 5_665 60.0
Au3 Au3 Pd4 5 5_665 180.0
Pd4 Au3 Pd4 9_455 5_665 120.0
In5 Pd4 Pd2 9_556 . 120.0
In5 Pd4 In1 9_556 . 120.0
Pd2 Pd4 In1 . . 0.0
In5 Pd4 In5 9_556 9_455 180.0
Pd2 Pd4 In5 . 9_455 60.0
In1 Pd4 In5 . 9_455 60.0
In5 Pd4 In5 9_556 5_665 60.0
Pd2 Pd4 In5 . 5_665 120.0
In1 Pd4 In5 . 5_665 120.0
In5 Pd4 In5 9_455 5_665 120.0
In5 Pd4 Pd2 9_556 1_566 60.0
Pd2 Pd4 Pd2 . 1_566 180.0
In1 Pd4 Pd2 . 1_566 180.0
In5 Pd4 Pd2 9_455 1_566 120.0
In5 Pd4 Pd2 5_665 1_566 60.0
In5 Pd4 In5 9_556 5 120.0
Pd2 Pd4 In5 . 5 60.0
In1 Pd4 In5 . 5 60.0
In5 Pd4 In5 9_455 5 60.0
In5 Pd4 In5 5_665 5 180.0
Pd2 Pd4 In5 1_566 5 120.0
In5 Pd4 Pd4 9_556 9_556 0.0
Pd2 Pd4 Pd4 . 9_556 120.0
In1 Pd4 Pd4 . 9_556 120.0
In5 Pd4 Pd4 9_455 9_556 180.0
In5 Pd4 Pd4 5_665 9_556 60.0
Pd2 Pd4 Pd4 1_566 9_556 60.0
In5 Pd4 Pd4 5 9_556 120.0
In5 Pd4 In1 9_556 1_566 60.0
Pd2 Pd4 In1 . 1_566 180.0
In1 Pd4 In1 . 1_566 180.0
In5 Pd4 In1 9_455 1_566 120.0
In5 Pd4 In1 5_665 1_566 60.0
Pd2 Pd4 In1 1_566 1_566 0.0
In5 Pd4 In1 5 1_566 120.0
Pd4 Pd4 In1 9_556 1_566 60.0
In5 Pd4 Au3 9_556 5 120.0
Pd2 Pd4 Au3 . 5 60.0
In1 Pd4 Au3 . 5 60.0
In5 Pd4 Au3 9_455 5 60.0
In5 Pd4 Au3 5_665 5 180.0
Pd2 Pd4 Au3 1_566 5 120.0
In5 Pd4 Au3 5 5 0.0
Pd4 Pd4 Au3 9_556 5 120.0
In1 Pd4 Au3 1_566 5 120.0
In5 Pd4 Pd4 9_556 9_455 180.0
Pd2 Pd4 Pd4 . 9_455 60.0
In1 Pd4 Pd4 . 9_455 60.0
In5 Pd4 Pd4 9_455 9_455 0.0
In5 Pd4 Pd4 5_665 9_455 120.0
Pd2 Pd4 Pd4 1_566 9_455 120.0
In5 Pd4 Pd4 5 9_455 60.0
Pd4 Pd4 Pd4 9_556 9_455 180.0
In1 Pd4 Pd4 1_566 9_455 120.0
Au3 Pd4 Pd4 5 9_455 60.0
In5 Pd4 Pd4 9_556 5_665 60.0
Pd2 Pd4 Pd4 . 5_665 120.0
In1 Pd4 Pd4 . 5_665 120.0
In5 Pd4 Pd4 9_455 5_665 120.0
In5 Pd4 Pd4 5_665 5_665 0.0
Pd2 Pd4 Pd4 1_566 5_665 60.0
In5 Pd4 Pd4 5 5_665 180.0
Pd4 Pd4 Pd4 9_556 5_665 60.0
In1 Pd4 Pd4 1_566 5_665 60.0
Au3 Pd4 Pd4 5 5_665 180.0
Pd4 Pd4 Pd4 9_455 5_665 120.0
In5 In5 Pd2 9_556 . 120.0
In5 In5 In1 9_556 . 120.0
Pd2 In5 In1 . . 0.0
In5 In5 In5 9_556 9_455 180.0
Pd2 In5 In5 . 9_455 60.0
In1 In5 In5 . 9_455 60.0
In5 In5 In5 9_556 5_665 60.0
Pd2 In5 In5 . 5_665 120.0
In1 In5 In5 . 5_665 120.0
In5 In5 In5 9_455 5_665 120.0
In5 In5 Pd2 9_556 1_566 60.0
Pd2 In5 Pd2 . 1_566 180.0
In1 In5 Pd2 . 1_566 180.0
In5 In5 Pd2 9_455 1_566 120.0
In5 In5 Pd2 5_665 1_566 60.0
In5 In5 In5 9_556 5 120.0
Pd2 In5 In5 . 5 60.0
In1 In5 In5 . 5 60.0
In5 In5 In5 9_455 5 60.0
In5 In5 In5 5_665 5 180.0
Pd2 In5 In5 1_566 5 120.0
In5 In5 Pd4 9_556 9_556 0.0
Pd2 In5 Pd4 . 9_556 120.0
In1 In5 Pd4 . 9_556 120.0
In5 In5 Pd4 9_455 9_556 180.0
In5 In5 Pd4 5_665 9_556 60.0
Pd2 In5 Pd4 1_566 9_556 60.0
In5 In5 Pd4 5 9_556 120.0
In5 In5 In1 9_556 1_566 60.0
Pd2 In5 In1 . 1_566 180.0
In1 In5 In1 . 1_566 180.0
In5 In5 In1 9_455 1_566 120.0
In5 In5 In1 5_665 1_566 60.0
Pd2 In5 In1 1_566 1_566 0.0
In5 In5 In1 5 1_566 120.0
Pd4 In5 In1 9_556 1_566 60.0
In5 In5 Au3 9_556 5 120.0
Pd2 In5 Au3 . 5 60.0
In1 In5 Au3 . 5 60.0
In5 In5 Au3 9_455 5 60.0
In5 In5 Au3 5_665 5 180.0
Pd2 In5 Au3 1_566 5 120.0
In5 In5 Au3 5 5 0.0
Pd4 In5 Au3 9_556 5 120.0
In1 In5 Au3 1_566 5 120.0
In5 In5 Pd4 9_556 9_455 180.0
Pd2 In5 Pd4 . 9_455 60.0
In1 In5 Pd4 . 9_455 60.0
In5 In5 Pd4 9_455 9_455 0.0
In5 In5 Pd4 5_665 9_455 120.0
Pd2 In5 Pd4 1_566 9_455 120.0
In5 In5 Pd4 5 9_455 60.0
Pd4 In5 Pd4 9_556 9_455 180.0
In1 In5 Pd4 1_566 9_455 120.0
Au3 In5 Pd4 5 9_455 60.0
In5 In5 Pd4 9_556 5_665 60.0
Pd2 In5 Pd4 . 5_665 120.0
In1 In5 Pd4 . 5_665 120.0
In5 In5 Pd4 9_455 5_665 120.0
In5 In5 Pd4 5_665 5_665 0.0
Pd2 In5 Pd4 1_566 5_665 60.0
In5 In5 Pd4 5 5_665 180.0
Pd4 In5 Pd4 9_556 5_665 60.0
In1 In5 Pd4 1_566 5_665 60.0
Au3 In5 Pd4 5 5_665 180.0
Pd4 In5 Pd4 9_455 5_665 120.0
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
Pd2 In5 9 2.8525(4)
Pd2 Au3 . 2.8525(4)
Pd2 Pd4 . 2.8525(4)
Pd2 In5 . 2.8525(4)
Pd2 Au3 1_544 2.8525(4)
Pd2 In5 9_445 2.8525(4)
Pd2 In5 5_655 2.8525(4)
Pd2 Au3 5_554 2.8525(4)
Pd2 In5 5_554 2.8525(4)
Pd2 In5 1_544 2.8525(4)
Pd2 Au3 5_655 2.8525(4)
Pd2 Au3 9_445 2.8525(4)
In1 In5 9 2.8525(4)
In1 Au3 . 2.8525(4)
In1 Pd4 . 2.8525(4)
In1 In5 . 2.8525(4)
In1 Au3 1_544 2.8525(4)
In1 In5 9_445 2.8525(4)
In1 In5 5_655 2.8525(4)
In1 Au3 5_554 2.8525(4)
In1 In5 5_554 2.8525(4)
In1 In5 1_544 2.8525(4)
In1 Au3 5_655 2.8525(4)
In1 Au3 9_445 2.8525(4)
Au3 In5 9_556 2.8525(4)
Au3 In5 9_455 2.8525(4)
Au3 In5 5_665 2.8525(4)
Au3 Pd2 1_566 2.8525(4)
Au3 In5 5 2.8525(4)
Au3 Pd4 9_556 2.8525(4)
Au3 In1 1_566 2.8525(4)
Au3 Au3 5 2.8525(4)
Au3 Pd4 9_455 2.8525(4)
Au3 Pd4 5_665 2.8525(4)
Pd4 In5 9_556 2.8525(4)
Pd4 In5 9_455 2.8525(4)
Pd4 In5 5_665 2.8525(4)
Pd4 Pd2 1_566 2.8525(4)
Pd4 In5 5 2.8525(4)
Pd4 Pd4 9_556 2.8525(4)
Pd4 In1 1_566 2.8525(4)
Pd4 Au3 5 2.8525(4)
Pd4 Pd4 9_455 2.8525(4)
Pd4 Pd4 5_665 2.8525(4)
In5 In5 9_556 2.8525(4)
In5 In5 9_455 2.8525(4)
In5 In5 5_665 2.8525(4)
In5 Pd2 1_566 2.8525(4)
In5 In5 5 2.8525(4)
In5 Pd4 9_556 2.8525(4)
In5 In1 1_566 2.8525(4)
In5 Au3 5 2.8525(4)
In5 Pd4 9_455 2.8525(4)
In5 Pd4 5_665 2.8525(4)

_cod_database_fobs_code 2021012
