#------------------------------------------------------------------------------
#$Date: 2016-03-23 20:49:57 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179426 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/23/4332303.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the Crystal Eye server at
# http://wwmm.ch.cam.ac.uk/crystaleye/, created by Nick Day at the
# Peter Murray-Rust laboratory.
#
# 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_4332303
loop_
_publ_author_name
'Li, Bin'
'Corbett, John D.'
_publ_section_title
;
 Synthesis and Structure of K3Mg20In14, a Stuffed Variant of the
 BaHg11Structure Type with a Magnesium−Indium Network
;
_journal_issue                   10
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3861
_journal_page_last               3863
_journal_paper_doi               10.1021/ic060215v
_journal_volume                  45
_journal_year                    2006
_chemical_formula_sum            'In14 K3 Mg20'
_chemical_formula_weight         2210.98
_chemical_name_systematic
; 
 ? 
;
_space_group_IT_number           221
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-P 4 2 3'
_symmetry_space_group_name_H-M   'P m -3 m'
_atom_sites_solution_hydrogens   geom
_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            1
_cell_length_a                   9.7689(11)
_cell_length_b                   9.7689(11)
_cell_length_c                   9.7689(11)
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      23
_cell_measurement_theta_min      4
_cell_volume                     932.26(18)
_computing_cell_refinement       'Bruker XSCANS'
_computing_data_collection       'Bruker XSCANS'
_computing_data_reduction        'Bruker SHELXTL'
_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_measured_fraction_theta_full 0.986
_diffrn_measured_fraction_theta_max 0.977
_diffrn_measurement_device_type  'STOE IPDSII'
_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  0.0000
_diffrn_reflns_av_sigmaI/netI    0.0089
_diffrn_reflns_limit_h_max       7
_diffrn_reflns_limit_h_min       0
_diffrn_reflns_limit_k_max       9
_diffrn_reflns_limit_k_min       0
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       1
_diffrn_reflns_number            303
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         29.30
_diffrn_reflns_theta_min         2.08
_exptl_absorpt_coefficient_mu    9.147
_exptl_absorpt_correction_type   numerical
_exptl_crystal_colour            gray
_exptl_crystal_density_diffrn    3.938
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       irregular
_exptl_crystal_F_000             983
_exptl_crystal_size_max          0.26
_exptl_crystal_size_mid          0.17
_exptl_crystal_size_min          0.12
_refine_diff_density_max         1.897
_refine_diff_density_min         -0.879
_refine_diff_density_rms         0.487
_refine_ls_extinction_coef       0.0058(8)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.259
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     17
_refine_ls_number_reflns         303
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.259
_refine_ls_R_factor_all          0.0322
_refine_ls_R_factor_gt           0.0267
_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)+(0.0501P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0789
_refine_ls_wR_factor_ref         0.0809
_reflns_number_gt                278
_reflns_number_total             303
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic060215vsup1.cif
_cod_data_source_block           K3Mg20In14
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Cubic' changed to 'cubic' according
to /home/saulius/struct/CIF-dictionaries/cif_core.dic dictionary
named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 

The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'none' was changed to '?' - the
value is perceived as not measured.

Automatic conversion script
Id: cif_fix_values 3008 2015-01-20 13:52:24Z robertas 
;
_cod_original_sg_symbol_H-M      Pm-3m
_cod_database_code               4332303
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, z'
'-x, y, -z'
'x, -y, -z'
'z, x, y'
'z, -x, -y'
'-z, -x, y'
'-z, x, -y'
'y, z, x'
'-y, z, -x'
'y, -z, -x'
'-y, -z, x'
'y, x, -z'
'-y, -x, -z'
'y, -x, z'
'-y, x, z'
'x, z, -y'
'-x, z, y'
'-x, -z, -y'
'x, -z, y'
'z, y, -x'
'z, -y, x'
'-z, y, x'
'-z, -y, -x'
'-x, -y, -z'
'x, y, -z'
'x, -y, z'
'-x, y, z'
'-z, -x, -y'
'-z, x, y'
'z, x, -y'
'z, -x, y'
'-y, -z, -x'
'y, -z, x'
'-y, z, x'
'y, z, -x'
'-y, -x, z'
'y, x, z'
'-y, x, -z'
'y, -x, -z'
'-x, -z, y'
'x, -z, -y'
'x, z, y'
'-x, z, -y'
'-z, -y, x'
'-z, y, -x'
'z, -y, -x'
'z, y, x'
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
In1 In 0.0000 0.0000 0.0000 0.0185(4) Uani 1 48 d S
In2 In 0.0000 0.34911(4) 0.34911(4) 0.0159(3) Uani 1 4 d S
In3 In 0.5000 0.5000 0.5000 0.0180(4) Uani 1 48 d S
Mg1 Mg 0.5000 0.26473(18) 0.26473(18) 0.0140(5) Uani 1 4 d S
Mg2 Mg 0.17402(16) 0.17402(16) 0.17402(16) 0.0113(7) Uani 1 6 d S
K K 0.5000 0.0000 0.0000 0.0233(7) Uani 1 16 d S
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Mg Mg 0.0486 0.0363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
K K 0.2009 0.2494 '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
_geom_angle_site_symmetry_1
_geom_angle_site_symmetry_3
Mg2 In1 Mg2 180.00(10) . 25
Mg2 In1 Mg2 70.5 . 28
Mg2 In1 Mg2 109.5 25 28
Mg2 In1 Mg2 109.5 . 2
Mg2 In1 Mg2 70.5 25 2
Mg2 In1 Mg2 70.5 28 2
Mg2 In1 Mg2 70.5 . 26
Mg2 In1 Mg2 109.5 25 26
Mg2 In1 Mg2 109.5 28 26
Mg2 In1 Mg2 180.00(15) 2 26
Mg2 In1 Mg2 109.5 . 3
Mg2 In1 Mg2 70.5 25 3
Mg2 In1 Mg2 70.5 28 3
Mg2 In1 Mg2 109.5 2 3
Mg2 In1 Mg2 70.5 26 3
Mg2 In1 Mg2 70.5 . 27
Mg2 In1 Mg2 109.5 25 27
Mg2 In1 Mg2 109.5 28 27
Mg2 In1 Mg2 70.5 2 27
Mg2 In1 Mg2 109.5 26 27
Mg2 In1 Mg2 180.00(15) 3 27
Mg2 In1 Mg2 109.5 . 4
Mg2 In1 Mg2 70.5 25 4
Mg2 In1 Mg2 180.00(10) 28 4
Mg2 In1 Mg2 109.5 2 4
Mg2 In1 Mg2 70.5 26 4
Mg2 In1 Mg2 109.5 3 4
Mg2 In1 Mg2 70.5 27 4
In2 In2 In2 90.0 26_556 2_565
In2 In2 Mg2 125.35(3) 26_556 28
In2 In2 Mg2 125.35(3) 2_565 28
In2 In2 Mg2 125.35(3) 26_556 .
In2 In2 Mg2 125.35(3) 2_565 .
Mg2 In2 Mg2 70.20(10) 28 .
In2 In2 Mg1 105.48(4) 26_556 5
In2 In2 Mg1 61.496(13) 2_565 5
Mg2 In2 Mg1 127.09(5) 28 5
Mg2 In2 Mg1 68.92(4) . 5
In2 In2 Mg1 61.496(13) 26_556 9
In2 In2 Mg1 105.48(4) 2_565 9
Mg2 In2 Mg1 127.09(5) 28 9
Mg2 In2 Mg1 68.92(4) . 9
Mg1 In2 Mg1 63.49(8) 5 9
In2 In2 Mg1 105.48(4) 26_556 30
In2 In2 Mg1 61.496(13) 2_565 30
Mg2 In2 Mg1 68.92(4) 28 30
Mg2 In2 Mg1 127.09(5) . 30
Mg1 In2 Mg1 113.71(6) 5 30
Mg1 In2 Mg1 162.89(5) 9 30
In2 In2 Mg1 61.496(13) 26_556 10_556
In2 In2 Mg1 105.48(4) 2_565 10_556
Mg2 In2 Mg1 68.92(4) 28 10_556
Mg2 In2 Mg1 127.09(5) . 10_556
Mg1 In2 Mg1 162.89(5) 5 10_556
Mg1 In2 Mg1 113.71(6) 9 10_556
Mg1 In2 Mg1 63.49(8) 30 10_556
In2 In2 K 66.626(9) 26_556 9
In2 In2 K 156.626(9) 2_565 9
Mg2 In2 K 72.450(14) 28 9
Mg2 In2 K 72.450(14) . 9
Mg1 In2 K 122.95(3) 5 9
Mg1 In2 K 64.26(4) 9 9
Mg1 In2 K 122.95(3) 30 9
Mg1 In2 K 64.26(4) 10_556 9
In2 In2 K 156.626(9) 26_556 5
In2 In2 K 66.626(9) 2_565 5
Mg2 In2 K 72.450(14) 28 5
Mg2 In2 K 72.450(14) . 5
Mg1 In2 K 64.26(4) 5 5
Mg1 In2 K 122.95(3) 9 5
Mg1 In2 K 64.26(4) 30 5
Mg1 In2 K 122.95(3) 10_556 5
K In2 K 136.748(17) 9 5
Mg1 In3 Mg1 180.0 33_666 9
Mg1 In3 Mg1 60.0 33_666 29_666
Mg1 In3 Mg1 120.0 9 29_666
Mg1 In3 Mg1 120.0 33_666 5
Mg1 In3 Mg1 60.0 9 5
Mg1 In3 Mg1 180.0 29_666 5
Mg1 In3 Mg1 120.0 33_666 .
Mg1 In3 Mg1 60.0 9 .
Mg1 In3 Mg1 120.0 29_666 .
Mg1 In3 Mg1 60.0 5 .
Mg1 In3 Mg1 60.0 33_666 25_666
Mg1 In3 Mg1 120.0 9 25_666
Mg1 In3 Mg1 60.0 29_666 25_666
Mg1 In3 Mg1 120.0 5 25_666
Mg1 In3 Mg1 180.0 . 25_666
Mg1 In3 Mg1 90.0 33_666 34_565
Mg1 In3 Mg1 90.0 9 34_565
Mg1 In3 Mg1 120.0 29_666 34_565
Mg1 In3 Mg1 60.0 5 34_565
Mg1 In3 Mg1 120.0 . 34_565
Mg1 In3 Mg1 60.0 25_666 34_565
Mg1 In3 Mg1 120.0 33_666 6_566
Mg1 In3 Mg1 60.0 9 6_566
Mg1 In3 Mg1 90.0 29_666 6_566
Mg1 In3 Mg1 90.0 5 6_566
Mg1 In3 Mg1 120.0 . 6_566
Mg1 In3 Mg1 60.0 25_666 6_566
Mg1 In3 Mg1 60.0 34_565 6_566
Mg1 In3 Mg1 60.0 33_666 30_655
Mg1 In3 Mg1 120.0 9 30_655
Mg1 In3 Mg1 90.0 29_666 30_655
Mg1 In3 Mg1 90.0 5 30_655
Mg1 In3 Mg1 60.0 . 30_655
Mg1 In3 Mg1 120.0 25_666 30_655
Mg1 In3 Mg1 120.0 34_565 30_655
Mg1 In3 Mg1 180.0 6_566 30_655
Mg1 In3 Mg1 90.0 33_666 10_656
Mg1 In3 Mg1 90.0 9 10_656
Mg1 In3 Mg1 60.0 29_666 10_656
Mg1 In3 Mg1 120.0 5 10_656
Mg1 In3 Mg1 60.0 . 10_656
Mg1 In3 Mg1 120.0 25_666 10_656
Mg1 In3 Mg1 180.0 34_565 10_656
Mg1 In3 Mg1 120.0 6_566 10_656
Mg1 In3 Mg1 60.0 30_655 10_656
Mg1 In3 Mg1 60.0 33_666 2_665
Mg1 In3 Mg1 120.0 9 2_665
Mg1 In3 Mg1 120.0 29_666 2_665
Mg1 In3 Mg1 60.0 5 2_665
Mg1 In3 Mg1 90.0 . 2_665
Mg1 In3 Mg1 90.0 25_666 2_665
Mg1 In3 Mg1 60.0 34_565 2_665
Mg1 In3 Mg1 120.0 6_566 2_665
Mg1 In3 Mg1 60.0 30_655 2_665
Mg1 In3 Mg1 120.0 10_656 2_665
Mg1 In3 Mg1 120.0 33_666 26_556
Mg1 In3 Mg1 60.0 9 26_556
Mg1 In3 Mg1 60.0 29_666 26_556
Mg1 In3 Mg1 120.0 5 26_556
Mg1 In3 Mg1 90.0 . 26_556
Mg1 In3 Mg1 90.0 25_666 26_556
Mg1 In3 Mg1 120.0 34_565 26_556
Mg1 In3 Mg1 60.0 6_566 26_556
Mg1 In3 Mg1 120.0 30_655 26_556
Mg1 In3 Mg1 60.0 10_656 26_556
Mg1 In3 Mg1 180.0 2_665 26_556
In2 Mg1 In2 102.66(5) 9 5
In2 Mg1 In2 57.01(3) 9 10_655
In2 Mg1 In2 132.43(9) 5 10_655
In2 Mg1 In2 132.43(9) 9 30_655
In2 Mg1 In2 57.01(3) 5 30_655
In2 Mg1 In2 102.66(5) 10_655 30_655
In2 Mg1 Mg1 158.355(19) 9 10_656
In2 Mg1 Mg1 98.55(2) 5 10_656
In2 Mg1 Mg1 104.75(2) 10_655 10_656
In2 Mg1 Mg1 58.25(4) 30_655 10_656
In2 Mg1 Mg1 98.55(2) 9 30_655
In2 Mg1 Mg1 158.355(19) 5 30_655
In2 Mg1 Mg1 58.25(4) 10_655 30_655
In2 Mg1 Mg1 104.75(2) 30_655 30_655
Mg1 Mg1 Mg1 60.0 10_656 30_655
In2 Mg1 In3 113.79(4) 9 .
In2 Mg1 In3 113.79(4) 5 .
In2 Mg1 In3 113.79(4) 10_655 .
In2 Mg1 In3 113.79(4) 30_655 .
Mg1 Mg1 In3 60.0 10_656 .
Mg1 Mg1 In3 60.0 30_655 .
In2 Mg1 Mg1 104.75(2) 9 9
In2 Mg1 Mg1 58.25(4) 5 9
In2 Mg1 Mg1 158.355(19) 10_655 9
In2 Mg1 Mg1 98.55(2) 30_655 9
Mg1 Mg1 Mg1 90.0 10_656 9
Mg1 Mg1 Mg1 120.0 30_655 9
In3 Mg1 Mg1 60.0 . 9
In2 Mg1 Mg1 58.25(4) 9 5
In2 Mg1 Mg1 104.75(2) 5 5
In2 Mg1 Mg1 98.55(2) 10_655 5
In2 Mg1 Mg1 158.355(19) 30_655 5
Mg1 Mg1 Mg1 120.0 10_656 5
Mg1 Mg1 Mg1 90.0 30_655 5
In3 Mg1 Mg1 60.0 . 5
Mg1 Mg1 Mg1 60.0 9 5
In2 Mg1 Mg2 53.72(2) 9 .
In2 Mg1 Mg2 53.72(2) 5 .
In2 Mg1 Mg2 107.24(5) 10_655 .
In2 Mg1 Mg2 107.24(5) 30_655 .
Mg1 Mg1 Mg2 147.255(18) 10_656 .
Mg1 Mg1 Mg2 147.255(18) 30_655 .
In3 Mg1 Mg2 111.48(5) . .
Mg1 Mg1 Mg2 61.65(4) 9 .
Mg1 Mg1 Mg2 61.65(4) 5 .
In2 Mg1 Mg2 107.24(5) 9 28_655
In2 Mg1 Mg2 107.24(5) 5 28_655
In2 Mg1 Mg2 53.72(2) 10_655 28_655
In2 Mg1 Mg2 53.72(2) 30_655 28_655
Mg1 Mg1 Mg2 61.65(4) 10_656 28_655
Mg1 Mg1 Mg2 61.65(4) 30_655 28_655
In3 Mg1 Mg2 111.48(5) . 28_655
Mg1 Mg1 Mg2 147.255(18) 9 28_655
Mg1 Mg1 Mg2 147.255(18) 5 28_655
Mg2 Mg1 Mg2 137.04(9) . 28_655
In2 Mg1 K 66.21(4) 9 .
In2 Mg1 K 66.21(4) 5 .
In2 Mg1 K 66.21(4) 10_655 .
In2 Mg1 K 66.21(4) 30_655 .
Mg1 Mg1 K 120.0 10_656 .
Mg1 Mg1 K 120.0 30_655 .
In3 Mg1 K 180.00(8) . .
Mg1 Mg1 K 120.0 9 .
Mg1 Mg1 K 120.0 5 .
Mg2 Mg1 K 68.52(5) . .
Mg2 Mg1 K 68.52(5) 28_655 .
In1 Mg2 In2 109.64(5) . 9
In1 Mg2 In2 109.64(5) . 5
In2 Mg2 In2 109.30(5) 9 5
In1 Mg2 In2 109.64(5) . .
In2 Mg2 In2 109.30(5) 9 .
In2 Mg2 In2 109.30(5) 5 .
In1 Mg2 Mg2 54.7 . 27
In2 Mg2 Mg2 125.35(3) 9 27
In2 Mg2 Mg2 54.90(5) 5 27
In2 Mg2 Mg2 125.35(3) . 27
In1 Mg2 Mg2 54.7 . 26
In2 Mg2 Mg2 54.90(5) 9 26
In2 Mg2 Mg2 125.35(3) 5 26
In2 Mg2 Mg2 125.35(3) . 26
Mg2 Mg2 Mg2 90.0 27 26
In1 Mg2 Mg2 54.7 . 28
In2 Mg2 Mg2 125.35(3) 9 28
In2 Mg2 Mg2 125.35(3) 5 28
In2 Mg2 Mg2 54.90(5) . 28
Mg2 Mg2 Mg2 90.0 27 28
Mg2 Mg2 Mg2 90.0 26 28
In1 Mg2 Mg1 146.75(5) . .
In2 Mg2 Mg1 57.37(4) 9 .
In2 Mg2 Mg1 57.37(4) 5 .
In2 Mg2 Mg1 103.62(9) . .
Mg2 Mg2 Mg1 105.01(3) 27 .
Mg2 Mg2 Mg1 105.01(3) 26 .
Mg2 Mg2 Mg1 158.52(5) 28 .
In1 Mg2 Mg1 146.75(5) . 5
In2 Mg2 Mg1 57.37(4) 9 5
In2 Mg2 Mg1 103.62(9) 5 5
In2 Mg2 Mg1 57.37(4) . 5
Mg2 Mg2 Mg1 158.52(5) 27 5
Mg2 Mg2 Mg1 105.01(3) 26 5
Mg2 Mg2 Mg1 105.01(3) 28 5
Mg1 Mg2 Mg1 56.71(8) . 5
In1 Mg2 Mg1 146.75(5) . 9
In2 Mg2 Mg1 103.62(9) 9 9
In2 Mg2 Mg1 57.37(4) 5 9
In2 Mg2 Mg1 57.37(4) . 9
Mg2 Mg2 Mg1 105.01(3) 27 9
Mg2 Mg2 Mg1 158.52(5) 26 9
Mg2 Mg2 Mg1 105.01(3) 28 9
Mg1 Mg2 Mg1 56.71(8) . 9
Mg1 Mg2 Mg1 56.71(8) 5 9
In1 Mg2 K 88.21(4) . 9
In2 Mg2 K 162.15(9) 9 9
In2 Mg2 K 62.599(5) 5 9
In2 Mg2 K 62.599(5) . 9
Mg2 Mg2 K 64.78(2) 27 9
Mg2 Mg2 K 142.95(4) 26 9
Mg2 Mg2 K 64.78(2) 28 9
Mg1 Mg2 K 107.46(5) . 9
Mg1 Mg2 K 107.46(5) 5 9
Mg1 Mg2 K 58.53(4) 9 9
In1 Mg2 K 88.21(4) . .
In2 Mg2 K 62.599(5) 9 .
In2 Mg2 K 62.599(5) 5 .
In2 Mg2 K 162.15(9) . .
Mg2 Mg2 K 64.78(2) 27 .
Mg2 Mg2 K 64.78(2) 26 .
Mg2 Mg2 K 142.95(4) 28 .
Mg1 Mg2 K 58.53(4) . .
Mg1 Mg2 K 107.46(5) 5 .
Mg1 Mg2 K 107.46(5) 9 .
K Mg2 K 119.904(4) 9 .
Mg1 K Mg1 180.00(4) 25_655 .
Mg1 K Mg1 90.0 25_655 26
Mg1 K Mg1 90.0 . 26
Mg1 K Mg1 90.0 25_655 2_655
Mg1 K Mg1 90.0 . 2_655
Mg1 K Mg1 180.00(4) 26 2_655
Mg1 K In2 130.472(3) 25_655 10_655
Mg1 K In2 49.528(3) . 10_655
Mg1 K In2 49.528(3) 26 10_655
Mg1 K In2 130.472(3) 2_655 10_655
Mg1 K In2 130.472(3) 25_655 30_655
Mg1 K In2 49.528(3) . 30_655
Mg1 K In2 130.472(3) 26 30_655
Mg1 K In2 49.528(3) 2_655 30_655
In2 K In2 80.944(6) 10_655 30_655
Mg1 K In2 49.528(3) 25_655 34
Mg1 K In2 130.472(3) . 34
Mg1 K In2 130.472(3) 26 34
Mg1 K In2 49.528(3) 2_655 34
In2 K In2 180.000(17) 10_655 34
In2 K In2 99.056(6) 30_655 34
Mg1 K In2 49.528(3) 25_655 6
Mg1 K In2 130.472(3) . 6
Mg1 K In2 49.528(3) 26 6
Mg1 K In2 130.472(3) 2_655 6
In2 K In2 99.056(6) 10_655 6
In2 K In2 180.000(17) 30_655 6
In2 K In2 80.944(6) 34 6
Mg1 K In2 49.528(3) 25_655 29_655
Mg1 K In2 130.472(3) . 29_655
Mg1 K In2 49.528(3) 26 29_655
Mg1 K In2 130.472(3) 2_655 29_655
In2 K In2 80.944(6) 10_655 29_655
In2 K In2 133.252(17) 30_655 29_655
In2 K In2 99.056(6) 34 29_655
In2 K In2 46.748(17) 6 29_655
Mg1 K In2 49.528(3) 25_655 33_655
Mg1 K In2 130.472(3) . 33_655
Mg1 K In2 130.472(3) 26 33_655
Mg1 K In2 49.528(3) 2_655 33_655
In2 K In2 133.252(17) 10_655 33_655
In2 K In2 80.944(6) 30_655 33_655
In2 K In2 46.748(17) 34 33_655
In2 K In2 99.056(6) 6 33_655
In2 K In2 80.944(6) 29_655 33_655
Mg1 K In2 130.472(3) 25_655 5
Mg1 K In2 49.528(3) . 5
Mg1 K In2 130.472(3) 26 5
Mg1 K In2 49.528(3) 2_655 5
In2 K In2 99.056(6) 10_655 5
In2 K In2 46.748(17) 30_655 5
In2 K In2 80.944(6) 34 5
In2 K In2 133.252(17) 6 5
In2 K In2 180.0 29_655 5
In2 K In2 99.056(6) 33_655 5
Mg1 K In2 130.472(3) 25_655 9
Mg1 K In2 49.528(3) . 9
Mg1 K In2 49.528(3) 26 9
Mg1 K In2 130.472(3) 2_655 9
In2 K In2 46.748(17) 10_655 9
In2 K In2 99.056(6) 30_655 9
In2 K In2 133.252(17) 34 9
In2 K In2 80.944(6) 6 9
In2 K In2 99.056(6) 29_655 9
In2 K In2 180.0 33_655 9
In2 K In2 80.944(6) 5 9
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
In1 Mg2 2.944(3) .
In1 Mg2 2.944(3) 25
In1 Mg2 2.944(3) 28
In1 Mg2 2.944(3) 2
In1 Mg2 2.944(3) 26
In1 Mg2 2.944(3) 3
In1 Mg2 2.944(3) 27
In1 Mg2 2.944(3) 4
In2 In2 2.9480(9) 26_556
In2 In2 2.9480(9) 2_565
In2 Mg2 2.9566(11) 28
In2 Mg2 2.9566(11) .
In2 Mg1 3.0887(11) 5
In2 Mg1 3.0887(11) 9
In2 Mg1 3.0887(11) 30
In2 Mg1 3.0887(11) 10_556
In2 K 3.7154(5) 9
In2 K 3.7154(5) 5
In3 Mg1 3.250(3) 33_666
In3 Mg1 3.250(3) 9
In3 Mg1 3.250(3) 29_666
In3 Mg1 3.250(3) 5
In3 Mg1 3.250(3) .
In3 Mg1 3.250(3) 25_666
In3 Mg1 3.250(3) 34_565
In3 Mg1 3.250(3) 6_566
In3 Mg1 3.250(3) 30_655
In3 Mg1 3.250(3) 10_656
In3 Mg1 3.250(3) 2_665
In3 Mg1 3.250(3) 26_556
Mg1 In2 3.0887(11) 9
Mg1 In2 3.0887(11) 5
Mg1 In2 3.0887(11) 10_655
Mg1 In2 3.0887(11) 30_655
Mg1 Mg1 3.250(3) 10_656
Mg1 Mg1 3.250(3) 30_655
Mg1 Mg1 3.250(3) 9
Mg1 Mg1 3.250(3) 5
Mg1 Mg2 3.422(3) .
Mg1 Mg2 3.422(3) 28_655
Mg1 K 3.657(3) .
Mg2 In2 2.9566(11) 9
Mg2 In2 2.9566(11) 5
Mg2 Mg2 3.400(3) 27
Mg2 Mg2 3.400(3) 26
Mg2 Mg2 3.400(3) 28
Mg2 Mg1 3.422(3) 5
Mg2 Mg1 3.422(3) 9
Mg2 K 3.9901(5) 9
Mg2 K 3.9901(5) .
K Mg1 3.657(3) 25_655
K Mg1 3.657(3) 26
K Mg1 3.657(3) 2_655
K In2 3.7154(5) 10_655
K In2 3.7154(5) 30_655
K In2 3.7154(5) 34
K In2 3.7154(5) 6
K In2 3.7154(5) 29_655
K In2 3.7154(5) 33_655
K In2 3.7154(5) 5
K In2 3.7154(5) 9
