#------------------------------------------------------------------------------
#$Date: 2023-12-25 04:21:21 +0200 (Mon, 25 Dec 2023) $
#$Revision: 288548 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/57/05/1570596.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_1570596
loop_
_publ_author_name
'Kitahara, Koichi'
'Takakura, Hiroyuki'
'Iwasaki, Yutaka'
'Kimura, Kaoru'
_publ_section_title
;
 Phase Equilibria in Aluminium--Ruthenium--Silicon System near 1200 Kelvin
;
_journal_issue                   1
_journal_name_full               'Materials Transactions'
_journal_page_first              18
_journal_page_last               26
_journal_paper_doi               10.2320/matertrans.MT-M2023128
_journal_volume                  65
_journal_year                    2024
_chemical_formula_iupac          '\\sim Ru23 (Al0.9 Si0.1)97'
_chemical_formula_moiety         'Al85.85 Ru23 Si11.10'
_chemical_formula_sum            'Al85.85 Ru23 Si11.1'
_chemical_formula_weight         4952.78
_space_group_crystal_system      hexagonal
_space_group_IT_number           194
_space_group_name_Hall           '-P 6c 2c'
_space_group_name_H-M_alt        'P 63/m m c'
_atom_sites_solution_hydrogens   .
_atom_sites_solution_primary     dual
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-2019/3
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   12.62636(7)
_cell_length_b                   12.62636(7)
_cell_length_c                   26.70599(16)
_cell_measurement_reflns_used    98962
_cell_measurement_temperature    300(1)
_cell_measurement_theta_max      38.2050
_cell_measurement_theta_min      1.9900
_cell_volume                     3687.19(4)
_computing_cell_refinement
'CrysAlisPro 1.171.42.84a (Matsumoto et al., 2021)'
_computing_data_collection
'CrysAlisPro 1.171.42.84a (Matsumoto et al., 2021)'
_computing_data_reduction
'CrysAlisPro 1.171.42.84a (Matsumoto et al., 2021)'
_computing_structure_refinement  'SHELXL-2019/3 (Sheldrick, 2015b)'
_computing_structure_solution    'SHELXT-2018/2 (Sheldrick, 2015a)'
_diffrn_ambient_temperature      300(1)
_diffrn_detector                 'Hybrid Pixel Array Detector'
_diffrn_detector_area_resol_mean 10.0000
_diffrn_detector_type            HyPix
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.989
_diffrn_measurement_device       'four-circle diffractometer'
_diffrn_measurement_device_type  'XtaLAB Synergy R, HyPix'
_diffrn_measurement_method       'ω scans'
_diffrn_radiation_monochromator  mirror
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0304
_diffrn_reflns_av_unetI/netI     0.0066
_diffrn_reflns_Laue_measured_fraction_full 0.999
_diffrn_reflns_Laue_measured_fraction_max 0.989
_diffrn_reflns_limit_h_max       21
_diffrn_reflns_limit_h_min       -21
_diffrn_reflns_limit_k_max       21
_diffrn_reflns_limit_k_min       -21
_diffrn_reflns_limit_l_max       46
_diffrn_reflns_limit_l_min       -45
_diffrn_reflns_number            191004
_diffrn_reflns_point_group_measured_fraction_full 0.999
_diffrn_reflns_point_group_measured_fraction_max 0.989
_diffrn_reflns_theta_full        25.242
_diffrn_reflns_theta_max         38.090
_diffrn_reflns_theta_min         1.862
_diffrn_source                   'micro-focus sealed X-ray tube'
_diffrn_source_type              'Mova (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    5.794
_exptl_absorpt_correction_T_max  0.864
_exptl_absorpt_correction_T_min  0.828
_exptl_absorpt_correction_type   gaussian
_exptl_absorpt_process_details
'CrysAlisPro 1.171.42.84a (Matsumoto et al., 2021)'
_exptl_crystal_colour            'metallic dark silver'
_exptl_crystal_density_diffrn    4.461
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       irregular
_exptl_crystal_F_000             4520.93
_exptl_crystal_size_max          0.049
_exptl_crystal_size_mid          0.042
_exptl_crystal_size_min          0.038
_refine_diff_density_max         0.754
_refine_diff_density_min         -0.583
_refine_diff_density_rms         0.088
_refine_ls_extinction_coef       0.000158(5)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL-2019/3 (Sheldrick, 2015b)'
_refine_ls_goodness_of_fit_ref   1.262
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     128
_refine_ls_number_reflns         3732
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.262
_refine_ls_R_factor_all          0.0138
_refine_ls_R_factor_gt           0.0120
_refine_ls_shift/su_max          0.002
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[σ²(Fo²)+(0.0063P)²+3.1672P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0246
_refine_ls_wR_factor_ref         0.0250
_reflns_Friedel_coverage         0.000
_reflns_Friedel_fraction_full    .
_reflns_Friedel_fraction_max     .
_reflns_number_gt                3550
_reflns_number_total             3732
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            chip_asrs05a001_a.checkcif.cif
_cod_data_source_block           asr-s05a001
_cod_original_cell_volume        3687.19(5)
_cod_original_formula_sum        'Al85.85 Ru23 Si11.10'
_cod_database_code               1570596
_shelx_shelxl_version_number     2019/3
_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.
;
_exptl_absorpt_special_details
;
CrysAlisPro 1.171.42.84a (Matsumoto et al., 2021)
Numerical absorption correction based on gaussian integration over
a multifaceted crystal model
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_oxdiff_exptl_absorpt_empirical_full_min 0.932
_oxdiff_exptl_absorpt_empirical_full_max 1.097
_oxdiff_exptl_absorpt_empirical_details
;
Empirical correction (ABSPACK) includes:
- Absorption correction using spherical harmonics
- Frame scaling
- Detector area scaling
;
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 'x, y, z'
2 '-y, x-y, z'
3 '-x+y, -x, z'
4 '-x, -y, z+1/2'
5 'y, -x+y, z+1/2'
6 'x-y, x, z+1/2'
7 'y, x, -z'
8 'x-y, -y, -z'
9 '-x, -x+y, -z'
10 '-y, -x, -z+1/2'
11 '-x+y, y, -z+1/2'
12 'x, x-y, -z+1/2'
13 '-x, -y, -z'
14 'y, -x+y, -z'
15 'x-y, x, -z'
16 'x, y, -z-1/2'
17 '-y, x-y, -z-1/2'
18 '-x+y, -x, -z-1/2'
19 '-y, -x, z'
20 '-x+y, y, z'
21 'x, x-y, z'
22 'y, x, z-1/2'
23 'x-y, -y, z-1/2'
24 '-x, -x+y, 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_site_symmetry_order
_atom_site_calc_flag
_atom_site_refinement_flags_posn
_atom_site_refinement_flags_adp
_atom_site_refinement_flags_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
Ru1 Ru 0.333333 0.666667 0.10023(2) 0.00519(3) Uani 1 6 d S T P . .
Ru2 Ru 0.21120(2) 0.42240(2) 0.250000 0.00465(2) Uani 1 4 d S T P . .
Ru3 Ru 0.53833(2) 0.07666(2) 0.16205(2) 0.00541(2) Uani 1 2 d S T P . .
Ru4 Ru 0.12887(2) 0.25775(2) 0.14882(2) 0.00582(2) Uani 1 2 d S T P . .
Ru5 Ru 0.21302(2) 0.42604(2) 0.53021(2) 0.00539(2) Uani 1 2 d S T P . .
Al6 Al 0.333333 0.666667 0.250000 0.0088(3) Uani 0.956(6) 12 d S T P . .
Al7A Al 0.45654(6) 0.91308(12) 0.250000 0.01030(19) Uani 0.956(6) 4 d S T P . .
Al7B Al 0.4360(18) 0.872(4) 0.250000 0.025(6) Uiso 0.044(6) 4 d S . P . .
Al8 Al 0.08955(3) 0.17909(7) 0.250000 0.01139(11) Uani 1 4 d S T P . .
Al9 Al 0.58323(3) 0.16645(7) 0.250000 0.01278(12) Uani 1 4 d S T P . .
Si10 Si 0.84017(3) 0.68034(6) 0.250000 0.00930(10) Uani 1 4 d S T P . .
Al11 Al 0.37529(4) 0.000000 0.000000 0.01110(8) Uani 1 2 d S T P . .
Si12 Si 0.10705(2) 0.21409(4) 0.51689(2) 0.0068(2) Uani 0.57(5) 2 d S T P . .
Al12 Al 0.10705(2) 0.21409(4) 0.51689(2) 0.0068(2) Uani 0.43(5) 2 d S T P . .
Al13 Al 0.06782(2) 0.13565(4) 0.07450(2) 0.0073(2) Uani 0.67(5) 2 d S T P . .
Si13 Si 0.06782(2) 0.13565(4) 0.07450(2) 0.0073(2) Uani 0.33(5) 2 d S T P . .
Al14 Al 0.54627(2) 0.09254(4) 0.60279(2) 0.0109(2) Uani 0.55(5) 2 d S T P . .
Si14 Si 0.54627(2) 0.09254(4) 0.60279(2) 0.0109(2) Uani 0.45(5) 2 d S T P . .
Al15 Al 0.59740(2) 0.19481(5) 0.08205(2) 0.00907(8) Uani 1 2 d S T P . .
Al16 Al 0.59588(2) 0.19175(4) 0.51675(2) 0.00761(7) Uani 1 2 d S T P . .
Al17 Al 0.20286(2) 0.40572(4) 0.06814(2) 0.00973(8) Uani 1 2 d S T P . .
Al18 Al 0.24887(2) 0.49775(5) 0.67304(2) 0.01232(8) Uani 1 2 d S T P . .
Al19 Al 0.08384(2) 0.16768(5) 0.66796(2) 0.01029(8) Uani 1 2 d S T P . .
Al20 Al 0.24980(2) 0.49960(5) 0.16342(2) 0.01553(10) Uani 1 2 d S T P . .
Al21 Al 0.00788(3) 0.33507(3) 0.19833(2) 0.00742(5) Uani 1 1 d . . . . .
Al22 Al 0.34642(3) 0.05223(3) 0.10270(2) 0.00921(5) Uani 1 1 d . . . . .
loop_
_atom_type_symbol
_atom_type_description
_atom_type_scat_dispersion_real
_atom_type_scat_dispersion_imag
_atom_type_scat_source
Al Al 0.0645 0.0514 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Ru Ru -1.2594 0.8363 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Si Si 0.0817 0.0704 '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
Al20 Ru1 Al20 79.007(18) 3_565 .
Al20 Ru1 Al20 79.007(18) 3_565 2_665
Al20 Ru1 Al20 79.007(18) . 2_665
Al20 Ru1 Al14 67.375(9) 3_565 4_664
Al20 Ru1 Al14 135.784(17) . 4_664
Al20 Ru1 Al14 67.373(9) 2_665 4_664
Al20 Ru1 Al14 67.373(9) 3_565 5_564
Al20 Ru1 Al14 67.375(9) . 5_564
Al20 Ru1 Al14 135.785(17) 2_665 5_564
Al14 Ru1 Al14 119.934(1) 4_664 5_564
Al20 Ru1 Al14 135.785(17) 3_565 6_554
Al20 Ru1 Al14 67.373(9) . 6_554
Al20 Ru1 Al14 67.375(9) 2_665 6_554
Al14 Ru1 Al14 119.933(1) 4_664 6_554
Al14 Ru1 Al14 119.933(1) 5_564 6_554
Al20 Ru1 Al16 110.359(12) 3_565 5_564
Al20 Ru1 Al16 110.359(12) . 5_564
Al20 Ru1 Al16 167.507(16) 2_665 5_564
Al14 Ru1 Al16 107.840(11) 4_664 5_564
Al14 Ru1 Al16 56.709(14) 5_564 5_564
Al14 Ru1 Al16 107.839(11) 6_554 5_564
Al20 Ru1 Al16 110.359(12) 3_565 4_664
Al20 Ru1 Al16 167.507(16) . 4_664
Al20 Ru1 Al16 110.359(12) 2_665 4_664
Al14 Ru1 Al16 56.709(14) 4_664 4_664
Al14 Ru1 Al16 107.839(11) 5_564 4_664
Al14 Ru1 Al16 107.840(11) 6_554 4_664
Al16 Ru1 Al16 59.200(16) 5_564 4_664
Al20 Ru1 Al16 167.507(16) 3_565 6_554
Al20 Ru1 Al16 110.359(12) . 6_554
Al20 Ru1 Al16 110.359(12) 2_665 6_554
Al14 Ru1 Al16 107.839(11) 4_664 6_554
Al14 Ru1 Al16 107.840(11) 5_564 6_554
Al14 Ru1 Al16 56.709(14) 6_554 6_554
Al16 Ru1 Al16 59.200(16) 5_564 6_554
Al16 Ru1 Al16 59.200(16) 4_664 6_554
Al20 Ru1 Al17 123.158(7) 3_565 .
Al20 Ru1 Al17 59.451(14) . .
Al20 Ru1 Al17 123.158(6) 2_665 .
Al14 Ru1 Al17 164.765(16) 4_664 .
Al14 Ru1 Al17 61.885(4) 5_564 .
Al14 Ru1 Al17 61.883(4) 6_554 .
Al16 Ru1 Al17 59.375(8) 5_564 .
Al16 Ru1 Al17 108.057(14) 4_664 .
Al16 Ru1 Al17 59.375(8) 6_554 .
Al20 Ru1 Al17 59.450(14) 3_565 3_565
Al20 Ru1 Al17 123.158(7) . 3_565
Al20 Ru1 Al17 123.157(6) 2_665 3_565
Al14 Ru1 Al17 61.885(4) 4_664 3_565
Al14 Ru1 Al17 61.883(4) 5_564 3_565
Al14 Ru1 Al17 164.766(16) 6_554 3_565
Al16 Ru1 Al17 59.376(8) 5_564 3_565
Al16 Ru1 Al17 59.375(8) 4_664 3_565
Al16 Ru1 Al17 108.057(14) 6_554 3_565
Al17 Ru1 Al17 112.078(8) . 3_565
Al20 Ru1 Al17 123.158(6) 3_565 2_665
Al20 Ru1 Al17 123.158(6) . 2_665
Al20 Ru1 Al17 59.450(14) 2_665 2_665
Al14 Ru1 Al17 61.883(4) 4_664 2_665
Al14 Ru1 Al17 164.766(16) 5_564 2_665
Al14 Ru1 Al17 61.885(4) 6_554 2_665
Al16 Ru1 Al17 108.057(14) 5_564 2_665
Al16 Ru1 Al17 59.376(8) 4_664 2_665
Al16 Ru1 Al17 59.375(8) 6_554 2_665
Al17 Ru1 Al17 112.078(8) . 2_665
Al17 Ru1 Al17 112.078(8) 3_565 2_665
Al20 Ru2 Al20 139.88(2) . 16_556
Al20 Ru2 Al7B 77.7(2) . 2_665
Al20 Ru2 Al7B 77.7(2) 16_556 2_665
Al20 Ru2 Al7B 77.7(2) . 3_565
Al20 Ru2 Al7B 77.7(2) 16_556 3_565
Al7B Ru2 Al7B 103.0(17) 2_665 3_565
Al20 Ru2 Al21 128.249(7) . 11
Al20 Ru2 Al21 68.325(10) 16_556 11
Al7B Ru2 Al21 145.9(3) 2_665 11
Al7B Ru2 Al21 68.0(7) 3_565 11
Al20 Ru2 Al21 68.325(10) . 20
Al20 Ru2 Al21 128.249(7) 16_556 20
Al7B Ru2 Al21 145.9(3) 2_665 20
Al7B Ru2 Al21 68.0(7) 3_565 20
Al21 Ru2 Al21 63.488(13) 11 20
Al20 Ru2 Al21 68.326(10) . .
Al20 Ru2 Al21 128.248(7) 16_556 .
Al7B Ru2 Al21 68.0(7) 2_665 .
Al7B Ru2 Al21 145.9(3) 3_565 .
Al21 Ru2 Al21 137.300(15) 11 .
Al21 Ru2 Al21 100.447(14) 20 .
Al20 Ru2 Al21 128.248(7) . 16_556
Al20 Ru2 Al21 68.326(10) 16_556 16_556
Al7B Ru2 Al21 68.0(7) 2_665 16_556
Al7B Ru2 Al21 145.9(3) 3_565 16_556
Al21 Ru2 Al21 100.447(14) 11 16_556
Al21 Ru2 Al21 137.301(15) 20 16_556
Al21 Ru2 Al21 63.486(13) . 16_556
Al20 Ru2 Al8 110.059(12) . .
Al20 Ru2 Al8 110.059(12) 16_556 .
Al7B Ru2 Al8 128.5(9) 2_665 .
Al7B Ru2 Al8 128.5(9) 3_565 .
Al21 Ru2 Al8 68.650(8) 11 .
Al21 Ru2 Al8 68.650(8) 20 .
Al21 Ru2 Al8 68.650(8) . .
Al21 Ru2 Al8 68.651(8) 16_556 .
Al20 Ru2 Al6 69.941(12) . .
Al20 Ru2 Al6 69.941(12) 16_556 .
Al7B Ru2 Al6 51.5(9) 2_665 .
Al7B Ru2 Al6 51.5(9) 3_565 .
Al21 Ru2 Al6 111.350(8) 11 .
Al21 Ru2 Al6 111.350(8) 20 .
Al21 Ru2 Al6 111.350(8) . .
Al21 Ru2 Al6 111.349(8) 16_556 .
Al8 Ru2 Al6 180.0 . .
Al20 Ru2 Al7A 80.256(9) . 2_665
Al20 Ru2 Al7A 80.257(9) 16_556 2_665
Al7B Ru2 Al7A 9.0(9) 2_665 2_665
Al7B Ru2 Al7A 111.9(9) 3_565 2_665
Al21 Ru2 Al7A 148.006(7) 11 2_665
Al21 Ru2 Al7A 148.006(7) 20 2_665
Al21 Ru2 Al7A 60.74(2) . 2_665
Al21 Ru2 Al7A 60.73(2) 16_556 2_665
Al8 Ru2 Al7A 119.57(2) . 2_665
Al6 Ru2 Al7A 60.43(2) . 2_665
Al20 Ru2 Al7A 80.257(9) . 3_565
Al20 Ru2 Al7A 80.257(9) 16_556 3_565
Al7B Ru2 Al7A 111.9(9) 2_665 3_565
Al7B Ru2 Al7A 9.0(9) 3_565 3_565
Al21 Ru2 Al7A 60.74(2) 11 3_565
Al21 Ru2 Al7A 60.74(2) 20 3_565
Al21 Ru2 Al7A 148.007(7) . 3_565
Al21 Ru2 Al7A 148.007(7) 16_556 3_565
Al8 Ru2 Al7A 119.57(2) . 3_565
Al6 Ru2 Al7A 60.43(2) . 3_565
Al7A Ru2 Al7A 120.87(5) 2_665 3_565
Al14 Ru3 Al18 130.675(14) 4_654 5_554
Al14 Ru3 Al18 130.672(14) 4_654 6_654
Al18 Ru3 Al18 80.02(2) 5_554 6_654
Al14 Ru3 Al15 80.614(17) 4_654 .
Al18 Ru3 Al15 73.100(15) 5_554 .
Al18 Ru3 Al15 73.101(15) 6_654 .
Al14 Ru3 Al21 88.347(10) 4_654 19_655
Al18 Ru3 Al21 140.978(15) 5_554 19_655
Al18 Ru3 Al21 71.822(14) 6_654 19_655
Al15 Ru3 Al21 121.281(7) . 19_655
Al14 Ru3 Al21 88.348(10) 4_654 3
Al18 Ru3 Al21 71.822(14) 5_554 3
Al18 Ru3 Al21 140.979(15) 6_654 3
Al15 Ru3 Al21 121.280(7) . 3
Al21 Ru3 Al21 115.742(15) 19_655 3
Al14 Ru3 Al9 153.23(2) 4_654 .
Al18 Ru3 Al9 66.379(16) 5_554 .
Al18 Ru3 Al9 66.380(16) 6_654 .
Al15 Ru3 Al9 126.15(2) . .
Al21 Ru3 Al9 77.676(11) 19_655 .
Al21 Ru3 Al9 77.677(11) 3 .
Al14 Ru3 Al22 63.670(9) 4_654 20_655
Al18 Ru3 Al22 131.647(15) 5_554 20_655
Al18 Ru3 Al22 67.374(14) 6_654 20_655
Al15 Ru3 Al22 64.022(9) . 20_655
Al21 Ru3 Al22 59.536(9) 19_655 20_655
Al21 Ru3 Al22 151.057(11) 3 20_655
Al9 Ru3 Al22 124.259(8) . 20_655
Al14 Ru3 Al22 63.671(9) 4_654 .
Al18 Ru3 Al22 67.377(14) 5_554 .
Al18 Ru3 Al22 131.648(15) 6_654 .
Al15 Ru3 Al22 64.021(8) . .
Al21 Ru3 Al22 151.056(11) 19_655 .
Al21 Ru3 Al22 59.536(9) 3 .
Al9 Ru3 Al22 124.260(8) . .
Al22 Ru3 Al22 109.377(14) 20_655 .
Al14 Ru3 Al7A 93.26(2) 4_654 1_545
Al18 Ru3 Al7A 111.389(19) 5_554 1_545
Al18 Ru3 Al7A 111.389(19) 6_654 1_545
Al15 Ru3 Al7A 173.87(2) . 1_545
Al21 Ru3 Al7A 58.092(7) 19_655 1_545
Al21 Ru3 Al7A 58.093(7) 3 1_545
Al9 Ru3 Al7A 59.98(2) . 1_545
Al22 Ru3 Al7A 113.282(11) 20_655 1_545
Al22 Ru3 Al7A 113.283(11) . 1_545
Al13 Ru4 Al19 75.408(13) . 6_554
Al13 Ru4 Al19 75.408(13) . 5_554
Al19 Ru4 Al19 77.76(2) 6_554 5_554
Al13 Ru4 Al21 127.888(7) . 20
Al19 Ru4 Al21 129.760(14) 6_554 20
Al19 Ru4 Al21 69.446(13) 5_554 20
Al13 Ru4 Al21 127.888(7) . .
Al19 Ru4 Al21 69.446(13) 6_554 .
Al19 Ru4 Al21 129.759(14) 5_554 .
Al21 Ru4 Al21 104.200(14) 20 .
Al13 Ru4 Al20 132.313(15) . .
Al19 Ru4 Al20 135.582(12) 6_554 .
Al19 Ru4 Al20 135.582(12) 5_554 .
Al21 Ru4 Al20 66.241(9) 20 .
Al21 Ru4 Al20 66.241(9) . .
Al13 Ru4 Al17 70.830(15) . .
Al19 Ru4 Al17 127.804(13) 6_554 .
Al19 Ru4 Al17 127.804(13) 5_554 .
Al21 Ru4 Al17 102.421(10) 20 .
Al21 Ru4 Al17 102.422(10) . .
Al20 Ru4 Al17 61.484(15) . .
Al13 Ru4 Al22 73.591(8) . 2
Al19 Ru4 Al22 68.626(14) 6_554 2
Al19 Ru4 Al22 138.763(14) 5_554 2
Al21 Ru4 Al22 151.680(11) 20 2
Al21 Ru4 Al22 58.459(9) . 2
Al20 Ru4 Al22 85.651(9) . 2
Al17 Ru4 Al22 64.372(7) . 2
Al13 Ru4 Al22 73.591(8) . 21
Al19 Ru4 Al22 138.763(14) 6_554 21
Al19 Ru4 Al22 68.626(14) 5_554 21
Al21 Ru4 Al22 58.459(9) 20 21
Al21 Ru4 Al22 151.681(11) . 21
Al20 Ru4 Al22 85.651(9) . 21
Al17 Ru4 Al22 64.372(7) . 21
Al22 Ru4 Al22 125.564(14) 2 21
Al13 Ru4 Al8 128.417(18) . .
Al19 Ru4 Al8 65.132(15) 6_554 .
Al19 Ru4 Al8 65.132(15) 5_554 .
Al21 Ru4 Al8 66.875(10) 20 .
Al21 Ru4 Al8 66.874(10) . .
Al20 Ru4 Al8 99.270(18) . .
Al17 Ru4 Al8 160.754(18) . .
Al22 Ru4 Al8 117.218(7) 2 .
Al22 Ru4 Al8 117.218(7) 21 .
Al12 Ru5 Al11 74.828(11) . 17_556
Al12 Ru5 Al11 74.828(11) . 6
Al11 Ru5 Al11 135.086(15) 17_556 6
Al12 Ru5 Al16 129.055(13) . 14_566
Al11 Ru5 Al16 61.857(14) 17_556 14_566
Al11 Ru5 Al16 118.507(12) 6 14_566
Al12 Ru5 Al16 129.055(13) . 15_556
Al11 Ru5 Al16 118.507(12) 17_556 15_556
Al11 Ru5 Al16 61.857(14) 6 15_556
Al16 Ru5 Al16 61.78(2) 14_566 15_556
Al12 Ru5 Al22 77.483(11) . 22_556
Al11 Ru5 Al22 67.737(8) 17_556 22_556
Al11 Ru5 Al22 134.485(10) 6 22_556
Al16 Ru5 Al22 107.002(12) 14_566 22_556
Al16 Ru5 Al22 153.145(12) 15_556 22_556
Al12 Ru5 Al22 77.483(11) . 6
Al11 Ru5 Al22 134.485(10) 17_556 6
Al11 Ru5 Al22 67.737(8) 6 6
Al16 Ru5 Al22 153.145(13) 14_566 6
Al16 Ru5 Al22 107.002(12) 15_556 6
Al22 Ru5 Al22 71.477(15) 22_556 6
Al12 Ru5 Al17 76.435(15) . 16_556
Al11 Ru5 Al17 70.618(4) 17_556 16_556
Al11 Ru5 Al17 70.618(4) 6 16_556
Al16 Ru5 Al17 65.255(12) 14_566 16_556
Al16 Ru5 Al17 65.255(12) 15_556 16_556
Al22 Ru5 Al17 135.200(10) 22_556 16_556
Al22 Ru5 Al17 135.200(10) 6 16_556
Al12 Ru5 Al15 140.471(12) . 5_565
Al11 Ru5 Al15 82.023(14) 17_556 5_565
Al11 Ru5 Al15 140.184(15) 6 5_565
Al16 Ru5 Al15 59.889(12) 14_566 5_565
Al16 Ru5 Al15 90.122(14) 15_556 5_565
Al22 Ru5 Al15 64.117(12) 22_556 5_565
Al22 Ru5 Al15 97.853(12) 6 5_565
Al17 Ru5 Al15 125.100(12) 16_556 5_565
Al12 Ru5 Al15 140.471(12) . 6
Al11 Ru5 Al15 140.184(15) 17_556 6
Al11 Ru5 Al15 82.023(14) 6 6
Al16 Ru5 Al15 90.122(14) 14_566 6
Al16 Ru5 Al15 59.889(12) 15_556 6
Al22 Ru5 Al15 97.853(12) 22_556 6
Al22 Ru5 Al15 64.117(12) 6 6
Al17 Ru5 Al15 125.100(12) 16_556 6
Al15 Ru5 Al15 58.77(2) 5_565 6
Al7B Al6 Al7B 120.001(3) 2_665 .
Al7B Al6 Al7B 120.0 2_665 3_565
Al7B Al6 Al7B 120.000(4) . 3_565
Al7B Al6 Ru2 60.0 2_665 .
Al7B Al6 Ru2 180.0 . .
Al7B Al6 Ru2 60.000(1) 3_565 .
Al7B Al6 Ru2 60.0 2_665 3_565
Al7B Al6 Ru2 60.000(3) . 3_565
Al7B Al6 Ru2 180.0 3_565 3_565
Ru2 Al6 Ru2 120.0 . 3_565
Al7B Al6 Ru2 180.0 2_665 2_665
Al7B Al6 Ru2 60.000(4) . 2_665
Al7B Al6 Ru2 60.000(1) 3_565 2_665
Ru2 Al6 Ru2 120.0 . 2_665
Ru2 Al6 Ru2 120.0 3_565 2_665
Al7B Al6 Al7A 120.001(1) 2_665 .
Al7B Al6 Al7A 0.000(3) . .
Al7B Al6 Al7A 120.000(1) 3_565 .
Ru2 Al6 Al7A 180.0 . .
Ru2 Al6 Al7A 60.0 3_565 .
Ru2 Al6 Al7A 60.0 2_665 .
Al7B Al6 Al7A 0.0 2_665 2_665
Al7B Al6 Al7A 120.000(3) . 2_665
Al7B Al6 Al7A 120.0 3_565 2_665
Ru2 Al6 Al7A 60.0 . 2_665
Ru2 Al6 Al7A 60.0 3_565 2_665
Ru2 Al6 Al7A 180.0 2_665 2_665
Al7A Al6 Al7A 120.0 . 2_665
Al7B Al6 Al7A 120.0 2_665 3_565
Al7B Al6 Al7A 120.000(3) . 3_565
Al7B Al6 Al7A 0.0 3_565 3_565
Ru2 Al6 Al7A 60.0 . 3_565
Ru2 Al6 Al7A 180.0 3_565 3_565
Ru2 Al6 Al7A 60.0 2_665 3_565
Al7A Al6 Al7A 120.0 . 3_565
Al7A Al6 Al7A 120.0 2_665 3_565
Al7B Al6 Al20 71.942(4) 2_665 .
Al7B Al6 Al20 128.312(10) . .
Al7B Al6 Al20 71.943(4) 3_565 .
Ru2 Al6 Al20 51.688(10) . .
Ru2 Al6 Al20 108.057(4) 3_565 .
Ru2 Al6 Al20 108.057(4) 2_665 .
Al7A Al6 Al20 128.312(10) . .
Al7A Al6 Al20 71.943(4) 2_665 .
Al7A Al6 Al20 71.943(4) 3_565 .
Al7B Al6 Al20 71.943(4) 2_665 18_566
Al7B Al6 Al20 71.943(5) . 18_566
Al7B Al6 Al20 128.312(10) 3_565 18_566
Ru2 Al6 Al20 108.057(4) . 18_566
Ru2 Al6 Al20 51.688(10) 3_565 18_566
Ru2 Al6 Al20 108.057(4) 2_665 18_566
Al7A Al6 Al20 71.943(4) . 18_566
Al7A Al6 Al20 71.942(4) 2_665 18_566
Al7A Al6 Al20 128.312(10) 3_565 18_566
Al20 Al6 Al20 143.885(8) . 18_566
Al7B Al6 Al20 71.943(4) 2_665 3_565
Al7B Al6 Al20 71.943(4) . 3_565
Al7B Al6 Al20 128.312(10) 3_565 3_565
Ru2 Al6 Al20 108.057(4) . 3_565
Ru2 Al6 Al20 51.688(10) 3_565 3_565
Ru2 Al6 Al20 108.057(4) 2_665 3_565
Al7A Al6 Al20 71.943(4) . 3_565
Al7A Al6 Al20 71.942(4) 2_665 3_565
Al7A Al6 Al20 128.312(10) 3_565 3_565
Al20 Al6 Al20 64.943(15) . 3_565
Al20 Al6 Al20 103.376(19) 18_566 3_565
Al21 Al7A Al21 61.911(17) 10_665 19_665
Al21 Al7A Ru2 148.042(19) 10_665 3_565
Al21 Al7A Ru2 148.042(19) 19_665 3_565
Al21 Al7A Ru2 58.529(8) 10_665 2_665
Al21 Al7A Ru2 58.529(8) 19_665 2_665
Ru2 Al7A Ru2 119.13(5) 3_565 2_665
Al21 Al7A Al21 142.41(5) 10_665 3_565
Al21 Al7A Al21 105.27(3) 19_665 3_565
Ru2 Al7A Al21 58.528(8) 3_565 3_565
Ru2 Al7A Al21 148.042(19) 2_665 3_565
Al21 Al7A Al21 105.27(3) 10_665 18_566
Al21 Al7A Al21 142.41(5) 19_665 18_566
Ru2 Al7A Al21 58.528(8) 3_565 18_566
Ru2 Al7A Al21 148.042(19) 2_665 18_566
Al21 Al7A Al21 61.910(17) 3_565 18_566
Al21 Al7A Al6 108.79(3) 10_665 .
Al21 Al7A Al6 108.79(3) 19_665 .
Ru2 Al7A Al6 59.57(2) 3_565 .
Ru2 Al7A Al6 59.57(2) 2_665 .
Al21 Al7A Al6 108.79(3) 3_565 .
Al21 Al7A Al6 108.79(3) 18_566 .
Al21 Al7A Al9 71.21(3) 10_665 1_565
Al21 Al7A Al9 71.21(3) 19_665 1_565
Ru2 Al7A Al9 120.43(2) 3_565 1_565
Ru2 Al7A Al9 120.43(2) 2_665 1_565
Al21 Al7A Al9 71.21(3) 3_565 1_565
Al21 Al7A Al9 71.21(3) 18_566 1_565
Al6 Al7A Al9 180.0 . 1_565
Al21 Al7A Ru3 52.814(14) 10_665 16_566
Al21 Al7A Ru3 102.36(3) 19_665 16_566
Ru2 Al7A Ru3 107.872(5) 3_565 16_566
Ru2 Al7A Ru3 107.872(5) 2_665 16_566
Al21 Al7A Ru3 102.36(3) 3_565 16_566
Al21 Al7A Ru3 52.815(14) 18_566 16_566
Al6 Al7A Ru3 127.29(2) . 16_566
Al9 Al7A Ru3 52.71(2) 1_565 16_566
Al21 Al7A Ru3 102.36(3) 10_665 1_565
Al21 Al7A Ru3 52.814(14) 19_665 1_565
Ru2 Al7A Ru3 107.872(5) 3_565 1_565
Ru2 Al7A Ru3 107.872(5) 2_665 1_565
Al21 Al7A Ru3 52.815(14) 3_565 1_565
Al21 Al7A Ru3 102.36(3) 18_566 1_565
Al6 Al7A Ru3 127.29(2) . 1_565
Al9 Al7A Ru3 52.71(2) 1_565 1_565
Ru3 Al7A Ru3 105.42(4) 16_566 1_565
Al6 Al7B Ru2 68.5(9) . 3_565
Al6 Al7B Ru2 68.5(9) . 2_665
Ru2 Al7B Ru2 137.0(17) 3_565 2_665
Al6 Al7B Al21 117.3(7) . 10_665
Ru2 Al7B Al21 149.6(3) 3_565 10_665
Ru2 Al7B Al21 58.28(13) 2_665 10_665
Al6 Al7B Al21 117.3(7) . 19_665
Ru2 Al7B Al21 149.6(3) 3_565 19_665
Ru2 Al7B Al21 58.28(13) 2_665 19_665
Al21 Al7B Al21 57.7(4) 10_665 19_665
Al6 Al7B Al21 117.3(7) . 18_566
Ru2 Al7B Al21 58.28(14) 3_565 18_566
Ru2 Al7B Al21 149.6(3) 2_665 18_566
Al21 Al7B Al21 96.4(8) 10_665 18_566
Al21 Al7B Al21 125.3(14) 19_665 18_566
Al6 Al7B Al21 117.3(7) . 3_565
Ru2 Al7B Al21 58.28(14) 3_565 3_565
Ru2 Al7B Al21 149.6(3) 2_665 3_565
Al21 Al7B Al21 125.3(14) 10_665 3_565
Al21 Al7B Al21 96.4(8) 19_665 3_565
Al21 Al7B Al21 57.7(4) 18_566 3_565
Ru2 Al8 Ru4 72.344(14) . .
Ru2 Al8 Ru4 72.344(14) . 16_556
Ru4 Al8 Ru4 144.69(3) . 16_556
Ru2 Al8 Al19 111.054(15) . 6_554
Ru4 Al8 Al19 52.331(6) . 6_554
Ru4 Al8 Al19 145.998(9) 16_556 6_554
Ru2 Al8 Al19 111.054(15) . 15_556
Ru4 Al8 Al19 145.998(9) . 15_556
Ru4 Al8 Al19 52.331(6) 16_556 15_556
Al19 Al8 Al19 98.165(18) 6_554 15_556
Ru2 Al8 Al19 111.054(15) . 5_554
Ru4 Al8 Al19 52.331(6) . 5_554
Ru4 Al8 Al19 145.998(9) 16_556 5_554
Al19 Al8 Al19 66.41(2) 6_554 5_554
Al19 Al8 Al19 137.89(3) 15_556 5_554
Ru2 Al8 Al19 111.054(15) . 14_556
Ru4 Al8 Al19 145.998(9) . 14_556
Ru4 Al8 Al19 52.331(6) 16_556 14_556
Al19 Al8 Al19 137.89(3) 6_554 14_556
Al19 Al8 Al19 66.41(2) 15_556 14_556
Al19 Al8 Al19 98.165(18) 5_554 14_556
Ru2 Al8 Al21 55.080(13) . .
Ru4 Al8 Al21 52.050(9) . .
Ru4 Al8 Al21 105.529(17) 16_556 .
Al19 Al8 Al21 59.009(11) 6_554 .
Al19 Al8 Al21 100.666(12) 15_556 .
Al19 Al8 Al21 103.074(9) 5_554 .
Al19 Al8 Al21 157.848(17) 14_556 .
Ru2 Al8 Al21 55.079(13) . 11
Ru4 Al8 Al21 105.530(17) . 11
Ru4 Al8 Al21 52.049(9) 16_556 11
Al19 Al8 Al21 157.849(18) 6_554 11
Al19 Al8 Al21 103.072(9) 15_556 11
Al19 Al8 Al21 100.668(12) 5_554 11
Al19 Al8 Al21 59.009(11) 14_556 11
Al21 Al8 Al21 110.16(3) . 11
Ru2 Al8 Al21 55.079(13) . 20
Ru4 Al8 Al21 52.049(9) . 20
Ru4 Al8 Al21 105.530(17) 16_556 20
Al19 Al8 Al21 103.072(9) 6_554 20
Al19 Al8 Al21 157.849(18) 15_556 20
Al19 Al8 Al21 59.009(11) 5_554 20
Al19 Al8 Al21 100.668(12) 14_556 20
Al21 Al8 Al21 85.157(19) . 20
Al21 Al8 Al21 55.185(14) 11 20
Ru2 Al8 Al21 55.080(13) . 16_556
Ru4 Al8 Al21 105.529(17) . 16_556
Ru4 Al8 Al21 52.050(9) 16_556 16_556
Al19 Al8 Al21 100.666(12) 6_554 16_556
Al19 Al8 Al21 59.009(11) 15_556 16_556
Al19 Al8 Al21 157.848(17) 5_554 16_556
Al19 Al8 Al21 103.073(9) 14_556 16_556
Al21 Al8 Al21 55.183(14) . 16_556
Al21 Al8 Al21 85.157(19) 11 16_556
Al21 Al8 Al21 110.16(3) 20 16_556
Ru3 Al9 Ru3 134.63(3) 16_556 .
Ru3 Al9 Al18 144.510(11) 16_556 5_554
Ru3 Al9 Al18 55.807(7) . 5_554
Ru3 Al9 Al18 55.807(7) 16_556 14_556
Ru3 Al9 Al18 144.510(11) . 14_556
Al18 Al9 Al18 96.46(2) 5_554 14_556
Ru3 Al9 Al18 55.808(7) 16_556 15_656
Ru3 Al9 Al18 144.508(11) . 15_656
Al18 Al9 Al18 141.83(3) 5_554 15_656
Al18 Al9 Al18 70.96(2) 14_556 15_656
Ru3 Al9 Al18 144.508(11) 16_556 6_654
Ru3 Al9 Al18 55.808(7) . 6_654
Al18 Al9 Al18 70.96(2) 5_554 6_654
Al18 Al9 Al18 141.83(3) 14_556 6_654
Al18 Al9 Al18 96.45(2) 15_656 6_654
Ru3 Al9 Al7A 67.314(15) 16_556 1_545
Ru3 Al9 Al7A 67.314(15) . 1_545
Al18 Al9 Al7A 109.087(16) 5_554 1_545
Al18 Al9 Al7A 109.087(16) 14_556 1_545
Al18 Al9 Al7A 109.087(16) 15_656 1_545
Al18 Al9 Al7A 109.087(16) 6_654 1_545
Al21 Si10 Al21 64.990(13) 12_665 21_665
Al21 Si10 Al21 176.33(3) 12_665 2_665
Al21 Si10 Al21 114.881(13) 21_665 2_665
Al21 Si10 Al21 114.881(13) 12_665 17_666
Al21 Si10 Al21 176.33(3) 21_665 17_666
Al21 Si10 Al21 64.988(13) 2_665 17_666
Al21 Si10 Al19 65.880(10) 12_665 13_666
Al21 Si10 Al19 116.577(15) 21_665 13_666
Al21 Si10 Al19 116.576(15) 2_665 13_666
Al21 Si10 Al19 65.880(10) 17_666 13_666
Al21 Si10 Al19 116.577(15) 12_665 4_664
Al21 Si10 Al19 65.880(10) 21_665 4_664
Al21 Si10 Al19 65.880(10) 2_665 4_664
Al21 Si10 Al19 116.576(15) 17_666 4_664
Al19 Si10 Al19 105.64(3) 13_666 4_664
Al21 Si10 Al18 111.588(17) 12_665 4_664
Al21 Si10 Al18 65.667(11) 21_665 4_664
Al21 Si10 Al18 65.669(11) 2_665 4_664
Al21 Si10 Al18 111.589(17) 17_666 4_664
Al19 Si10 Al18 173.73(3) 13_666 4_664
Al19 Si10 Al18 80.634(15) 4_664 4_664
Al21 Si10 Al18 65.667(11) 12_665 13_666
Al21 Si10 Al18 111.588(17) 21_665 13_666
Al21 Si10 Al18 111.589(17) 2_665 13_666
Al21 Si10 Al18 65.669(11) 17_666 13_666
Al19 Si10 Al18 80.634(15) 13_666 13_666
Al19 Si10 Al18 173.73(3) 4_664 13_666
Al18 Si10 Al18 93.09(3) 4_664 13_666
Ru5 Al11 Ru5 148.12(2) 18_556 5_554
Ru5 Al11 Al16 145.672(14) 18_556 16_556
Ru5 Al11 Al16 59.952(8) 5_554 16_556
Ru5 Al11 Al16 59.952(8) 18_556 4_654
Ru5 Al11 Al16 145.672(14) 5_554 4_654
Al16 Al11 Al16 107.41(2) 16_556 4_654
Ru5 Al11 Al22 114.381(11) 18_556 .
Ru5 Al11 Al22 56.982(8) 5_554 .
Al16 Al11 Al22 98.405(12) 16_556 .
Al16 Al11 Al22 97.965(12) 4_654 .
Ru5 Al11 Al22 56.982(8) 18_556 8
Ru5 Al11 Al22 114.382(11) 5_554 8
Al16 Al11 Al22 97.965(12) 16_556 8
Al16 Al11 Al22 98.405(12) 4_654 8
Al22 Al11 Al22 152.17(2) . 8
Ru5 Al11 Al12 49.249(10) 18_556 18_556
Ru5 Al11 Al12 98.879(16) 5_554 18_556
Al16 Al11 Al12 145.156(14) 16_556 18_556
Al16 Al11 Al12 104.699(10) 4_654 18_556
Al22 Al11 Al12 90.158(15) . 18_556
Al22 Al11 Al12 63.940(13) 8 18_556
Ru5 Al12 Si12 121.045(4) . 14_556
Ru5 Al12 Si12 121.044(4) . 15_556
Si12 Al12 Si12 107.821(19) 14_556 15_556
Ru5 Al12 Al13 121.700(17) . 6
Si12 Al12 Al13 109.244(15) 14_556 6
Si12 Al12 Al13 61.310(14) 15_556 6
Ru5 Al12 Al13 121.700(17) . 5
Si12 Al12 Al13 61.311(14) 14_556 5
Si12 Al12 Al13 109.244(15) 15_556 5
Al13 Al12 Al13 60.13(2) 6 5
Ru5 Al12 Al13 118.090(19) . 16_556
Si12 Al12 Al13 60.399(16) 14_556 16_556
Si12 Al12 Al13 60.400(16) 15_556 16_556
Al13 Al12 Al13 111.055(19) 6 16_556
Al13 Al12 Al13 111.055(19) 5 16_556
Ru5 Al12 Al11 55.923(8) . 17_556
Si12 Al12 Al11 149.53(3) 14_556 17_556
Si12 Al12 Al11 65.169(8) 15_556 17_556
Al13 Al12 Al11 93.515(11) 6 17_556
Al13 Al12 Al11 148.866(16) 5 17_556
Al13 Al12 Al11 93.048(12) 16_556 17_556
Ru5 Al12 Al11 55.923(8) . 6
Si12 Al12 Al11 65.170(8) 14_556 6
Si12 Al12 Al11 149.53(3) 15_556 6
Al13 Al12 Al11 148.866(16) 6 6
Al13 Al12 Al11 93.515(11) 5 6
Al13 Al12 Al11 93.048(12) 16_556 6
Al11 Al12 Al11 104.955(15) 17_556 6
Ru4 Al13 Si12 124.466(13) . 5_554
Ru4 Al13 Si12 124.465(13) . 6_554
Si12 Al13 Si12 104.49(2) 5_554 6_554
Ru4 Al13 Al13 118.904(9) . 2
Si12 Al13 Al13 106.841(12) 5_554 2
Si12 Al13 Al13 59.937(11) 6_554 2
Ru4 Al13 Al13 118.904(9) . 3
Si12 Al13 Al13 59.937(11) 5_554 3
Si12 Al13 Al13 106.841(12) 6_554 3
Al13 Al13 Al13 60.0 2 3
Ru4 Al13 Si12 126.71(2) . 16_556
Si12 Al13 Si12 58.289(11) 5_554 16_556
Si12 Al13 Si12 58.292(11) 6_554 16_556
Al13 Al13 Si12 106.687(11) 2 16_556
Al13 Al13 Si12 106.686(11) 3 16_556
Ru4 Al13 Al17 59.366(13) . .
Si12 Al13 Al17 95.008(14) 5_554 .
Si12 Al13 Al17 95.008(13) 6_554 .
Al13 Al13 Al17 149.836(1) 2 .
Al13 Al13 Al17 149.836(1) 3 .
Si12 Al13 Al17 67.344(16) 16_556 .
Ru3 Al14 Al16 155.82(2) 4_655 .
Ru3 Al14 Ru1 140.94(2) 4_655 4_665
Al16 Al14 Ru1 63.238(15) . 4_665
Ru3 Al14 Al22 64.258(11) 4_655 23_556
Al16 Al14 Al22 104.100(15) . 23_556
Ru1 Al14 Al22 124.887(10) 4_665 23_556
Ru3 Al14 Al22 64.259(11) 4_655 4_655
Al16 Al14 Al22 104.100(15) . 4_655
Ru1 Al14 Al22 124.890(11) 4_665 4_655
Al22 Al14 Al22 110.19(2) 23_556 4_655
Ru3 Al14 Al20 95.128(16) 4_655 5
Al16 Al14 Al20 104.880(18) . 5
Ru1 Al14 Al20 53.849(13) 4_665 5
Al22 Al14 Al20 83.694(13) 23_556 5
Al22 Al14 Al20 143.41(2) 4_655 5
Ru3 Al14 Al20 95.128(16) 4_655 6_655
Al16 Al14 Al20 104.880(18) . 6_655
Ru1 Al14 Al20 53.851(13) 4_665 6_655
Al22 Al14 Al20 143.41(2) 23_556 6_655
Al22 Al14 Al20 83.694(13) 4_655 6_655
Al20 Al14 Al20 67.63(2) 5 6_655
Ru3 Al14 Al17 121.551(12) 4_655 5
Al16 Al14 Al17 62.230(12) . 5
Ru1 Al14 Al17 64.917(12) 4_665 5
Al22 Al14 Al17 62.558(11) 23_556 5
Al22 Al14 Al17 159.42(2) 4_655 5
Al20 Al14 Al17 57.057(13) 5 5
Al20 Al14 Al17 113.84(2) 6_655 5
Ru3 Al14 Al17 121.552(12) 4_655 6_655
Al16 Al14 Al17 62.230(12) . 6_655
Ru1 Al14 Al17 64.919(12) 4_665 6_655
Al22 Al14 Al17 159.42(2) 23_556 6_655
Al22 Al14 Al17 62.558(11) 4_655 6_655
Al20 Al14 Al17 113.84(2) 5 6_655
Al20 Al14 Al17 57.057(13) 6_655 6_655
Al17 Al14 Al17 116.80(2) 5 6_655
Ru3 Al15 Al15 116.622(10) . 2_655
Ru3 Al15 Al15 116.622(10) . 3_665
Al15 Al15 Al15 60.0 2_655 3_665
Ru3 Al15 Al16 148.12(2) . 16_556
Al15 Al15 Al16 90.628(13) 2_655 16_556
Al15 Al15 Al16 90.628(13) 3_665 16_556
Ru3 Al15 Ru5 118.789(10) . 6_654
Al15 Al15 Ru5 60.617(11) 2_655 6_654
Al15 Al15 Ru5 111.200(10) 3_665 6_654
Al16 Al15 Ru5 58.885(8) 16_556 6_654
Ru3 Al15 Ru5 118.789(10) . 5_554
Al15 Al15 Ru5 111.201(10) 2_655 5_554
Al15 Al15 Ru5 60.617(11) 3_665 5_554
Al16 Al15 Ru5 58.885(8) 16_556 5_554
Ru5 Al15 Ru5 116.922(16) 6_654 5_554
Ru3 Al15 Al22 62.903(11) . 20_655
Al15 Al15 Al22 94.406(11) 2_655 20_655
Al15 Al15 Al22 152.244(12) 3_665 20_655
Al16 Al15 Al22 100.923(15) 16_556 20_655
Ru5 Al15 Al22 56.932(8) 6_654 20_655
Ru5 Al15 Al22 146.29(2) 5_554 20_655
Ru3 Al15 Al22 62.905(11) . .
Al15 Al15 Al22 152.245(12) 2_655 .
Al15 Al15 Al22 94.407(11) 3_665 .
Al16 Al15 Al22 100.922(15) 16_556 .
Ru5 Al15 Al22 146.29(2) 6_654 .
Ru5 Al15 Al22 56.931(8) 5_554 .
Al22 Al15 Al22 107.82(2) 20_655 .
Ru3 Al15 Al18 53.316(9) . 5_554
Al15 Al15 Al18 95.564(12) 2_655 5_554
Al15 Al15 Al18 63.776(10) 3_665 5_554
Al16 Al15 Al18 145.184(11) 16_556 5_554
Ru5 Al15 Al18 150.250(18) 6_654 5_554
Ru5 Al15 Al18 87.118(10) 5_554 5_554
Al22 Al15 Al18 112.653(17) 20_655 5_554
Al22 Al15 Al18 60.942(13) . 5_554
Ru3 Al15 Al18 53.316(9) . 6_654
Al15 Al15 Al18 63.776(10) 2_655 6_654
Al15 Al15 Al18 95.564(12) 3_665 6_654
Al16 Al15 Al18 145.183(11) 16_556 6_654
Ru5 Al15 Al18 87.117(10) 6_654 6_654
Ru5 Al15 Al18 150.251(18) 5_554 6_654
Al22 Al15 Al18 60.939(13) 20_655 6_654
Al22 Al15 Al18 112.656(17) . 6_654
Al18 Al15 Al18 65.21(2) 5_554 6_654
Al14 Al16 Ru5 118.184(9) . 14_556
Al14 Al16 Ru5 118.184(9) . 15_656
Ru5 Al16 Ru5 121.523(18) 14_556 15_656
Al14 Al16 Al15 155.45(3) . 16_556
Ru5 Al16 Al15 61.226(9) 14_556 16_556
Ru5 Al16 Al15 61.227(9) 15_656 16_556
Al14 Al16 Al11 79.368(15) . 16_556
Ru5 Al16 Al11 58.191(9) 14_556 16_556
Ru5 Al16 Al11 120.396(18) 15_656 16_556
Al15 Al16 Al11 80.900(15) 16_556 16_556
Al14 Al16 Al11 79.368(15) . 4_655
Ru5 Al16 Al11 120.396(18) 14_556 4_655
Ru5 Al16 Al11 58.191(9) 15_656 4_655
Al15 Al16 Al11 80.900(15) 16_556 4_655
Al11 Al16 Al11 72.59(2) 16_556 4_655
Al14 Al16 Al16 111.702(13) . 3_665
Ru5 Al16 Al16 59.108(10) 14_556 3_665
Ru5 Al16 Al16 111.049(10) 15_656 3_665
Al15 Al16 Al16 89.371(13) 16_556 3_665
Al11 Al16 Al16 112.747(10) 16_556 3_665
Al11 Al16 Al16 168.128(10) 4_655 3_665
Al14 Al16 Al16 111.702(13) . 2_655
Ru5 Al16 Al16 111.049(10) 14_556 2_655
Ru5 Al16 Al16 59.108(10) 15_656 2_655
Al15 Al16 Al16 89.371(13) 16_556 2_655
Al11 Al16 Al16 168.128(10) 16_556 2_655
Al11 Al16 Al16 112.747(10) 4_655 2_655
Al16 Al16 Al16 60.0 3_665 2_655
Al14 Al16 Ru1 60.053(15) . 4_665
Ru5 Al16 Ru1 110.100(11) 14_556 4_665
Ru5 Al16 Ru1 110.102(11) 15_656 4_665
Al15 Al16 Ru1 144.50(2) 16_556 4_665
Al11 Al16 Ru1 125.994(14) 16_556 4_665
Al11 Al16 Ru1 125.996(14) 4_655 4_665
Al16 Al16 Ru1 60.398(8) 3_665 4_665
Al16 Al16 Ru1 60.399(8) 2_655 4_665
Al14 Al16 Al17 65.146(11) . 5
Ru5 Al16 Al17 57.792(9) 14_556 5
Ru5 Al16 Al17 172.43(2) 15_656 5
Al15 Al16 Al17 118.979(12) 16_556 5
Al11 Al16 Al17 66.320(12) 16_556 5
Al11 Al16 Al17 129.228(18) 4_655 5
Al16 Al16 Al17 61.715(10) 3_665 5
Al16 Al16 Al17 113.550(11) 2_655 5
Ru1 Al16 Al17 64.981(12) 4_665 5
Al14 Al16 Al17 65.146(11) . 6_655
Ru5 Al16 Al17 172.43(2) 14_556 6_655
Ru5 Al16 Al17 57.792(9) 15_656 6_655
Al15 Al16 Al17 118.979(12) 16_556 6_655
Al11 Al16 Al17 129.228(18) 16_556 6_655
Al11 Al16 Al17 66.320(12) 4_655 6_655
Al16 Al16 Al17 113.550(11) 3_665 6_655
Al16 Al16 Al17 61.715(10) 2_655 6_655
Ru1 Al16 Al17 64.983(12) 4_665 6_655
Al17 Al16 Al17 121.72(2) 5 6_655
Ru5 Al17 Ru4 147.93(2) 16_556 .
Ru5 Al17 Al20 153.19(2) 16_556 .
Ru4 Al17 Al20 58.874(14) . .
Ru5 Al17 Al16 56.953(12) 16_556 6_554
Ru4 Al17 Al16 146.017(14) . 6_554
Al20 Al17 Al16 100.072(19) . 6_554
Ru5 Al17 Al16 56.953(12) 16_556 5_564
Ru4 Al17 Al16 146.017(14) . 5_564
Al20 Al17 Al16 100.072(19) . 5_564
Al16 Al17 Al16 56.57(2) 6_554 5_564
Ru5 Al17 Al14 105.850(15) 16_556 6_554
Ru4 Al17 Al14 93.615(14) . 6_554
Al20 Al17 Al14 60.401(14) . 6_554
Al16 Al17 Al14 52.624(13) 6_554 6_554
Al16 Al17 Al14 97.922(19) 5_564 6_554
Ru5 Al17 Al14 105.849(15) 16_556 5_564
Ru4 Al17 Al14 93.616(14) . 5_564
Al20 Al17 Al14 60.401(14) . 5_564
Al16 Al17 Al14 97.921(19) 6_554 5_564
Al16 Al17 Al14 52.624(13) 5_564 5_564
Al14 Al17 Al14 103.62(2) 6_554 5_564
Ru5 Al17 Al22 110.320(12) 16_556 2
Ru4 Al17 Al22 60.046(10) . 2
Al20 Al17 Al22 82.197(13) . 2
Al16 Al17 Al22 149.467(17) 6_554 2
Al16 Al17 Al22 92.949(12) 5_564 2
Al14 Al17 Al22 142.28(2) 6_554 2
Al14 Al17 Al22 56.479(11) 5_564 2
Ru5 Al17 Al22 110.320(12) 16_556 21
Ru4 Al17 Al22 60.046(10) . 21
Al20 Al17 Al22 82.196(13) . 21
Al16 Al17 Al22 92.949(12) 6_554 21
Al16 Al17 Al22 149.467(17) 5_564 21
Al14 Al17 Al22 56.478(11) 6_554 21
Al14 Al17 Al22 142.28(2) 5_564 21
Al22 Al17 Al22 117.42(2) 2 21
Ru5 Al17 Al13 98.129(17) 16_556 .
Ru4 Al17 Al13 49.805(12) . .
Al20 Al17 Al13 108.68(2) . .
Al16 Al17 Al13 139.605(16) 6_554 .
Al16 Al17 Al13 139.605(17) 5_564 .
Al14 Al17 Al13 120.698(13) 6_554 .
Al14 Al17 Al13 120.699(13) 5_564 .
Al22 Al17 Al13 64.443(11) 2 .
Al22 Al17 Al13 64.443(11) 21 .
Ru5 Al17 Ru1 101.882(16) 16_556 .
Ru4 Al17 Ru1 110.184(16) . .
Al20 Al17 Ru1 51.310(14) . .
Al16 Al17 Ru1 55.644(12) 6_554 .
Al16 Al17 Ru1 55.644(12) 5_564 .
Al14 Al17 Ru1 53.198(12) 6_554 .
Al14 Al17 Ru1 53.197(12) 5_564 .
Al22 Al17 Ru1 107.843(12) 2 .
Al22 Al17 Ru1 107.843(12) 21 .
Al13 Al17 Ru1 159.989(19) . .
Ru3 Al18 Ru3 155.31(2) 5_565 6
Ru3 Al18 Al9 125.99(2) 5_565 15_556
Ru3 Al18 Al9 57.814(12) 6 15_556
Ru3 Al18 Al9 57.813(12) 5_565 14_566
Ru3 Al18 Al9 125.99(2) 6 14_566
Al9 Al18 Al9 69.98(3) 15_556 14_566
Ru3 Al18 Si10 102.021(12) 5_565 13_666
Ru3 Al18 Si10 102.021(12) 6 13_666
Al9 Al18 Si10 72.055(15) 15_556 13_666
Al9 Al18 Si10 72.055(15) 14_566 13_666
Ru3 Al18 Al22 61.068(10) 5_565 22_556
Ru3 Al18 Al22 122.273(19) 6 22_556
Al9 Al18 Al22 165.41(2) 15_556 22_556
Al9 Al18 Al22 111.737(16) 14_566 22_556
Si10 Al18 Al22 94.407(18) 13_666 22_556
Ru3 Al18 Al22 122.273(19) 5_565 6
Ru3 Al18 Al22 61.069(10) 6 6
Al9 Al18 Al22 111.739(16) 15_556 6
Al9 Al18 Al22 165.41(2) 14_566 6
Si10 Al18 Al22 94.407(18) 13_666 6
Al22 Al18 Al22 62.786(17) 22_556 6
Ru3 Al18 Al21 54.558(8) 5_565 24_556
Ru3 Al18 Al21 149.39(2) 6 24_556
Al9 Al18 Al21 117.818(19) 15_556 24_556
Al9 Al18 Al21 67.734(17) 14_566 24_556
Si10 Al18 Al21 52.855(11) 13_666 24_556
Al22 Al18 Al21 53.475(11) 22_556 24_556
Al22 Al18 Al21 99.961(18) 6 24_556
Ru3 Al18 Al21 149.39(2) 5_565 5
Ru3 Al18 Al21 54.557(8) 6 5
Al9 Al18 Al21 67.734(17) 15_556 5
Al9 Al18 Al21 117.820(19) 14_566 5
Si10 Al18 Al21 52.856(11) 13_666 5
Al22 Al18 Al21 99.962(18) 22_556 5
Al22 Al18 Al21 53.475(11) 6 5
Al21 Al18 Al21 95.01(2) 24_556 5
Ru3 Al18 Al15 53.583(12) 5_565 5_565
Ru3 Al18 Al15 105.644(19) 6 5_565
Al9 Al18 Al15 137.67(2) 15_556 5_565
Al9 Al18 Al15 103.448(12) 14_566 5_565
Si10 Al18 Al15 147.850(16) 13_666 5_565
Al22 Al18 Al15 56.817(13) 22_556 5_565
Al22 Al18 Al15 85.011(16) 6 5_565
Al21 Al18 Al15 95.487(13) 24_556 5_565
Al21 Al18 Al15 138.351(19) 5 5_565
Ru3 Al18 Al15 105.644(19) 5_565 6
Ru3 Al18 Al15 53.583(12) 6 6
Al9 Al18 Al15 103.450(12) 15_556 6
Al9 Al18 Al15 137.67(2) 14_566 6
Si10 Al18 Al15 147.850(16) 13_666 6
Al22 Al18 Al15 85.010(16) 22_556 6
Al22 Al18 Al15 56.817(13) 6 6
Al21 Al18 Al15 138.351(19) 24_556 6
Al21 Al18 Al15 95.486(13) 5 6
Al15 Al18 Al15 52.45(2) 5_565 6
Ru4 Al19 Ru4 149.55(2) 6 5
Ru4 Al19 Si10 105.209(11) 6 13_666
Ru4 Al19 Si10 105.209(11) 5 13_666
Ru4 Al19 Al21 55.686(8) 6 24_556
Ru4 Al19 Al21 151.51(2) 5 24_556
Si10 Al19 Al21 54.050(11) 13_666 24_556
Ru4 Al19 Al21 151.51(2) 6 5
Ru4 Al19 Al21 55.684(8) 5 5
Si10 Al19 Al21 54.051(11) 13_666 5
Al21 Al19 Al21 96.76(2) 24_556 5
Ru4 Al19 Al8 62.540(11) 6 15_556
Ru4 Al19 Al8 131.89(2) 5 15_556
Si10 Al19 Al8 64.912(13) 13_666 15_556
Al21 Al19 Al8 61.873(15) 24_556 15_556
Al21 Al19 Al8 113.773(17) 5 15_556
Ru4 Al19 Al8 131.89(2) 6 14_556
Ru4 Al19 Al8 62.539(11) 5 14_556
Si10 Al19 Al8 64.912(13) 13_666 14_556
Al21 Al19 Al8 113.773(17) 24_556 14_556
Al21 Al19 Al8 61.872(15) 5 14_556
Al8 Al19 Al8 71.60(3) 15_556 14_556
Ru2 Al20 Ru1 152.79(2) . .
Ru2 Al20 Ru4 78.327(15) . .
Ru1 Al20 Ru4 128.88(2) . .
Ru2 Al20 Al17 137.97(2) . .
Ru1 Al20 Al17 69.239(16) . .
Ru4 Al20 Al17 59.642(15) . .
Ru2 Al20 Al14 126.629(12) . 6_554
Ru1 Al20 Al14 58.778(12) . 6_554
Ru4 Al20 Al14 95.421(14) . 6_554
Al17 Al20 Al14 62.542(12) . 6_554
Ru2 Al20 Al14 126.628(12) . 5_564
Ru1 Al20 Al14 58.777(12) . 5_564
Ru4 Al20 Al14 95.422(14) . 5_564
Al17 Al20 Al14 62.543(12) . 5_564
Al14 Al20 Al14 106.66(2) 6_554 5_564
Ru2 Al20 Al21 58.517(11) . 20
Ru1 Al20 Al21 133.131(10) . 20
Ru4 Al20 Al21 54.888(11) . 20
Al17 Al20 Al21 93.838(16) . 20
Al14 Al20 Al21 74.518(11) 6_554 20
Al14 Al20 Al21 149.82(2) 5_564 20
Ru2 Al20 Al21 58.516(11) . .
Ru1 Al20 Al21 133.131(10) . .
Ru4 Al20 Al21 54.889(11) . .
Al17 Al20 Al21 93.839(16) . .
Al14 Al20 Al21 149.82(2) 6_554 .
Al14 Al20 Al21 74.519(11) 5_564 .
Al21 Al20 Al21 89.703(19) 20 .
Ru2 Al20 Al6 58.371(11) . .
Ru1 Al20 Al6 94.421(16) . .
Ru4 Al20 Al6 136.698(18) . .
Al17 Al20 Al6 163.66(2) . .
Al14 Al20 Al6 109.615(14) 6_554 .
Al14 Al20 Al6 109.614(14) 5_564 .
Al21 Al20 Al6 97.720(14) 20 .
Al21 Al20 Al6 97.719(14) . .
Ru3 Al21 Ru4 124.599(12) 2 .
Ru3 Al21 Si10 108.967(19) 2 3_565
Ru4 Al21 Si10 109.984(18) . 3_565
Ru3 Al21 Ru2 124.893(13) 2 .
Ru4 Al21 Ru2 77.661(9) . .
Si10 Al21 Ru2 106.948(13) 3_565 .
Ru3 Al21 Al22 65.183(10) 2 2
Ru4 Al21 Al22 65.993(10) . 2
Si10 Al21 Al22 108.578(14) 3_565 2
Ru2 Al21 Al22 135.745(15) . 2
Ru3 Al21 Al7A 69.093(16) 2 2_665
Ru4 Al21 Al7A 129.84(3) . 2_665
Si10 Al21 Al7A 108.10(2) 3_565 2_665
Ru2 Al21 Al7A 60.74(2) . 2_665
Al22 Al21 Al7A 128.227(14) 2 2_665
Ru3 Al21 Al21 112.630(7) 2 16_556
Ru4 Al21 Al21 121.167(7) . 16_556
Si10 Al21 Al21 57.506(7) 3_565 16_556
Ru2 Al21 Al21 58.258(7) . 16_556
Al22 Al21 Al21 165.270(11) 2 16_556
Al7A Al21 Al21 59.045(8) 2_665 16_556
Ru3 Al21 Al20 92.939(12) 2 .
Ru4 Al21 Al20 58.870(11) . .
Si10 Al21 Al20 157.278(19) 3_565 .
Ru2 Al21 Al20 53.157(11) . .
Al22 Al21 Al20 85.695(15) 2 .
Al7A Al21 Al20 73.54(3) 2_665 .
Al21 Al21 Al20 109.035(11) 16_556 .
Ru3 Al21 Al7B 73.9(4) 2 2_665
Ru4 Al21 Al7B 121.3(7) . 2_665
Si10 Al21 Al7B 113.8(5) 3_565 2_665
Ru2 Al21 Al7B 53.7(6) . 2_665
Al22 Al21 Al7B 128.29(4) 2 2_665
Al7A Al21 Al7B 8.5(7) 2_665 2_665
Al21 Al21 Al7B 61.1(2) 16_556 2_665
Al20 Al21 Al7B 65.7(7) . 2_665
Ru3 Al21 Al19 121.556(15) 2 6_554
Ru4 Al21 Al19 54.869(10) . 6_554
Si10 Al21 Al19 60.068(14) 3_565 6_554
Ru2 Al21 Al19 112.277(14) . 6_554
Al22 Al21 Al19 66.211(14) 2 6_554
Al7A Al21 Al19 165.284(16) 2_665 6_554
Al21 Al21 Al19 106.263(11) 16_556 6_554
Al20 Al21 Al19 113.673(16) . 6_554
Al7B Al21 Al19 164.1(3) 2_665 6_554
Ru3 Al21 Al18 53.620(10) 2 6_554
Ru4 Al21 Al18 119.978(15) . 6_554
Si10 Al21 Al18 61.477(16) 3_565 6_554
Ru2 Al21 Al18 160.730(16) . 6_554
Al22 Al21 Al18 63.185(14) 2 6_554
Al7A Al21 Al18 106.39(3) 2_665 6_554
Al21 Al21 Al18 103.299(12) 16_556 6_554
Al20 Al21 Al18 140.802(16) . 6_554
Al7B Al21 Al18 114.5(7) 2_665 6_554
Al19 Al21 Al18 76.519(14) 6_554 6_554
Ru3 Al21 Al8 174.030(13) 2 .
Ru4 Al21 Al8 61.076(7) . .
Si10 Al21 Al8 65.828(17) 3_565 .
Ru2 Al21 Al8 56.270(13) . .
Al22 Al21 Al8 118.646(15) 2 .
Al7A Al21 Al8 109.153(18) 2_665 .
Al21 Al21 Al8 62.409(7) 16_556 .
Al20 Al21 Al8 91.959(14) . .
Al7B Al21 Al8 105.1(4) 2_665 .
Al19 Al21 Al8 59.118(16) 6_554 .
Al18 Al21 Al8 122.984(17) 6_554 .
Ru5 Al22 Al21 152.064(16) 5_554 3
Ru5 Al22 Al14 112.849(15) 5_554 4_654
Al21 Al22 Al14 79.305(15) 3 4_654
Ru5 Al22 Ru3 111.124(12) 5_554 .
Al21 Al22 Ru3 55.280(9) 3 .
Al14 Al22 Ru3 52.070(11) 4_654 .
Ru5 Al22 Al15 58.951(11) 5_554 .
Al21 Al22 Al15 106.645(16) 3 .
Al14 Al22 Al15 69.825(14) 4_654 .
Ru3 Al22 Al15 53.074(10) . .
Ru5 Al22 Ru4 142.228(13) 5_554 3
Al21 Al22 Ru4 55.548(10) 3 3
Al14 Al22 Ru4 93.666(13) 4_654 3
Ru3 Al22 Ru4 106.351(11) . 3
Al15 Al22 Ru4 158.735(15) . 3
Ru5 Al22 Al11 55.283(7) 5_554 .
Al21 Al22 Al11 149.021(17) 3 .
Al14 Al22 Al11 71.956(15) 4_654 .
Ru3 Al22 Al11 111.370(15) . .
Al15 Al22 Al11 74.263(14) . .
Ru4 Al22 Al11 114.289(13) 3 .
Ru5 Al22 Al18 88.970(13) 5_554 5_554
Al21 Al22 Al18 63.336(13) 3 5_554
Al14 Al22 Al18 103.407(15) 4_654 5_554
Ru3 Al22 Al18 51.553(8) . 5_554
Al15 Al22 Al18 62.241(16) . 5_554
Ru4 Al22 Al18 111.326(15) 3 5_554
Al11 Al22 Al18 134.333(17) . 5_554
Ru5 Al22 Al17 113.857(14) 5_554 3
Al21 Al22 Al17 94.070(15) 3 3
Al14 Al22 Al17 60.964(14) 4_654 3
Ru3 Al22 Al17 109.008(15) . 3
Al15 Al22 Al17 121.320(17) . 3
Ru4 Al22 Al17 55.581(10) 3 3
Al11 Al22 Al17 62.047(11) . 3
Al18 Al22 Al17 155.632(17) 5_554 3
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Ru1 Al20 2.4870(5) 3_565
Ru1 Al20 2.4870(5) .
Ru1 Al20 2.4870(5) 2_665
Ru1 Al14 2.6339(5) 4_664
Ru1 Al14 2.6339(5) 5_564
Ru1 Al14 2.6339(5) 6_554
Ru1 Al16 2.7143(5) 5_564
Ru1 Al16 2.7143(5) 4_664
Ru1 Al16 2.7143(5) 6_554
Ru1 Al17 2.9793(5) .
Ru1 Al17 2.9794(5) 3_565
Ru1 Al17 2.9794(5) 2_665
Ru2 Al20 2.4615(5) .
Ru2 Al20 2.4615(5) 16_556
Ru2 Al7B 2.486(15) 2_665
Ru2 Al7B 2.486(15) 3_565
Ru2 Al21 2.6229(3) 11
Ru2 Al21 2.6229(3) 20
Ru2 Al21 2.6230(3) .
Ru2 Al21 2.6230(3) 16_556
Ru2 Al8 2.6604(7) .
Ru2 Al6 2.67104(15) .
Ru2 Al7A 2.6829(6) 2_665
Ru2 Al7A 2.6829(7) 3_565
Ru3 Al14 2.4348(5) 4_654
Ru3 Al18 2.48812(14) 5_554
Ru3 Al18 2.48818(14) 6_654
Ru3 Al15 2.4968(5) .
Ru3 Al21 2.5178(3) 19_655
Ru3 Al21 2.5179(3) 3
Ru3 Al9 2.5458(3) .
Ru3 Al22 2.7804(3) 20_655
Ru3 Al22 2.7805(3) .
Ru3 Al7A 2.9523(8) 1_545
Ru4 Al13 2.3921(4) .
Ru4 Al19 2.52958(15) 6_554
Ru4 Al19 2.52959(15) 5_554
Ru4 Al21 2.5546(3) 20
Ru4 Al21 2.5547(3) .
Ru4 Al20 2.6732(5) .
Ru4 Al17 2.6946(5) .
Ru4 Al22 2.8301(3) 2
Ru4 Al22 2.8301(3) 21
Ru4 Al8 2.8356(2) .
Ru5 Al12 2.3448(4) .
Ru5 Al11 2.56369(14) 17_556
Ru5 Al11 2.56369(14) 6
Ru5 Al16 2.6113(2) 14_566
Ru5 Al16 2.6114(2) 15_556
Ru5 Al22 2.6152(3) 22_556
Ru5 Al22 2.6152(3) 6
Ru5 Al17 2.6359(5) 16_556
Ru5 Al15 2.6736(2) 5_565
Ru5 Al15 2.6736(2) 6
Al6 Al7B 2.25(4) 2_665
Al6 Al7B 2.25(4) .
Al6 Al7B 2.25(4) 3_565
Al6 Al7A 2.6945(13) .
Al6 Al7A 2.6945(13) 2_665
Al6 Al7A 2.6945(13) 3_565
Al6 Al20 2.9467(5) .
Al6 Al20 2.9467(5) 18_566
Al6 Al20 2.9467(5) 3_565
Al7A Al21 2.6829(5) 10_665
Al7A Al21 2.6829(5) 19_665
Al7A Al21 2.6829(5) 3_565
Al7A Al21 2.6829(5) 18_566
Al7A Al9 2.7705(15) 1_565
Al7B Al21 2.859(19) 10_665
Al7B Al21 2.859(19) 19_665
Al7B Al21 2.859(19) 18_566
Al7B Al21 2.859(19) 3_565
Al8 Al19 2.8994(5) 6_554
Al8 Al19 2.8994(5) 15_556
Al8 Al19 2.8994(5) 5_554
Al8 Al19 2.8994(5) 14_556
Al8 Al21 2.9794(5) .
Al8 Al21 2.9794(5) 11
Al8 Al21 2.9794(5) 20
Al8 Al21 2.9795(5) 16_556
Al9 Al18 2.7560(5) 5_554
Al9 Al18 2.7560(5) 14_556
Al9 Al18 2.7561(5) 15_656
Al9 Al18 2.7561(5) 6_654
Si10 Al21 2.5687(3) 12_665
Si10 Al21 2.5687(3) 21_665
Si10 Al21 2.5688(3) 2_665
Si10 Al21 2.5688(3) 17_666
Si10 Al19 2.7499(6) 13_666
Si10 Al19 2.7499(6) 4_664
Si10 Al18 2.8315(7) 4_664
Si10 Al18 2.8315(7) 13_666
Al11 Al16 2.6601(5) 16_556
Al11 Al16 2.6601(5) 4_654
Al11 Al22 2.8864(3) .
Al11 Al22 2.8864(3) 8
Al11 Al12 2.9872(5) 18_556
Al12 Al13 2.5642(4) 6
Al12 Al13 2.5642(4) 5
Al12 Al13 2.5870(6) 16_556
Al13 Al13 2.5691(8) 2
Al13 Al13 2.5691(8) 3
Al13 Al17 2.9580(7) .
Al14 Al16 2.5410(6) .
Al14 Al22 2.7665(4) 23_556
Al14 Al22 2.7665(4) 4_655
Al14 Al20 2.8429(5) 5
Al14 Al20 2.8429(5) 6_655
Al14 Al17 2.9014(4) 5
Al14 Al17 2.9014(4) 6_655
Al15 Al15 2.6236(9) 2_655
Al15 Al15 2.6236(9) 3_665
Al15 Al16 2.6386(6) 16_556
Al15 Al22 2.8077(4) 20_655
Al15 Al22 2.8077(4) .
Al15 Al18 2.9686(6) 5_554
Al15 Al18 2.9687(6) 6_654
Al16 Al16 2.6814(8) 3_665
Al16 Al16 2.6814(8) 2_655
Al16 Al17 2.8293(5) 5
Al16 Al17 2.8293(5) 6_655
Al17 Al20 2.7440(7) .
Al17 Al22 2.9451(4) 2
Al17 Al22 2.9451(4) 21
Al18 Al22 2.9324(6) 22_556
Al18 Al22 2.9324(6) 6
Al18 Al21 2.9363(5) 24_556
Al18 Al21 2.9364(5) 5
Al19 Al21 2.8961(5) 24_556
Al19 Al21 2.8961(5) 5
Al20 Al21 2.8582(5) 20
Al20 Al21 2.8583(5) .
Al21 Al22 2.6404(4) 2
Al21 Al21 2.7599(6) 16_556
