#------------------------------------------------------------------------------
#$Date: 2016-03-23 22:32:00 +0200 (Wed, 23 Mar 2016) $
#$Revision: 179484 $
#$URL: svn://www.crystallography.net/cod/cif/4/33/81/4338170.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_4338170
loop_
_publ_author_name
'Zhang, Xu'
'Yi, Wei'
'Feng, Kai'
'Wu, Desheng'
'Yang, Yifeng'
'Zheng, Ping'
'Yao, Jiyong'
'Matsushita, Yoshitaka'
'Sato, Akira'
'Jiang, Hongwei'
'Wang, Hai'
'Shi, Youguo'
'Yamaura, Kazunari'
'Wang, Nanlin'
_publ_section_title
;
 Crystal Growth, Structural, Electrical, and Magnetic Properties of
 Mixed-Valent Compounds YbOs2Al10 and LuOs2Al10.
;
_journal_issue                   9
_journal_name_full               'Inorganic chemistry'
_journal_page_first              4387
_journal_page_last               4393
_journal_paper_doi               10.1021/ic403168v
_journal_volume                  53
_journal_year                    2014
_chemical_formula_sum            'Al10 Os2 Yb'
_chemical_formula_weight         823.24
_space_group_IT_number           63
_space_group_name_Hall           '-C 2c 2'
_space_group_name_H-M_alt        'C m c m'
_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
_audit_update_record
;
2014-03-08 # Formatted by publCIF

;
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.1005(4)
_cell_length_b                   10.1855(4)
_cell_length_c                   9.1118(5)
_cell_measurement_reflns_used    3568
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      28.17
_cell_measurement_theta_min      3.01
_cell_volume                     844.60(7)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_detector_area_resol_mean 28.5714
_diffrn_measured_fraction_theta_full 1.000
_diffrn_measured_fraction_theta_max 1.000
_diffrn_measurement_device_type  'Bruker APEX-II CCD'
_diffrn_measurement_method       'φ and 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  0.0527
_diffrn_reflns_av_sigmaI/netI    0.0373
_diffrn_reflns_limit_h_max       10
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       12
_diffrn_reflns_limit_l_min       -12
_diffrn_reflns_number            3570
_diffrn_reflns_theta_full        27.93
_diffrn_reflns_theta_max         29.73
_diffrn_reflns_theta_min         3.21
_exptl_absorpt_coefficient_mu    41.956
_exptl_absorpt_correction_T_max  0.0550
_exptl_absorpt_correction_T_min  0.0076
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   ' '
_exptl_crystal_colour            Metallic
_exptl_crystal_density_diffrn    6.474
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Plate
_exptl_crystal_F_000             1408
_exptl_crystal_size_max          0.12
_exptl_crystal_size_mid          0.06
_exptl_crystal_size_min          0.05
_refine_diff_density_max         2.721
_refine_diff_density_min         -2.723
_refine_diff_density_rms         0.684
_refine_ls_extinction_coef       0.0084(4)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.442
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     41
_refine_ls_number_reflns         563
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.442
_refine_ls_R_factor_all          0.0291
_refine_ls_R_factor_gt           0.0288
_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)+(0.0400P)²+0.0000P] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0793
_refine_ls_wR_factor_ref         0.0795
_reflns_number_gt                559
_reflns_number_total             563
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic403168v_si_002.cif
_cod_data_source_block           final
_cod_depositor_comments
'Adding full bibliography for 4338170--4338171.cif.'
_cod_database_code               4338170
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-x, -y, z+1/2'
'x, -y, -z'
'-x, y, -z+1/2'
'x+1/2, y+1/2, z'
'-x+1/2, -y+1/2, z+1/2'
'x+1/2, -y+1/2, -z'
'-x+1/2, y+1/2, -z+1/2'
'-x, -y, -z'
'x, y, -z-1/2'
'-x, y, z'
'x, -y, z-1/2'
'-x+1/2, -y+1/2, -z'
'x+1/2, y+1/2, -z-1/2'
'-x+1/2, y+1/2, z'
'x+1/2, -y+1/2, z-1/2'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
Os1 Os 0.2500 0.2500 0.0000 0.0041(3) Uani 1 2 d S
Yb1 Yb 0.0000 0.37276(5) 0.2500 0.0069(3) Uani 1 4 d S
Al1 Al 0.3467(3) 0.3696(2) 0.2500 0.0077(6) Uani 1 2 d S
Al2 Al 0.0000 0.1241(3) 0.0452(4) 0.0094(6) Uani 1 2 d S
Al3 Al 0.2200(4) 0.1366(2) 0.2500 0.0082(6) Uani 1 2 d S
Al4 Al 0.0000 0.6554(3) 0.0997(3) 0.0073(5) Uani 1 2 d S
Al5 Al 0.2762(6) 0.0000 0.0000 0.0078(9) Uani 1 2 d S
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'
Os Os -1.2165 7.6030 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Yb Yb -0.3850 5.5486 '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
Al5 Os1 Al5 180.0 13 .
Al5 Os1 Al3 115.96(6) 13 .
Al5 Os1 Al3 64.04(6) . .
Al5 Os1 Al3 64.04(6) 13 13
Al5 Os1 Al3 115.96(6) . 13
Al3 Os1 Al3 180.00(10) . 13
Al5 Os1 Al4 63.56(12) 13 9_565
Al5 Os1 Al4 116.44(12) . 9_565
Al3 Os1 Al4 112.25(10) . 9_565
Al3 Os1 Al4 67.75(10) 13 9_565
Al5 Os1 Al4 116.44(12) 13 5_545
Al5 Os1 Al4 63.56(12) . 5_545
Al3 Os1 Al4 67.75(10) . 5_545
Al3 Os1 Al4 112.25(10) 13 5_545
Al4 Os1 Al4 180.00(11) 9_565 5_545
Al5 Os1 Al2 113.73(12) 13 .
Al5 Os1 Al2 66.27(12) . .
Al3 Os1 Al2 63.41(11) . .
Al3 Os1 Al2 116.59(11) 13 .
Al4 Os1 Al2 59.17(8) 9_565 .
Al4 Os1 Al2 120.83(8) 5_545 .
Al5 Os1 Al2 66.27(12) 13 13
Al5 Os1 Al2 113.73(12) . 13
Al3 Os1 Al2 116.59(11) . 13
Al3 Os1 Al2 63.41(11) 13 13
Al4 Os1 Al2 120.83(8) 9_565 13
Al4 Os1 Al2 59.17(8) 5_545 13
Al2 Os1 Al2 180.00(18) . 13
Al5 Os1 Al1 65.53(6) 13 .
Al5 Os1 Al1 114.47(7) . .
Al3 Os1 Al1 59.65(7) . .
Al3 Os1 Al1 120.35(7) 13 .
Al4 Os1 Al1 113.79(9) 9_565 .
Al4 Os1 Al1 66.21(9) 5_545 .
Al2 Os1 Al1 111.35(9) . .
Al2 Os1 Al1 68.65(9) 13 .
Al5 Os1 Al1 114.47(7) 13 13
Al5 Os1 Al1 65.53(7) . 13
Al3 Os1 Al1 120.35(7) . 13
Al3 Os1 Al1 59.65(7) 13 13
Al4 Os1 Al1 66.21(9) 9_565 13
Al4 Os1 Al1 113.79(9) 5_545 13
Al2 Os1 Al1 68.65(9) . 13
Al2 Os1 Al1 111.35(9) 13 13
Al1 Os1 Al1 180.0 . 13
Al5 Os1 Yb1 65.04(8) 13 .
Al5 Os1 Yb1 114.96(8) . .
Al3 Os1 Yb1 60.52(7) . .
Al3 Os1 Yb1 119.48(7) 13 .
Al4 Os1 Yb1 61.68(6) 9_565 .
Al4 Os1 Yb1 118.32(6) 5_545 .
Al2 Os1 Yb1 60.39(7) . .
Al2 Os1 Yb1 119.61(7) 13 .
Al1 Os1 Yb1 60.03(6) . .
Al1 Os1 Yb1 119.97(6) 13 .
Al5 Os1 Yb1 114.96(8) 13 13
Al5 Os1 Yb1 65.04(8) . 13
Al3 Os1 Yb1 119.48(7) . 13
Al3 Os1 Yb1 60.52(7) 13 13
Al4 Os1 Yb1 118.32(6) 9_565 13
Al4 Os1 Yb1 61.68(6) 5_545 13
Al2 Os1 Yb1 119.61(7) . 13
Al2 Os1 Yb1 60.39(7) 13 13
Al1 Os1 Yb1 119.97(6) . 13
Al1 Os1 Yb1 60.03(6) 13 13
Yb1 Os1 Yb1 180.0 . 13
Al3 Yb1 Al3 79.55(11) 11 .
Al3 Yb1 Al2 51.78(5) 11 .
Al3 Yb1 Al2 51.78(5) . .
Al3 Yb1 Al2 51.78(5) 11 10_556
Al3 Yb1 Al2 51.78(5) . 10_556
Al2 Yb1 Al2 72.78(12) . 10_556
Al3 Yb1 Al1 49.64(7) 11 11
Al3 Yb1 Al1 129.19(7) . 11
Al2 Yb1 Al1 89.53(3) . 11
Al2 Yb1 Al1 89.53(3) 10_556 11
Al3 Yb1 Al1 129.19(7) 11 .
Al3 Yb1 Al1 49.64(7) . .
Al2 Yb1 Al1 89.53(3) . .
Al2 Yb1 Al1 89.53(3) 10_556 .
Al1 Yb1 Al1 178.83(8) 11 .
Al3 Yb1 Al4 133.95(5) 11 10_556
Al3 Yb1 Al4 133.95(5) . 10_556
Al2 Yb1 Al4 169.06(8) . 10_556
Al2 Yb1 Al4 118.16(8) 10_556 10_556
Al1 Yb1 Al4 90.53(4) 11 10_556
Al1 Yb1 Al4 90.53(4) . 10_556
Al3 Yb1 Al4 133.95(5) 11 .
Al3 Yb1 Al4 133.95(5) . .
Al2 Yb1 Al4 118.16(8) . .
Al2 Yb1 Al4 169.06(8) 10_556 .
Al1 Yb1 Al4 90.53(4) 11 .
Al1 Yb1 Al4 90.53(4) . .
Al4 Yb1 Al4 50.90(11) 10_556 .
Al3 Yb1 Al4 86.05(4) 11 9_565
Al3 Yb1 Al4 86.05(4) . 9_565
Al2 Yb1 Al4 48.47(8) . 9_565
Al2 Yb1 Al4 121.25(7) 10_556 9_565
Al1 Yb1 Al4 89.947(4) 11 9_565
Al1 Yb1 Al4 89.947(4) . 9_565
Al4 Yb1 Al4 120.59(6) 10_556 9_565
Al4 Yb1 Al4 69.69(8) . 9_565
Al3 Yb1 Al4 86.05(4) 11 2_565
Al3 Yb1 Al4 86.05(4) . 2_565
Al2 Yb1 Al4 121.25(7) . 2_565
Al2 Yb1 Al4 48.47(8) 10_556 2_565
Al1 Yb1 Al4 89.947(4) 11 2_565
Al1 Yb1 Al4 89.947(4) . 2_565
Al4 Yb1 Al4 69.69(8) 10_556 2_565
Al4 Yb1 Al4 120.59(6) . 2_565
Al4 Yb1 Al4 169.72(10) 9_565 2_565
Al3 Yb1 Al5 133.84(3) 11 6
Al3 Yb1 Al5 84.70(6) . 6
Al2 Yb1 Al5 136.18(6) . 6
Al2 Yb1 Al5 84.67(5) 10_556 6
Al1 Yb1 Al5 128.14(7) 11 6
Al1 Yb1 Al5 52.44(7) . 6
Al4 Yb1 Al5 49.64(6) 10_556 6
Al4 Yb1 Al5 86.69(4) . 6
Al4 Yb1 Al5 135.94(6) 9_565 6
Al4 Yb1 Al5 49.56(5) 2_565 6
Al3 Yb1 Al5 84.70(6) 11 5_455
Al3 Yb1 Al5 133.84(3) . 5_455
Al2 Yb1 Al5 84.67(5) . 5_455
Al2 Yb1 Al5 136.18(6) 10_556 5_455
Al1 Yb1 Al5 52.44(7) 11 5_455
Al1 Yb1 Al5 128.14(7) . 5_455
Al4 Yb1 Al5 86.69(4) 10_556 5_455
Al4 Yb1 Al5 49.64(6) . 5_455
Al4 Yb1 Al5 49.56(5) 9_565 5_455
Al4 Yb1 Al5 135.94(6) 2_565 5_455
Al5 Yb1 Al5 134.03(5) 6 5_455
Al3 Al1 Os1 57.15(5) . .
Al3 Al1 Os1 57.15(5) . 6
Os1 Al1 Os1 113.17(9) . 6
Al3 Al1 Al3 141.49(12) . 15
Os1 Al1 Al3 111.42(7) . 15
Os1 Al1 Al3 111.42(7) 6 15
Al3 Al1 Al1 115.92(10) . 11_655
Os1 Al1 Al1 108.82(6) . 11_655
Os1 Al1 Al1 108.82(6) 6 11_655
Al3 Al1 Al1 102.59(10) 15 11_655
Al3 Al1 Al5 104.26(10) . 6
Os1 Al1 Al5 138.13(15) . 6
Os1 Al1 Al5 54.35(3) 6 6
Al3 Al1 Al5 57.47(5) 15 6
Al1 Al1 Al5 113.00(11) 11_655 6
Al3 Al1 Al5 104.26(10) . 13
Os1 Al1 Al5 54.35(3) . 13
Os1 Al1 Al5 138.13(15) 6 13
Al3 Al1 Al5 57.47(5) 15 13
Al1 Al1 Al5 113.00(11) 11_655 13
Al5 Al1 Al5 105.35(14) 6 13
Al3 Al1 Al4 62.50(9) . 5_545
Os1 Al1 Al4 55.31(5) . 5_545
Os1 Al1 Al4 102.21(9) 6 5_545
Al3 Al1 Al4 146.16(9) 15 5_545
Al1 Al1 Al4 61.57(6) 11_655 5_545
Al5 Al1 Al4 154.58(9) 6 5_545
Al5 Al1 Al4 99.18(7) 13 5_545
Al3 Al1 Al4 62.50(9) . 14_546
Os1 Al1 Al4 102.21(9) . 14_546
Os1 Al1 Al4 55.31(5) 6 14_546
Al3 Al1 Al4 146.16(9) 15 14_546
Al1 Al1 Al4 61.57(6) 11_655 14_546
Al5 Al1 Al4 99.18(7) 6 14_546
Al5 Al1 Al4 154.58(9) 13 14_546
Al4 Al1 Al4 55.76(12) 5_545 14_546
Al3 Al1 Yb1 64.67(10) . .
Os1 Al1 Yb1 71.46(6) . .
Os1 Al1 Yb1 71.46(6) 6 .
Al3 Al1 Yb1 76.82(10) 15 .
Al1 Al1 Yb1 179.41(4) 11_655 .
Al5 Al1 Yb1 66.71(11) 6 .
Al5 Al1 Yb1 66.71(11) 13 .
Al4 Al1 Yb1 118.93(8) 5_545 .
Al4 Al1 Yb1 118.93(8) 14_546 .
Al4 Al2 Os1 60.20(5) 9_565 .
Al4 Al2 Os1 60.20(5) 9_565 7_455
Os1 Al2 Os1 118.76(10) . 7_455
Al4 Al2 Al2 131.5(2) 9_565 9
Os1 Al2 Al2 114.39(9) . 9
Os1 Al2 Al2 114.39(9) 7_455 9
Al4 Al2 Al3 107.76(10) 9_565 .
Os1 Al2 Al3 56.96(6) . .
Os1 Al2 Al3 135.43(13) 7_455 .
Al2 Al2 Al3 104.77(12) 9 .
Al4 Al2 Al3 107.76(10) 9_565 11
Os1 Al2 Al3 135.43(13) . 11
Os1 Al2 Al3 56.96(6) 7_455 11
Al2 Al2 Al3 104.77(12) 9 11
Al3 Al2 Al3 93.89(14) . 11
Al4 Al2 Al5 108.06(8) 9_565 9
Os1 Al2 Al5 162.51(14) . 9
Os1 Al2 Al5 55.41(5) 7_455 9
Al2 Al2 Al5 62.12(7) 9 9
Al3 Al2 Al5 139.92(12) . 9
Al3 Al2 Al5 58.22(7) 11 9
Al4 Al2 Al5 108.06(8) 9_565 .
Os1 Al2 Al5 55.41(5) . .
Os1 Al2 Al5 162.51(14) 7_455 .
Al2 Al2 Al5 62.12(7) 9 .
Al3 Al2 Al5 58.22(7) . .
Al3 Al2 Al5 139.92(12) 11 .
Al5 Al2 Al5 124.25(14) 9 .
Al4 Al2 Yb1 66.83(9) 9_565 .
Os1 Al2 Yb1 72.66(6) . .
Os1 Al2 Yb1 72.66(6) 7_455 .
Al2 Al2 Yb1 161.6(2) 9 .
Al3 Al2 Yb1 63.81(8) . .
Al3 Al2 Yb1 63.81(8) 11 .
Al5 Al2 Yb1 116.34(8) 9 .
Al5 Al2 Yb1 116.34(8) . .
Os1 Al3 Os1 124.96(10) 6 .
Os1 Al3 Al1 63.20(5) 6 .
Os1 Al3 Al1 63.20(5) . .
Os1 Al3 Al5 162.46(18) 6 .
Os1 Al3 Al5 57.784(15) . .
Al1 Al3 Al5 112.22(10) . .
Os1 Al3 Al5 57.784(15) 6 10_556
Os1 Al3 Al5 162.46(18) . 10_556
Al1 Al3 Al5 112.22(10) . 10_556
Al5 Al3 Al5 113.89(12) . 10_556
Os1 Al3 Al2 134.63(14) 6 .
Os1 Al3 Al2 59.63(7) . .
Al1 Al3 Al2 111.17(10) . .
Al5 Al3 Al2 62.80(12) . .
Al5 Al3 Al2 133.21(15) 10_556 .
Os1 Al3 Al2 59.63(7) 6 10_556
Os1 Al3 Al2 134.63(14) . 10_556
Al1 Al3 Al2 111.17(10) . 10_556
Al5 Al3 Al2 133.21(15) . 10_556
Al5 Al3 Al2 62.80(12) 10_556 10_556
Al2 Al3 Al2 85.86(14) . 10_556
Os1 Al3 Al1 117.52(5) 6 15_545
Os1 Al3 Al1 117.52(5) . 15_545
Al1 Al3 Al1 166.67(16) . 15_545
Al5 Al3 Al1 62.70(6) . 15_545
Al5 Al3 Al1 62.70(6) 10_556 15_545
Al2 Al3 Al1 78.20(9) . 15_545
Al2 Al3 Al1 78.20(9) 10_556 15_545
Os1 Al3 Al4 57.18(7) 6 14_546
Os1 Al3 Al4 107.22(12) . 14_546
Al1 Al3 Al4 63.67(10) . 14_546
Al5 Al3 Al4 105.33(16) . 14_546
Al5 Al3 Al4 58.15(12) 10_556 14_546
Al2 Al3 Al4 165.26(11) . 14_546
Al2 Al3 Al4 108.87(8) 10_556 14_546
Al1 Al3 Al4 104.83(12) 15_545 14_546
Os1 Al3 Al4 107.22(12) 6 5_545
Os1 Al3 Al4 57.18(7) . 5_545
Al1 Al3 Al4 63.67(10) . 5_545
Al5 Al3 Al4 58.15(12) . 5_545
Al5 Al3 Al4 105.33(16) 10_556 5_545
Al2 Al3 Al4 108.87(8) . 5_545
Al2 Al3 Al4 165.26(11) 10_556 5_545
Al1 Al3 Al4 104.83(12) 15_545 5_545
Al4 Al3 Al4 56.39(13) 14_546 5_545
Os1 Al3 Yb1 73.88(7) 6 .
Os1 Al3 Yb1 73.88(7) . .
Al1 Al3 Yb1 65.70(9) . .
Al5 Al3 Yb1 120.92(10) . .
Al5 Al3 Yb1 120.92(10) 10_556 .
Al2 Al3 Yb1 64.42(9) . .
Al2 Al3 Yb1 64.42(9) 10_556 .
Al1 Al3 Yb1 127.63(14) 15_545 .
Al4 Al3 Yb1 120.77(9) 14_546 .
Al4 Al3 Yb1 120.77(9) 5_545 .
Al2 Al4 Os1 60.63(5) 9_565 3_565
Al2 Al4 Os1 60.63(5) 9_565 5_455
Os1 Al4 Os1 119.60(11) 3_565 5_455
Al2 Al4 Al5 109.32(10) 9_565 5_455
Os1 Al4 Al5 137.82(13) 3_565 5_455
Os1 Al4 Al5 56.88(6) 5_455 5_455
Al2 Al4 Al5 109.32(10) 9_565 13
Os1 Al4 Al5 56.88(6) 3_565 13
Os1 Al4 Al5 137.82(13) 5_455 13
Al5 Al4 Al5 96.28(17) 5_455 13
Al2 Al4 Al4 120.44(10) 9_565 10_556
Os1 Al4 Al4 110.18(6) 3_565 10_556
Os1 Al4 Al4 110.18(6) 5_455 10_556
Al5 Al4 Al4 109.40(7) 5_455 10_556
Al5 Al4 Al4 109.40(7) 13 10_556
Al2 Al4 Al3 107.23(8) 9_565 15
Os1 Al4 Al3 55.08(5) 3_565 15
Os1 Al4 Al3 161.21(13) 5_455 15
Al5 Al4 Al3 140.65(12) 5_455 15
Al5 Al4 Al3 57.60(7) 13 15
Al4 Al4 Al3 61.80(6) 10_556 15
Al2 Al4 Al3 107.23(8) 9_565 5_455
Os1 Al4 Al3 161.21(13) 3_565 5_455
Os1 Al4 Al3 55.08(5) 5_455 5_455
Al5 Al4 Al3 57.60(7) 5_455 5_455
Al5 Al4 Al3 140.65(12) 13 5_455
Al4 Al4 Al3 61.80(6) 10_556 5_455
Al3 Al4 Al3 123.01(13) 15 5_455
Al2 Al4 Al1 66.10(8) 9_565 15
Os1 Al4 Al1 58.48(6) 3_565 15
Os1 Al4 Al1 107.46(10) 5_455 15
Al5 Al4 Al1 160.21(11) 5_455 15
Al5 Al4 Al1 103.40(9) 13 15
Al4 Al4 Al1 62.12(6) 10_556 15
Al3 Al4 Al1 53.82(8) 15 15
Al3 Al4 Al1 104.27(11) 5_455 15
Al2 Al4 Al1 66.10(8) 9_565 5_455
Os1 Al4 Al1 107.46(10) 3_565 5_455
Os1 Al4 Al1 58.48(6) 5_455 5_455
Al5 Al4 Al1 103.40(9) 5_455 5_455
Al5 Al4 Al1 160.21(11) 13 5_455
Al4 Al4 Al1 62.12(6) 10_556 5_455
Al3 Al4 Al1 104.27(11) 15 5_455
Al3 Al4 Al1 53.82(8) 5_455 5_455
Al1 Al4 Al1 56.86(13) 15 5_455
Al2 Al4 Yb1 175.01(14) 9_565 .
Os1 Al4 Yb1 118.61(5) 3_565 .
Os1 Al4 Yb1 118.61(5) 5_455 .
Al5 Al4 Yb1 67.67(6) 5_455 .
Al5 Al4 Yb1 67.67(6) 13 .
Al4 Al4 Yb1 64.55(6) 10_556 .
Al3 Al4 Yb1 74.78(7) 15 .
Al3 Al4 Yb1 74.78(7) 5_455 .
Al1 Al4 Yb1 118.13(9) 15 .
Al1 Al4 Yb1 118.13(9) 5_455 .
Al2 Al4 Yb1 64.70(10) 9_565 9_565
Os1 Al4 Yb1 71.90(6) 3_565 9_565
Os1 Al4 Yb1 71.90(6) 5_455 9_565
Al5 Al4 Yb1 67.50(7) 5_455 9_565
Al5 Al4 Yb1 67.50(7) 13 9_565
Al4 Al4 Yb1 174.86(5) 10_556 9_565
Al3 Al4 Yb1 117.69(6) 15 9_565
Al3 Al4 Yb1 117.69(6) 5_455 9_565
Al1 Al4 Yb1 122.17(8) 15 9_565
Al1 Al4 Yb1 122.17(8) 5_455 9_565
Yb1 Al4 Yb1 110.31(8) . 9_565
Os1 Al5 Os1 169.3(2) 3 .
Os1 Al5 Al3 58.18(5) 3 3
Os1 Al5 Al3 119.48(7) . 3
Os1 Al5 Al3 119.48(7) 3 .
Os1 Al5 Al3 58.18(5) . .
Al3 Al5 Al3 158.3(3) 3 .
Os1 Al5 Al4 130.23(16) 3 5_545
Os1 Al5 Al4 59.55(7) . 5_545
Al3 Al5 Al4 135.63(17) 3 5_545
Al3 Al5 Al4 64.25(10) . 5_545
Os1 Al5 Al4 59.55(7) 3 13
Os1 Al5 Al4 130.22(16) . 13
Al3 Al5 Al4 64.25(10) 3 13
Al3 Al5 Al4 135.63(17) . 13
Al4 Al5 Al4 83.72(17) 5_545 13
Os1 Al5 Al2 58.32(8) 3 9
Os1 Al5 Al2 111.11(16) . 9
Al3 Al5 Al2 58.98(12) 3 9
Al3 Al5 Al2 100.52(16) . 9
Al4 Al5 Al2 164.53(13) 5_545 9
Al4 Al5 Al2 110.67(7) 13 9
Os1 Al5 Al2 111.11(16) 3 .
Os1 Al5 Al2 58.32(8) . .
Al3 Al5 Al2 100.52(16) 3 .
Al3 Al5 Al2 58.98(12) . .
Al4 Al5 Al2 110.67(7) 5_545 .
Al4 Al5 Al2 164.53(13) 13 .
Al2 Al5 Al2 55.75(14) 9 .
Os1 Al5 Al1 115.16(10) 3 13
Os1 Al5 Al1 60.12(5) . 13
Al3 Al5 Al1 59.83(7) 3 13
Al3 Al5 Al1 110.83(12) . 13
Al4 Al5 Al1 106.66(9) 5_545 13
Al4 Al5 Al1 107.17(9) 13 13
Al2 Al5 Al1 75.27(13) 9 13
Al2 Al5 Al1 64.13(12) . 13
Os1 Al5 Al1 60.12(5) 3 15_545
Os1 Al5 Al1 115.17(10) . 15_545
Al3 Al5 Al1 110.83(12) 3 15_545
Al3 Al5 Al1 59.83(7) . 15_545
Al4 Al5 Al1 107.17(9) 5_545 15_545
Al4 Al5 Al1 106.66(9) 13 15_545
Al2 Al5 Al1 64.13(12) 9 15_545
Al2 Al5 Al1 75.27(13) . 15_545
Al1 Al5 Al1 134.0(2) 13 15_545
Os1 Al5 Yb1 70.64(5) 3 5_545
Os1 Al5 Yb1 116.49(9) . 5_545
Al3 Al5 Yb1 119.39(9) 3 5_545
Al3 Al5 Yb1 74.94(8) . 5_545
Al4 Al5 Yb1 62.68(10) 5_545 5_545
Al4 Al5 Yb1 62.93(10) 13 5_545
Al2 Al5 Yb1 117.91(7) 9 5_545
Al2 Al5 Yb1 128.07(8) . 5_545
Al1 Al5 Yb1 165.14(17) 13 5_545
Al1 Al5 Yb1 60.85(6) 15_545 5_545
Os1 Al5 Yb1 116.49(9) 3 13
Os1 Al5 Yb1 70.64(5) . 13
Al3 Al5 Yb1 74.94(8) 3 13
Al3 Al5 Yb1 119.39(9) . 13
Al4 Al5 Yb1 62.93(10) 5_545 13
Al4 Al5 Yb1 62.68(10) 13 13
Al2 Al5 Yb1 128.07(8) 9 13
Al2 Al5 Yb1 117.91(7) . 13
Al1 Al5 Yb1 60.85(6) 13 13
Al1 Al5 Yb1 165.14(17) 15_545 13
Yb1 Al5 Yb1 104.30(14) 5_545 13
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_distance
_geom_bond_site_symmetry_2
Os1 Al5 2.5575(5) 13
Os1 Al5 2.5575(5) .
Os1 Al3 2.5685(11) .
Os1 Al3 2.5685(11) 13
Os1 Al4 2.6324(14) 9_565
Os1 Al4 2.6324(14) 5_545
Os1 Al2 2.6437(13) .
Os1 Al2 2.6437(13) 13
Os1 Al1 2.7290(15) .
Os1 Al1 2.7290(15) 13
Os1 Yb1 3.4538(2) .
Os1 Yb1 3.4538(2) 13
Yb1 Al3 3.130(3) 11
Yb1 Al3 3.130(3) .
Yb1 Al2 3.146(3) .
Yb1 Al2 3.146(3) 10_556
Yb1 Al1 3.156(3) 11
Yb1 Al1 3.156(3) .
Yb1 Al4 3.188(3) 10_556
Yb1 Al4 3.188(3) .
Yb1 Al4 3.199(3) 9_565
Yb1 Al4 3.199(3) 2_565
Yb1 Al5 3.319(3) 6
Yb1 Al5 3.319(3) 5_455
Al1 Al3 2.638(4) .
Al1 Os1 2.7290(15) 6
Al1 Al3 2.787(4) 15
Al1 Al1 2.789(6) 11_655
Al1 Al5 2.865(3) 6
Al1 Al5 2.865(3) 13
Al1 Al4 2.930(3) 5_545
Al1 Al4 2.930(3) 14_546
Al2 Al4 2.605(4) 9_565
Al2 Os1 2.6437(13) 7_455
Al2 Al2 2.659(5) 9
Al2 Al3 2.740(4) .
Al2 Al3 2.740(4) 11
Al2 Al5 2.844(5) 9
Al2 Al5 2.844(5) .
Al3 Os1 2.5685(11) 6
Al3 Al5 2.7179(18) .
Al3 Al5 2.7179(18) 10_556
Al3 Al2 2.740(4) 10_556
Al3 Al1 2.787(4) 15_545
Al3 Al4 2.899(3) 14_546
Al3 Al4 2.899(3) 5_545
Al4 Al2 2.605(4) 9_565
Al4 Os1 2.6324(14) 3_565
Al4 Os1 2.6324(14) 5_455
Al4 Al5 2.734(4) 5_455
Al4 Al5 2.734(4) 13
Al4 Al4 2.740(6) 10_556
Al4 Al3 2.899(4) 15
Al4 Al3 2.899(4) 5_455
Al4 Al1 2.930(3) 15
Al4 Al1 2.930(3) 5_455
Al4 Yb1 3.199(3) 9_565
Al5 Os1 2.5575(5) 3
Al5 Al3 2.7179(18) 3
Al5 Al4 2.734(4) 5_545
Al5 Al4 2.734(4) 13
Al5 Al2 2.844(5) 9
Al5 Al1 2.865(3) 13
Al5 Al1 2.865(3) 15_545
Al5 Yb1 3.319(3) 5_545
Al5 Yb1 3.319(3) 13
