#------------------------------------------------------------------------------
#$Date: 2016-02-20 00:18:51 +0200 (Sat, 20 Feb 2016) $
#$Revision: 176760 $
#$URL: svn://www.crystallography.net/cod/cif/2/01/37/2013739.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_2013739
loop_
_publ_author_name
'Stêpieň-Damm, J.'
'Tougait, O.'
'Zaremba, V.I.'
'Noël, H.'
'Troc\(, R.'
_publ_section_title
;
Uranium cobalt tetraaluminide, UCoAl₄
;
_journal_name_full               'Acta Crystallographica, Section C'
_journal_page_first              i7
_journal_page_last               i8
_journal_paper_doi               10.1107/S0108270103027252
_journal_volume                  60
_journal_year                    2004
_chemical_formula_iupac          'U Co Al4'
_chemical_formula_moiety         'Al4 Co U'
_chemical_formula_sum            'Al4 Co U'
_chemical_formula_weight         404.88
_chemical_name_common            'uranium cobalt tetraaluminide'
_chemical_name_systematic        'uranium cobalt tetraaluminide'
_space_group_IT_number           189
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_Hall  'P -6 -2'
_symmetry_space_group_name_H-M   'P -6 2 m'
_atom_sites_solution_hydrogens   none
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   9.1610(10)
_cell_length_b                   9.1610(10)
_cell_length_c                   4.1140(10)
_cell_measurement_reflns_used    2952
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      46.0
_cell_measurement_theta_min      4.45
_cell_volume                     299.01(9)
_computing_cell_refinement       CrysAlisCCD
_computing_data_collection       'CrysAlisCCD (Oxford Diffraction, 2003)'
_computing_data_reduction        'CrysAlisRED (Oxford Diffraction, 2003)'
_computing_molecular_graphics    'DIAMOND (Bergerhoff, 1996)'
_computing_publication_material  SHELXL97
_computing_structure_refinement  'SHELXL97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.992
_diffrn_measured_fraction_theta_max 0.981
_diffrn_measurement_device_type  'Kuma KM4 CCD area-detector'
_diffrn_measurement_method       ω
_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  0.041
_diffrn_reflns_av_sigmaI/netI    0.035
_diffrn_reflns_limit_h_max       14
_diffrn_reflns_limit_h_min       -18
_diffrn_reflns_limit_k_max       17
_diffrn_reflns_limit_k_min       -17
_diffrn_reflns_limit_l_max       5
_diffrn_reflns_limit_l_min       -8
_diffrn_reflns_number            5480
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         46.13
_diffrn_reflns_theta_min         4.45
_exptl_absorpt_coefficient_mu    45.376
_exptl_absorpt_correction_T_max  0.468
_exptl_absorpt_correction_T_min  0.038
_exptl_absorpt_correction_type   analytical
_exptl_absorpt_process_details
'SHELXL70 in CrysAlis; Oxford Diffraction, 2003)'
_exptl_crystal_colour            black
_exptl_crystal_density_diffrn    6.746
_exptl_crystal_density_meas      ?
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             513
_exptl_crystal_size_max          0.11
_exptl_crystal_size_mid          0.02
_exptl_crystal_size_min          0.015
_refine_diff_density_max         2.42
_refine_diff_density_min         -1.91
_refine_ls_abs_structure_details 'Flack (1983),  561 Friedel pairs'
_refine_ls_abs_structure_Flack   0.046(7)
_refine_ls_extinction_coef       0.0154(5)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method     'SHELXL97 (Sheldrick, 1997)'
_refine_ls_goodness_of_fit_ref   1.007
_refine_ls_hydrogen_treatment    none
_refine_ls_matrix_type           full
_refine_ls_number_parameters     25
_refine_ls_number_reflns         1001
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.007
_refine_ls_R_factor_all          0.025
_refine_ls_R_factor_gt           0.022
_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)+(0.0168P)²] where P=(Fo²+2Fc²)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.037
_refine_ls_wR_factor_ref         0.037
_reflns_number_gt                949
_reflns_number_total             1001
_reflns_threshold_expression     I>2σ(I)
_cod_data_source_file            bc1029.cif
_cod_data_source_block           I
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_crystal_density_meas' value 'not measured' 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_database_code               2013739
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'x, y, -z'
'-y, x-y, -z'
'-x+y, -x, -z'
'y, x, -z'
'x-y, -y, -z'
'-x, -x+y, -z'
'y, x, z'
'x-y, -y, z'
'-x, -x+y, z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_occupancy
_atom_site_disorder_assembly
_atom_site_disorder_group
_atom_site_type_symbol
U 0.40522(2) 0.0000 0.0000 0.00660(4) Uani d S 1 . . U
Co1 0.0000 0.0000 0.0000 0.0088(2) Uani d S 1 . . Co
Co2 0.3333 0.6667 0.0000 0.01168(19) Uani d S 1 . . Co
Al1 0.29637(16) 0.47944(17) 0.5000 0.0078(2) Uani d S 1 . . Al
Al2 0.16977(19) 0.0000 0.5000 0.0075(3) Uani d S 1 . . Al
Al3 0.7420(3) 0.0000 0.0000 0.0116(3) Uani d S 1 . . Al
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'
Co Co 0.3494 0.9721 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
U U -9.6767 9.6646 '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
_geom_angle_publ_flag
Co2 U Co2 1_545 7 143.649(7) no
Co2 U Al2 1_545 1_554 103.046(6) no
Co2 U Al2 7 1_554 103.046(6) no
Co2 U Al2 1_545 . 103.046(6) no
Co2 U Al2 7 . 103.046(6) no
Al2 U Al2 1_554 . 87.28(5) no
Co2 U Al3 1_545 . 71.824(4) no
Co2 U Al3 7 . 71.824(4) no
Al2 U Al3 1_554 . 136.36(2) no
Al2 U Al3 . . 136.36(2) no
Co2 U Al1 1_545 9_656 104.49(2) no
Co2 U Al1 7 9_656 51.286(19) no
Al2 U Al1 1_554 9_656 152.33(2) no
Al2 U Al1 . 9_656 89.13(3) no
Al3 U Al1 . 9_656 53.03(2) no
Co2 U Al1 1_545 2_654 51.286(19) no
Co2 U Al1 7 2_654 104.49(2) no
Al2 U Al1 1_554 2_654 89.13(3) no
Al2 U Al1 . 2_654 152.33(2) no
Al3 U Al1 . 2_654 53.03(2) no
Al1 U Al1 9_656 2_654 106.07(4) no
Co2 U Al1 1_545 2_655 51.286(19) no
Co2 U Al1 7 2_655 104.49(2) no
Al2 U Al1 1_554 2_655 152.33(2) no
Al2 U Al1 . 2_655 89.13(3) no
Al3 U Al1 . 2_655 53.03(2) no
Al1 U Al1 9_656 2_655 54.88(4) no
Al1 U Al1 2_654 2_655 81.49(3) no
Co2 U Al1 1_545 9_655 104.49(2) no
Co2 U Al1 7 9_655 51.286(19) no
Al2 U Al1 1_554 9_655 89.13(3) no
Al2 U Al1 . 9_655 152.33(2) no
Al3 U Al1 . 9_655 53.03(2) no
Al1 U Al1 9_656 9_655 81.49(3) no
Al1 U Al1 2_654 9_655 54.88(4) no
Al1 U Al1 2_655 9_655 106.07(4) no
Co2 U Al1 1_545 3_554 50.75(2) no
Co2 U Al1 7 3_554 139.903(16) no
Al2 U Al1 1_554 3_554 53.31(3) no
Al2 U Al1 . 3_554 106.90(2) no
Al3 U Al1 . 3_554 102.24(2) no
Al1 U Al1 9_656 3_554 152.429(8) no
Al1 U Al1 2_654 3_554 50.84(4) no
Al1 U Al1 2_655 3_554 102.03(3) no
Al1 U Al1 9_655 3_554 92.663(14) no
Co2 U Al1 1_545 7_556 139.903(16) no
Co2 U Al1 7 7_556 50.75(2) no
Al2 U Al1 1_554 7_556 106.90(2) no
Al2 U Al1 . 7_556 53.31(3) no
Al3 U Al1 . 7_556 102.24(2) no
Al1 U Al1 9_656 7_556 50.84(4) no
Al1 U Al1 2_654 7_556 152.429(8) no
Al1 U Al1 2_655 7_556 92.663(14) no
Al1 U Al1 9_655 7_556 102.03(3) no
Al1 U Al1 3_554 7_556 155.52(5) no
Co2 U Al1 1_545 3 50.75(2) no
Co2 U Al1 7 3 139.903(16) no
Al2 U Al1 1_554 3 106.90(2) no
Al2 U Al1 . 3 53.31(3) no
Al3 U Al1 . 3 102.24(2) no
Al1 U Al1 9_656 3 92.663(14) no
Al1 U Al1 2_654 3 102.03(3) no
Al1 U Al1 2_655 3 50.84(4) no
Al1 U Al1 9_655 3 152.429(8) no
Al1 U Al1 3_554 3 80.10(3) no
Al1 U Al1 7_556 3 94.70(4) no
Al3 Co1 Al3 3_665 2_545 120.0 no
Al3 Co1 Al3 3_665 1_455 120.0 no
Al3 Co1 Al3 2_545 1_455 120.0 no
Al3 Co1 Al2 3_665 3_554 127.09(3) no
Al3 Co1 Al2 2_545 3_554 72.450(13) no
Al3 Co1 Al2 1_455 3_554 72.450(13) no
Al3 Co1 Al2 3_665 2 72.450(13) no
Al3 Co1 Al2 2_545 2 127.09(3) no
Al3 Co1 Al2 1_455 2 72.450(13) no
Al2 Co1 Al2 3_554 2 144.90(3) no
Al3 Co1 Al2 3_665 . 72.450(13) no
Al3 Co1 Al2 2_545 . 72.450(13) no
Al3 Co1 Al2 1_455 . 127.09(3) no
Al2 Co1 Al2 3_554 . 144.90(3) no
Al2 Co1 Al2 2 . 62.97(5) no
Al3 Co1 Al2 3_665 1_554 72.450(13) no
Al3 Co1 Al2 2_545 1_554 72.450(13) no
Al3 Co1 Al2 1_455 1_554 127.09(3) no
Al2 Co1 Al2 3_554 1_554 62.97(5) no
Al2 Co1 Al2 2 1_554 144.90(3) no
Al2 Co1 Al2 . 1_554 105.82(6) no
Al3 Co1 Al2 3_665 2_554 72.450(13) no
Al3 Co1 Al2 2_545 2_554 127.09(3) no
Al3 Co1 Al2 1_455 2_554 72.450(13) no
Al2 Co1 Al2 3_554 2_554 62.97(5) no
Al2 Co1 Al2 2 2_554 105.82(6) no
Al2 Co1 Al2 . 2_554 144.90(3) no
Al2 Co1 Al2 1_554 2_554 62.97(5) no
Al3 Co1 Al2 3_665 3 127.09(3) no
Al3 Co1 Al2 2_545 3 72.450(13) no
Al3 Co1 Al2 1_455 3 72.450(13) no
Al2 Co1 Al2 3_554 3 105.82(6) no
Al2 Co1 Al2 2 3 62.97(5) no
Al2 Co1 Al2 . 3 62.97(5) no
Al2 Co1 Al2 1_554 3 144.90(3) no
Al2 Co1 Al2 2_554 3 144.90(3) no
Al1 Co2 Al1 3_564 3_565 105.17(5) no
Al1 Co2 Al1 3_564 2_665 144.63(2) no
Al1 Co2 Al1 3_565 2_665 63.49(4) no
Al1 Co2 Al1 3_564 1_554 63.49(4) no
Al1 Co2 Al1 3_565 1_554 144.63(2) no
Al1 Co2 Al1 2_665 1_554 144.63(2) no
Al1 Co2 Al1 3_564 2_664 63.49(4) no
Al1 Co2 Al1 3_565 2_664 144.63(2) no
Al1 Co2 Al1 2_665 2_664 105.17(5) no
Al1 Co2 Al1 1_554 2_664 63.49(4) no
Al1 Co2 Al1 3_564 . 144.63(2) no
Al1 Co2 Al1 3_565 . 63.49(4) no
Al1 Co2 Al1 2_665 . 63.49(4) no
Al1 Co2 Al1 1_554 . 105.17(5) no
Al1 Co2 Al1 2_664 . 144.63(2) no
Al1 Co2 U 3_564 1_565 72.91(3) no
Al1 Co2 U 3_565 1_565 72.91(3) no
Al1 Co2 U 2_665 1_565 71.72(3) no
Al1 Co2 U 1_554 1_565 127.41(2) no
Al1 Co2 U 2_664 1_565 71.72(3) no
Al1 Co2 U . 1_565 127.41(2) no
Al1 Co2 U 3_564 2 71.72(3) no
Al1 Co2 U 3_565 2 71.72(3) no
Al1 Co2 U 2_665 2 127.41(2) no
Al1 Co2 U 1_554 2 72.91(3) no
Al1 Co2 U 2_664 2 127.41(2) no
Al1 Co2 U . 2 72.91(3) no
U Co2 U 1_565 2 120.0 no
Al1 Co2 U 3_564 3_665 127.41(2) no
Al1 Co2 U 3_565 3_665 127.41(2) no
Al1 Co2 U 2_665 3_665 72.91(3) no
Al1 Co2 U 1_554 3_665 71.72(3) no
Al1 Co2 U 2_664 3_665 72.91(3) no
Al1 Co2 U . 3_665 71.72(3) no
U Co2 U 1_565 3_665 120.0 no
U Co2 U 2 3_665 120.0 no
Co2 Al1 Co2 1_556 . 105.17(5) no
Co2 Al1 Al1 1_556 2_665 58.253(19) no
Co2 Al1 Al1 . 2_665 58.253(19) no
Co2 Al1 Al1 1_556 3_565 58.253(19) no
Co2 Al1 Al1 . 3_565 58.253(19) no
Al1 Al1 Al1 2_665 3_565 60.0 no
Co2 Al1 Al2 1_556 2 114.44(4) no
Co2 Al1 Al2 . 2 114.44(4) no
Al1 Al1 Al2 2_665 2 162.92(7) no
Al1 Al1 Al2 3_565 2 102.92(7) no
Co2 Al1 Al3 1_556 3_665 174.94(4) no
Co2 Al1 Al3 . 3_665 79.80(3) no
Al1 Al1 Al3 2_665 3_665 125.12(6) no
Al1 Al1 Al3 3_565 3_665 126.30(4) no
Al2 Al1 Al3 2 3_665 63.47(5) no
Co2 Al1 Al3 1_556 3_666 79.80(3) no
Co2 Al1 Al3 . 3_666 174.94(4) no
Al1 Al1 Al3 2_665 3_666 125.12(6) no
Al1 Al1 Al3 3_565 3_666 126.30(4) no
Al2 Al1 Al3 2 3_666 63.47(5) no
Al3 Al1 Al3 3_665 3_666 95.22(6) no
Co2 Al1 Al1 1_556 7_556 117.41(2) no
Co2 Al1 Al1 . 7_556 117.41(2) no
Al1 Al1 Al1 2_665 7_556 109.26(5) no
Al1 Al1 Al1 3_565 7_556 169.26(5) no
Al2 Al1 Al1 2 7_556 87.82(4) no
Al3 Al1 Al1 3_665 7_556 58.57(3) no
Al3 Al1 Al1 3_666 7_556 58.57(3) no
Co2 Al1 U 1_556 3_666 56.994(18) no
Co2 Al1 U . 3_666 119.48(5) no
Al1 Al1 U 2_665 3_666 65.44(5) no
Al1 Al1 U 3_565 3_666 109.92(4) no
Al2 Al1 U 2 3_666 125.69(4) no
Al3 Al1 U 3_665 3_666 119.91(5) no
Al3 Al1 U 3_666 3_666 62.26(5) no
Al1 Al1 U 7_556 3_666 62.56(2) no
Co2 Al1 U 1_556 3_665 119.48(5) no
Co2 Al1 U . 3_665 56.994(18) no
Al1 Al1 U 2_665 3_665 65.44(5) no
Al1 Al1 U 3_565 3_665 109.92(4) no
Al2 Al1 U 2 3_665 125.69(4) no
Al3 Al1 U 3_665 3_665 62.26(5) no
Al3 Al1 U 3_666 3_665 119.91(5) no
Al1 Al1 U 7_556 3_665 62.56(2) no
U Al1 U 3_666 3_665 81.49(3) no
Co2 Al1 U 1_556 2 117.90(4) no
Co2 Al1 U . 2 56.335(17) no
Al1 Al1 U 2_665 2 108.63(3) no
Al1 Al1 U 3_565 2 63.72(4) no
Al2 Al1 U 2 2 59.36(3) no
Al3 Al1 U 3_665 2 65.51(3) no
Al3 Al1 U 3_666 2 122.41(6) no
Al1 Al1 U 7_556 2 123.46(2) no
U Al1 U 3_666 2 173.41(5) no
U Al1 U 3_665 2 98.825(15) no
Co2 Al1 U 1_556 2_556 56.335(17) no
Co2 Al1 U . 2_556 117.90(4) no
Al1 Al1 U 2_665 2_556 108.63(3) no
Al1 Al1 U 3_565 2_556 63.72(4) no
Al2 Al1 U 2 2_556 59.36(3) no
Al3 Al1 U 3_665 2_556 122.41(6) no
Al3 Al1 U 3_666 2_556 65.51(3) no
Al1 Al1 U 7_556 2_556 123.46(2) no
U Al1 U 3_666 2_556 98.825(15) no
U Al1 U 3_665 2_556 173.41(5) no
U Al1 U 2 2_556 80.10(3) no
Co1 Al2 Co1 . 1_556 105.82(6) no
Co1 Al2 Al2 . 3 58.51(3) no
Co1 Al2 Al2 1_556 3 58.51(3) no
Co1 Al2 Al2 . 2 58.51(3) no
Co1 Al2 Al2 1_556 2 58.51(3) no
Al2 Al2 Al2 3 2 60.0 no
Co1 Al2 Al1 . 7_556 108.734(14) no
Co1 Al2 Al1 1_556 7_556 108.734(14) no
Al2 Al2 Al1 3 7_556 152.18(4) no
Al2 Al2 Al1 2 7_556 92.18(4) no
Co1 Al2 Al1 . 3 108.734(14) no
Co1 Al2 Al1 1_556 3 108.734(14) no
Al2 Al2 Al1 3 3 92.18(4) no
Al2 Al2 Al1 2 3 152.18(4) no
Al1 Al2 Al1 7_556 3 115.64(8) no
Co1 Al2 Al3 . 2_545 50.38(4) no
Co1 Al2 Al3 1_556 2_545 118.94(5) no
Al2 Al2 Al3 3 2_545 62.59(3) no
Al2 Al2 Al3 2 2_545 103.85(4) no
Al1 Al2 Al3 7_556 2_545 131.31(4) no
Al1 Al2 Al3 3 2_545 58.39(4) no
Co1 Al2 Al3 . 3_666 118.94(5) no
Co1 Al2 Al3 1_556 3_666 50.38(4) no
Al2 Al2 Al3 3 3_666 103.85(4) no
Al2 Al2 Al3 2 3_666 62.59(3) no
Al1 Al2 Al3 7_556 3_666 58.39(4) no
Al1 Al2 Al3 3 3_666 131.31(4) no
Al3 Al2 Al3 2_545 3_666 165.34(8) no
Co1 Al2 Al3 . 3_665 50.38(4) no
Co1 Al2 Al3 1_556 3_665 118.94(5) no
Al2 Al2 Al3 3 3_665 103.85(4) no
Al2 Al2 Al3 2 3_665 62.59(3) no
Al1 Al2 Al3 7_556 3_665 58.39(4) no
Al1 Al2 Al3 3 3_665 131.31(4) no
Al3 Al2 Al3 2_545 3_665 88.79(6) no
Al3 Al2 Al3 3_666 3_665 89.34(5) no
Co1 Al2 Al3 . 2_546 118.94(5) no
Co1 Al2 Al3 1_556 2_546 50.38(4) no
Al2 Al2 Al3 3 2_546 62.59(3) no
Al2 Al2 Al3 2 2_546 103.85(4) no
Al1 Al2 Al3 7_556 2_546 131.31(4) no
Al1 Al2 Al3 3 2_546 58.39(4) no
Al3 Al2 Al3 2_545 2_546 89.34(5) no
Al3 Al2 Al3 3_666 2_546 88.79(6) no
Al3 Al2 Al3 3_665 2_546 165.34(8) no
Co1 Al2 U . 1_556 170.73(5) no
Co1 Al2 U 1_556 1_556 83.451(17) no
Al2 Al2 U 3 1_556 128.810(19) no
Al2 Al2 U 2 1_556 128.810(19) no
Al1 Al2 U 7_556 1_556 67.33(4) no
Al1 Al2 U 3 1_556 67.33(4) no
Al3 Al2 U 2_545 1_556 125.28(5) no
Al3 Al2 U 3_666 1_556 66.869(18) no
Al3 Al2 U 3_665 1_556 125.28(5) no
Al3 Al2 U 2_546 1_556 66.869(18) no
Co1 Al2 U . . 83.451(17) no
Co1 Al2 U 1_556 . 170.73(5) no
Al2 Al2 U 3 . 128.809(19) no
Al2 Al2 U 2 . 128.810(19) no
Al1 Al2 U 7_556 . 67.33(4) no
Al1 Al2 U 3 . 67.33(4) no
Al3 Al2 U 2_545 . 66.869(18) no
Al3 Al2 U 3_666 . 125.28(5) no
Al3 Al2 U 3_665 . 66.869(18) no
Al3 Al2 U 2_546 . 125.28(5) no
U Al2 U 1_556 . 87.28(5) no
Co1 Al3 Al1 1_655 2_654 115.29(5) no
Co1 Al3 Al1 1_655 9_656 115.29(5) no
Al1 Al3 Al1 2_654 9_656 129.42(10) no
Co1 Al3 Al1 1_655 9_655 115.29(5) no
Al1 Al3 Al1 2_654 9_655 62.87(5) no
Al1 Al3 Al1 9_656 9_655 95.22(6) no
Co1 Al3 Al1 1_655 2_655 115.29(5) no
Al1 Al3 Al1 2_654 2_655 95.22(6) no
Al1 Al3 Al1 9_656 2_655 62.87(5) no
Al1 Al3 Al1 9_655 2_655 129.42(10) no
Co1 Al3 Al2 1_655 2_655 57.17(4) no
Al1 Al3 Al2 2_654 2_655 172.26(9) no
Al1 Al3 Al2 9_656 2_655 58.15(4) no
Al1 Al3 Al2 9_655 2_655 120.72(4) no
Al1 Al3 Al2 2_655 2_655 87.27(3) no
Co1 Al3 Al2 1_655 3_654 57.17(4) no
Al1 Al3 Al2 2_654 3_654 58.15(4) no
Al1 Al3 Al2 9_656 3_654 172.26(9) no
Al1 Al3 Al2 9_655 3_654 87.27(3) no
Al1 Al3 Al2 2_655 3_654 120.72(4) no
Al2 Al3 Al2 2_655 3_654 114.35(9) no
Co1 Al3 Al2 1_655 3_655 57.17(4) no
Al1 Al3 Al2 2_654 3_655 120.72(4) no
Al1 Al3 Al2 9_656 3_655 87.27(3) no
Al1 Al3 Al2 9_655 3_655 172.26(9) no
Al1 Al3 Al2 2_655 3_655 58.15(4) no
Al2 Al3 Al2 2_655 3_655 54.82(7) no
Al2 Al3 Al2 3_654 3_655 89.34(5) no
Co1 Al3 Al2 1_655 2_654 57.17(4) no
Al1 Al3 Al2 2_654 2_654 87.27(3) no
Al1 Al3 Al2 9_656 2_654 120.72(4) no
Al1 Al3 Al2 9_655 2_654 58.15(4) no
Al1 Al3 Al2 2_655 2_654 172.26(9) no
Al2 Al3 Al2 2_655 2_654 89.34(5) no
Al2 Al3 Al2 3_654 2_654 54.82(7) no
Al2 Al3 Al2 3_655 2_654 114.35(9) no
Co1 Al3 U 1_655 . 180.0 no
Al1 Al3 U 2_654 . 64.71(5) no
Al1 Al3 U 9_656 . 64.71(5) no
Al1 Al3 U 9_655 . 64.71(5) no
Al1 Al3 U 2_655 . 64.71(5) no
Al2 Al3 U 2_655 . 122.83(4) no
Al2 Al3 U 3_654 . 122.83(4) no
Al2 Al3 U 3_655 . 122.83(4) no
Al2 Al3 U 2_654 . 122.83(4) no
Co1 Al3 U 1_655 2_655 81.03(4) no
Al1 Al3 U 2_654 2_655 125.57(3) no
Al1 Al3 U 9_656 2_655 63.35(2) no
Al1 Al3 U 9_655 2_655 63.35(2) no
Al1 Al3 U 2_655 2_655 125.57(3) no
Al2 Al3 U 2_655 2_655 57.37(3) no
Al2 Al3 U 3_654 2_655 111.73(5) no
Al2 Al3 U 3_655 2_655 111.73(5) no
Al2 Al3 U 2_654 2_655 57.37(3) no
U Al3 U . 2_655 98.97(4) no
Co1 Al3 U 1_655 3_655 81.03(4) no
Al1 Al3 U 2_654 3_655 63.35(2) no
Al1 Al3 U 9_656 3_655 125.57(3) no
Al1 Al3 U 9_655 3_655 125.57(3) no
Al1 Al3 U 2_655 3_655 63.35(2) no
Al2 Al3 U 2_655 3_655 111.73(5) no
Al2 Al3 U 3_654 3_655 57.37(3) no
Al2 Al3 U 3_655 3_655 57.37(3) no
Al2 Al3 U 2_654 3_655 111.73(5) no
U Al3 U . 3_655 98.97(4) no
U Al3 U 2_655 3_655 162.06(8) no
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
_geom_bond_publ_flag
U Co2 1_545 2.7834(3) yes
U Co2 7 2.7834(3) .
U Al2 1_554 2.9806(13) .
U Al2 . 2.9806(13) yes
U Al3 . 3.085(2) yes
U Al1 9_656 3.1516(10) yes
U Al1 2_654 3.1516(10) .
U Al1 2_655 3.1516(10) .
U Al1 9_655 3.1516(10) .
U Al1 3_554 3.1967(10) yes
U Al1 7_556 3.1967(10) .
U Al1 3 3.1967(10) .
Co1 Al3 3_665 2.364(2) yes
Co1 Al3 2_545 2.364(2) .
Co1 Al3 1_455 2.364(2) .
Co1 Al2 3_554 2.5788(11) .
Co1 Al2 2 2.5788(11) .
Co1 Al2 . 2.5788(11) yes
Co1 Al2 1_554 2.5788(11) .
Co1 Al2 2_554 2.5788(11) .
Co1 Al2 3 2.5788(11) .
Co2 Al1 3_564 2.5898(9) .
Co2 Al1 3_565 2.5898(9) .
Co2 Al1 2_665 2.5898(9) .
Co2 Al1 1_554 2.5898(9) .
Co2 Al1 2_664 2.5898(9) .
Co2 Al1 . 2.5898(9) yes
Co2 U 1_565 2.7834(3) .
Co2 U 2 2.7834(3) yes
Co2 U 3_665 2.7834(3) .
Al1 Co2 1_556 2.5898(9) yes
Al1 Al1 2_665 2.725(2) yes
Al1 Al1 3_565 2.725(2) .
Al1 Al2 2 2.7780(17) yes
Al1 Al3 3_665 2.7851(14) yes
Al1 Al3 3_666 2.7851(14) .
Al1 Al1 7_556 2.905(2) yes
Al1 U 3_666 3.1516(10) yes
Al1 U 3_665 3.1516(10) yes
Al1 U 2 3.1967(10) yes
Al1 U 2_556 3.1967(10) .
Al2 Co1 1_556 2.5788(11) yes
Al2 Al2 3 2.694(3) yes
Al2 Al2 2 2.694(3) .
Al2 Al1 7_556 2.7780(17) .
Al2 Al1 3 2.7780(16) yes
Al2 Al3 2_545 2.9259(13) .
Al2 Al3 3_666 2.9259(13) .
Al2 Al3 3_665 2.9259(13) .
Al2 Al3 2_546 2.9259(13) yes
Al2 U 1_556 2.9806(13) yes
Al3 Co1 1_655 2.364(2) yes
Al3 Al1 2_654 2.7851(14) yes
Al3 Al1 9_656 2.7851(14) .
Al3 Al1 9_655 2.7851(14) .
Al3 Al1 2_655 2.7851(14) .
Al3 Al2 2_655 2.9259(13) yes
Al3 Al2 3_654 2.9259(13) .
Al3 Al2 3_655 2.9259(13) .
Al3 Al2 2_654 2.9259(13) .
Al3 U 2_655 3.2547(5) yes
Al3 U 3_655 3.2547(5) .
