#------------------------------------------------------------------------------
#$Date: 2016-06-29 04:33:47 +0300 (Wed, 29 Jun 2016) $
#$Revision: 184035 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/24/17/2241752.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_2241752
loop_
_publ_author_name
'Malcherek, Thomas'
'Schlüter, Jochen'
_publ_section_title
;
 Crystal structure of Cr-bearing Mg₃BeAl₈O₁₆, a new polytype of
 magnesiotaaffeite-2N'2S
;
_journal_coeditor_code           WM5296
_journal_issue                   7
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              1060
_journal_page_last               1063
_journal_paper_doi               10.1107/S2056989016010215
_journal_volume                  72
_journal_year                    2016
_chemical_formula_analytical     'Al7.86 Be Cr0.19 Mg2.93 O16'
_chemical_formula_iupac          'Mg3 Be Al8 O16'
_chemical_formula_sum            'Al7.92 Be Cr0.15 Mg2.92 O16'
_chemical_formula_weight         557.75
_chemical_name_systematic
;
Trimagnesium beryllium octaaluminium hexadecaoxide
;
_space_group_crystal_system      trigonal
_space_group_IT_number           164
_space_group_name_Hall           '-P 3 2"'
_space_group_name_H-M_alt        'P -3 m 1'
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_audit_creation_method           SHELXL-2014/7
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   5.6788(3)
_cell_length_b                   5.6788(3)
_cell_length_c                   18.3368(14)
_cell_measurement_reflns_used    9717
_cell_measurement_temperature    295(2)
_cell_measurement_theta_max      35
_cell_measurement_theta_min      2.22
_cell_volume                     512.11(5)
_computing_cell_refinement
;
EVAL15/Peakref (Schreurs et al.,  2010)
;
_computing_data_collection
;
COLLECT (Nonius, 1998)
;
_computing_data_reduction
;
EVAL15 (Schreurs et al.,  2010)
;
_computing_molecular_graphics
;
VESTA (Momma & Izumi, 2011)
;
_computing_publication_material
;
publCIF (Westrip, 2010)
;
_computing_structure_refinement
;
SHELXL2014 (Sheldrick, 2015)
;
_computing_structure_solution
;
SUPERFLIP (Palatinus & Chapuis, 2007)
;
_diffrn_ambient_temperature      295(2)
_diffrn_detector_area_resol_mean 9
_diffrn_measured_fraction_theta_full 0.998
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Nonius KappaCCD'
_diffrn_measurement_method       'φ scans, and ω scans with κ offsets'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71069
_diffrn_reflns_av_R_equivalents  0.0395
_diffrn_reflns_limit_h_max       9
_diffrn_reflns_limit_h_min       -8
_diffrn_reflns_limit_k_max       8
_diffrn_reflns_limit_k_min       -9
_diffrn_reflns_limit_l_max       29
_diffrn_reflns_limit_l_min       -29
_diffrn_reflns_number            10618
_diffrn_reflns_theta_full        25.240
_diffrn_reflns_theta_max         34.995
_diffrn_reflns_theta_min         2.221
_exptl_absorpt_coefficient_mu    1.254
_exptl_absorpt_correction_T_max  0.747
_exptl_absorpt_correction_T_min  0.614
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details
;
(SADABS; Bruker, 2008)
;
_exptl_crystal_colour            red
_exptl_crystal_density_diffrn    3.617
_exptl_crystal_description       tabular
_exptl_crystal_F_000             547
_exptl_crystal_size_max          0.23
_exptl_crystal_size_mid          0.22
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.412
_refine_diff_density_min         -1.010
_refine_ls_extinction_coef       0.046(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc²λ³/sin(2θ)]^-1/4^
_refine_ls_extinction_method
;
SHELXL2014 (Sheldrick, 2015)
;
_refine_ls_goodness_of_fit_ref   0.834
_refine_ls_hydrogen_treatment    undef
_refine_ls_matrix_type           full
_refine_ls_number_parameters     75
_refine_ls_number_reflns         940
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      0.834
_refine_ls_R_factor_all          0.0186
_refine_ls_R_factor_gt           0.0180
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
;
w = {1-exp[-5(sinθ/λ)²)]}/[σ²(Fo²)+(0.0296P)²+0.0310P]
where P=(Fo²+2Fc²)/3
;
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0400
_refine_ls_wR_factor_ref         0.0404
_reflns_number_gt                912
_reflns_number_total             940
_reflns_threshold_expression     'I > 2σ(I)'
_cod_data_source_file            wm5296sup1.cif
_cod_data_source_block           I
_cod_original_cell_volume        512.11(7)
_cod_database_code               2241752
_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.
;
loop_
_space_group_symop_operation_xyz
'x, y, z'
'-y, x-y, z'
'-x+y, -x, z'
'y, x, -z'
'x-y, -y, -z'
'-x, -x+y, -z'
'-x, -y, -z'
'y, -x+y, -z'
'x-y, x, -z'
'-y, -x, z'
'-x+y, y, z'
'x, x-y, z'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_calc_flag
_atom_site_occupancy
Be Be1 0.3333 0.6667 0.10240(12) 0.0054(3) Uani d 1
Al Al1 0.5000 0.0000 0.0000 0.00335(9) Uani d 1
Al Al2 0.6667 0.3333 0.15613(3) 0.00344(9) Uani d 1
Al Al3A -0.33348(5) -0.16674(3) 0.24468(2) 0.00340(11) Uani d 0.983(3)
Cr Cr3B -0.33348(5) -0.16674(3) 0.24468(2) 0.00340(11) Uani d 0.017(3)
Al Al4A 0.5000 0.0000 0.5000 0.00331(15) Uani d 0.983(5)
Cr Cr4B 0.5000 0.0000 0.5000 0.00331(15) Uani d 0.017(5)
Al Al5 0.3333 0.6667 0.37276(3) 0.00293(9) Uani d 1
Mg Mg1A 0.0000 0.0000 0.40321(3) 0.0040(2) Uani d 0.972(5)
Cr Cr1B 0.0000 0.0000 0.40321(3) 0.0040(2) Uani d 0.028(5)
Mg Mg2A 0.6667 0.3333 0.34070(3) 0.0041(2) Uani d 0.952(5)
Cr Cr2B 0.6667 0.3333 0.34070(3) 0.0041(2) Uani d 0.048(5)
Mg Mg3 0.0000 0.0000 0.10393(4) 0.00473(11) Uani d 1
O O1 0.6667 0.3333 0.44628(7) 0.00471(17) Uani d 1
O O2 0.6667 0.3333 0.05925(6) 0.00435(18) Uani d 1
O O3 -0.81376(7) -0.18624(7) 0.05785(4) 0.00439(12) Uani d 1
O O4 -0.81598(7) -0.18402(7) 0.43966(4) 0.00449(12) Uani d 1
O O5 -0.51854(7) -0.03709(14) 0.30594(3) 0.00497(12) Uani d 1
O O6 0.0000 0.0000 0.29666(6) 0.00458(18) Uani d 1
O O7 0.3333 0.6667 0.18977(6) 0.00459(18) Uani d 1
O O8 -0.16175(6) -0.83825(6) 0.18822(4) 0.00461(11) Uani d 1
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'
Be Be 0.0005 0.0002 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Al Al 0.0645 0.0514 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
O O 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
Cr Cr 0.3209 0.6236 '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
O7 Be1 O3 . 1_665 119.45(7)
O7 Be1 O3 . 2_565 119.45(7)
O3 Be1 O3 1_665 2_565 97.89(9)
O7 Be1 O3 . 3 119.45(7)
O3 Be1 O3 1_665 3 97.89(9)
O3 Be1 O3 2_565 3 97.89(9)
O7 Be1 Al1 . 2 138.88(3)
O3 Be1 Al1 1_665 2 48.95(5)
O3 Be1 Al1 2_565 2 48.95(5)
O3 Be1 Al1 3 2 101.67(10)
O7 Be1 Al1 . 1_565 138.88(3)
O3 Be1 Al1 1_665 1_565 48.95(5)
O3 Be1 Al1 2_565 1_565 101.67(10)
O3 Be1 Al1 3 1_565 48.95(5)
Al1 Be1 Al1 2 1_565 69.44(5)
O7 Be1 Al1 . 3_665 138.88(3)
O3 Be1 Al1 1_665 3_665 101.67(10)
O3 Be1 Al1 2_565 3_665 48.95(5)
O3 Be1 Al1 3 3_665 48.95(5)
Al1 Be1 Al1 2 3_665 69.44(5)
Al1 Be1 Al1 1_565 3_665 69.44(5)
O3 Al1 O3 7 1_655 180.00(4)
O3 Al1 O3 7 9_665 83.60(4)
O3 Al1 O3 1_655 9_665 96.40(4)
O3 Al1 O3 7 3_545 96.40(4)
O3 Al1 O3 1_655 3_545 83.60(4)
O3 Al1 O3 9_665 3_545 180.00(4)
O3 Al1 O2 7 . 84.58(3)
O3 Al1 O2 1_655 . 95.42(3)
O3 Al1 O2 9_665 . 84.58(3)
O3 Al1 O2 3_545 . 95.42(3)
O3 Al1 O2 7 7_655 95.42(3)
O3 Al1 O2 1_655 7_655 84.58(3)
O3 Al1 O2 9_665 7_655 95.42(3)
O3 Al1 O2 3_545 7_655 84.58(3)
O2 Al1 O2 . 7_655 180.0
O3 Al1 Be1 7 7_665 41.80(2)
O3 Al1 Be1 1_655 7_665 138.20(2)
O3 Al1 Be1 9_665 7_665 41.80(2)
O3 Al1 Be1 3_545 7_665 138.20(2)
O2 Al1 Be1 . 7_665 82.41(4)
O2 Al1 Be1 7_655 7_665 97.59(4)
O3 Al1 Be1 7 1_545 138.20(2)
O3 Al1 Be1 1_655 1_545 41.80(2)
O3 Al1 Be1 9_665 1_545 138.20(2)
O3 Al1 Be1 3_545 1_545 41.80(2)
O2 Al1 Be1 . 1_545 97.59(4)
O2 Al1 Be1 7_655 1_545 82.41(4)
Be1 Al1 Be1 7_665 1_545 180.00(7)
O3 Al1 Al1 7 2_545 139.043(16)
O3 Al1 Al1 1_655 2_545 40.957(16)
O3 Al1 Al1 9_665 2_545 95.088(18)
O3 Al1 Al1 3_545 2_545 84.912(18)
O2 Al1 Al1 . 2_545 136.211(19)
O2 Al1 Al1 7_655 2_545 43.790(19)
Be1 Al1 Al1 7_665 2_545 124.72(3)
Be1 Al1 Al1 1_545 2_545 55.28(3)
O3 Al1 Al1 7 2_655 40.957(16)
O3 Al1 Al1 1_655 2_655 139.043(16)
O3 Al1 Al1 9_665 2_655 84.912(18)
O3 Al1 Al1 3_545 2_655 95.088(18)
O2 Al1 Al1 . 2_655 43.789(19)
O2 Al1 Al1 7_655 2_655 136.210(19)
Be1 Al1 Al1 7_665 2_655 55.28(3)
Be1 Al1 Al1 1_545 2_655 124.72(3)
Al1 Al1 Al1 2_545 2_655 180.0
O3 Al1 Al1 7 3_665 84.912(18)
O3 Al1 Al1 1_655 3_665 95.088(18)
O3 Al1 Al1 9_665 3_665 40.957(16)
O3 Al1 Al1 3_545 3_665 139.043(16)
O2 Al1 Al1 . 3_665 43.789(19)
O2 Al1 Al1 7_655 3_665 136.211(19)
Be1 Al1 Al1 7_665 3_665 55.28(3)
Be1 Al1 Al1 1_545 3_665 124.72(3)
Al1 Al1 Al1 2_545 3_665 120.0
Al1 Al1 Al1 2_655 3_665 60.0
O3 Al1 Al1 7 3_655 95.088(18)
O3 Al1 Al1 1_655 3_655 84.912(18)
O3 Al1 Al1 9_665 3_655 139.043(16)
O3 Al1 Al1 3_545 3_655 40.957(16)
O2 Al1 Al1 . 3_655 136.211(19)
O2 Al1 Al1 7_655 3_655 43.789(19)
Be1 Al1 Al1 7_665 3_655 124.72(3)
Be1 Al1 Al1 1_545 3_655 55.28(3)
Al1 Al1 Al1 2_545 3_655 60.0
Al1 Al1 Al1 2_655 3_655 120.0
Al1 Al1 Al1 3_665 3_655 180.0
O2 Al2 O8 . 1_665 109.22(3)
O2 Al2 O8 . 2 109.22(3)
O8 Al2 O8 1_665 2 109.72(3)
O2 Al2 O8 . 3_655 109.22(3)
O8 Al2 O8 1_665 3_655 109.72(3)
O8 Al2 O8 2 3_655 109.72(3)
O6 Al3A O5 . 3_445 96.66(3)
O6 Al3A O5 . . 96.66(3)
O5 Al3A O5 3_445 . 82.22(4)
O6 Al3A O8 . 1_565 83.72(3)
O5 Al3A O8 3_445 1_565 175.23(3)
O5 Al3A O8 . 1_565 93.01(3)
O6 Al3A O8 . 2_445 83.72(3)
O5 Al3A O8 3_445 2_445 93.01(3)
O5 Al3A O8 . 2_445 175.23(3)
O8 Al3A O8 1_565 2_445 91.76(4)
O6 Al3A O7 . 1_445 178.60(4)
O5 Al3A O7 3_445 1_445 84.39(3)
O5 Al3A O7 . 1_445 84.40(3)
O8 Al3A O7 1_565 1_445 95.31(3)
O8 Al3A O7 2_445 1_445 95.31(3)
O6 Al3A Cr3B . 3_445 138.48(2)
O5 Al3A Cr3B 3_445 3_445 42.307(16)
O5 Al3A Cr3B . 3_445 85.296(19)
O8 Al3A Cr3B 1_565 3_445 137.735(18)
O8 Al3A Cr3B 2_445 3_445 91.271(18)
O7 Al3A Cr3B 1_445 3_445 42.450(19)
O6 Al3A Al3A . 3_445 138.48(2)
O5 Al3A Al3A 3_445 3_445 42.307(16)
O5 Al3A Al3A . 3_445 85.296(19)
O8 Al3A Al3A 1_565 3_445 137.735(18)
O8 Al3A Al3A 2_445 3_445 91.271(18)
O7 Al3A Al3A 1_445 3_445 42.450(19)
Cr3B Al3A Al3A 3_445 3_445 0.0
O6 Al3A Al3A . 2_455 138.48(2)
O5 Al3A Al3A 3_445 2_455 85.296(19)
O5 Al3A Al3A . 2_455 42.308(16)
O8 Al3A Al3A 1_565 2_455 91.271(18)
O8 Al3A Al3A 2_445 2_455 137.735(18)
O7 Al3A Al3A 1_445 2_455 42.451(19)
Cr3B Al3A Al3A 3_445 2_455 60.0
Al3A Al3A Al3A 3_445 2_455 60.0
O6 Al3A Cr3B . 2_455 138.48(2)
O5 Al3A Cr3B 3_445 2_455 85.296(19)
O5 Al3A Cr3B . 2_455 42.308(16)
O8 Al3A Cr3B 1_565 2_455 91.271(18)
O8 Al3A Cr3B 2_445 2_455 137.735(18)
O7 Al3A Cr3B 1_445 2_455 42.451(19)
Cr3B Al3A Cr3B 3_445 2_455 60.0
Al3A Al3A Cr3B 3_445 2_455 60.0
Al3A Al3A Cr3B 2_455 2_455 0.000(14)
O6 Al3A Cr3B . 3 41.52(2)
O5 Al3A Cr3B 3_445 3 137.691(16)
O5 Al3A Cr3B . 3 94.703(19)
O8 Al3A Cr3B 1_565 3 42.266(18)
O8 Al3A Cr3B 2_445 3 88.730(18)
O7 Al3A Cr3B 1_445 3 137.552(19)
Cr3B Al3A Cr3B 3_445 3 180.0
Al3A Al3A Cr3B 3_445 3 180.0
Al3A Al3A Cr3B 2_455 3 120.0
Cr3B Al3A Cr3B 2_455 3 120.0
O6 Al3A Al3A . 3 41.52(2)
O5 Al3A Al3A 3_445 3 137.691(16)
O5 Al3A Al3A . 3 94.703(19)
O8 Al3A Al3A 1_565 3 42.266(18)
O8 Al3A Al3A 2_445 3 88.730(18)
O7 Al3A Al3A 1_445 3 137.552(19)
Cr3B Al3A Al3A 3_445 3 180.0
Al3A Al3A Al3A 3_445 3 180.0
Al3A Al3A Al3A 2_455 3 120.0
Cr3B Al3A Al3A 2_455 3 120.0
Cr3B Al3A Al3A 3 3 0.0
O1 Al4A O1 7_656 . 180.0
O1 Al4A O4 7_656 9_666 96.18(3)
O1 Al4A O4 . 9_666 83.82(3)
O1 Al4A O4 7_656 3_545 83.82(3)
O1 Al4A O4 . 3_545 96.18(3)
O4 Al4A O4 9_666 3_545 180.00(3)
O1 Al4A O4 7_656 7_556 96.18(3)
O1 Al4A O4 . 7_556 83.82(3)
O4 Al4A O4 9_666 7_556 83.33(4)
O4 Al4A O4 3_545 7_556 96.67(4)
O1 Al4A O4 7_656 1_655 83.82(3)
O1 Al4A O4 . 1_655 96.18(3)
O4 Al4A O4 9_666 1_655 96.67(4)
O4 Al4A O4 3_545 1_655 83.33(4)
O4 Al4A O4 7_556 1_655 180.0
O1 Al4A Al4A 7_656 2_545 42.07(2)
O1 Al4A Al4A . 2_545 137.93(2)
O4 Al4A Al4A 9_666 2_545 94.432(19)
O4 Al4A Al4A 3_545 2_545 85.568(19)
O4 Al4A Al4A 7_556 2_545 137.904(15)
O4 Al4A Al4A 1_655 2_545 42.096(15)
O1 Al4A Al4A 7_656 2_655 137.93(2)
O1 Al4A Al4A . 2_655 42.07(2)
O4 Al4A Al4A 9_666 2_655 85.568(19)
O4 Al4A Al4A 3_545 2_655 94.432(19)
O4 Al4A Al4A 7_556 2_655 42.096(15)
O4 Al4A Al4A 1_655 2_655 137.904(15)
Al4A Al4A Al4A 2_545 2_655 180.0
O1 Al4A Cr4B 7_656 2_545 42.07(2)
O1 Al4A Cr4B . 2_545 137.93(2)
O4 Al4A Cr4B 9_666 2_545 94.432(19)
O4 Al4A Cr4B 3_545 2_545 85.568(19)
O4 Al4A Cr4B 7_556 2_545 137.904(15)
O4 Al4A Cr4B 1_655 2_545 42.096(15)
Al4A Al4A Cr4B 2_545 2_545 0.0
Al4A Al4A Cr4B 2_655 2_545 180.0
O1 Al4A Cr4B 7_656 2_655 137.93(2)
O1 Al4A Cr4B . 2_655 42.07(2)
O4 Al4A Cr4B 9_666 2_655 85.568(19)
O4 Al4A Cr4B 3_545 2_655 94.432(19)
O4 Al4A Cr4B 7_556 2_655 42.096(15)
O4 Al4A Cr4B 1_655 2_655 137.904(15)
Al4A Al4A Cr4B 2_545 2_655 180.0
Al4A Al4A Cr4B 2_655 2_655 0.0
Cr4B Al4A Cr4B 2_545 2_655 180.0
O1 Al4A Al4A 7_656 3_665 137.93(2)
O1 Al4A Al4A . 3_665 42.07(2)
O4 Al4A Al4A 9_666 3_665 42.096(15)
O4 Al4A Al4A 3_545 3_665 137.904(15)
O4 Al4A Al4A 7_556 3_665 85.569(18)
O4 Al4A Al4A 1_655 3_665 94.431(18)
Al4A Al4A Al4A 2_545 3_665 120.0
Al4A Al4A Al4A 2_655 3_665 60.0
Cr4B Al4A Al4A 2_545 3_665 120.0
Cr4B Al4A Al4A 2_655 3_665 60.0
O1 Al4A Cr4B 7_656 3_665 137.93(2)
O1 Al4A Cr4B . 3_665 42.07(2)
O4 Al4A Cr4B 9_666 3_665 42.096(15)
O4 Al4A Cr4B 3_545 3_665 137.904(15)
O4 Al4A Cr4B 7_556 3_665 85.569(18)
O4 Al4A Cr4B 1_655 3_665 94.431(18)
Al4A Al4A Cr4B 2_545 3_665 120.0
Al4A Al4A Cr4B 2_655 3_665 60.0
Cr4B Al4A Cr4B 2_545 3_665 120.0
Cr4B Al4A Cr4B 2_655 3_665 60.0
Al4A Al4A Cr4B 3_665 3_665 0.0
O5 Al5 O5 3 2_565 83.03(3)
O5 Al5 O5 3 1_665 83.03(3)
O5 Al5 O5 2_565 1_665 83.02(3)
O5 Al5 O4 3 3 96.83(2)
O5 Al5 O4 2_565 3 179.81(3)
O5 Al5 O4 1_665 3 96.83(2)
O5 Al5 O4 3 2_565 96.83(2)
O5 Al5 O4 2_565 2_565 96.83(2)
O5 Al5 O4 1_665 2_565 179.81(3)
O4 Al5 O4 3 2_565 83.31(3)
O5 Al5 O4 3 1_665 179.81(3)
O5 Al5 O4 2_565 1_665 96.83(2)
O5 Al5 O4 1_665 1_665 96.83(2)
O4 Al5 O4 3 1_665 83.31(3)
O4 Al5 O4 2_565 1_665 83.31(3)
O5 Al5 Cr4B 3 1_565 138.301(15)
O5 Al5 Cr4B 2_565 1_565 138.300(15)
O5 Al5 Cr4B 1_665 1_565 94.97(2)
O4 Al5 Cr4B 3 1_565 41.825(15)
O4 Al5 Cr4B 2_565 1_565 85.22(2)
O4 Al5 Cr4B 1_665 1_565 41.826(15)
O5 Al5 Al4A 3 1_565 138.301(15)
O5 Al5 Al4A 2_565 1_565 138.300(15)
O5 Al5 Al4A 1_665 1_565 94.97(2)
O4 Al5 Al4A 3 1_565 41.825(15)
O4 Al5 Al4A 2_565 1_565 85.22(2)
O4 Al5 Al4A 1_665 1_565 41.826(15)
Cr4B Al5 Al4A 1_565 1_565 0.0
O5 Al5 Cr4B 3 2 138.301(15)
O5 Al5 Cr4B 2_565 2 94.97(2)
O5 Al5 Cr4B 1_665 2 138.300(15)
O4 Al5 Cr4B 3 2 85.22(2)
O4 Al5 Cr4B 2_565 2 41.825(15)
O4 Al5 Cr4B 1_665 2 41.826(15)
Cr4B Al5 Cr4B 1_565 2 59.719(10)
Al4A Al5 Cr4B 1_565 2 59.719(10)
O5 Al5 Al4A 3 2 138.301(15)
O5 Al5 Al4A 2_565 2 94.97(2)
O5 Al5 Al4A 1_665 2 138.300(15)
O4 Al5 Al4A 3 2 85.22(2)
O4 Al5 Al4A 2_565 2 41.825(15)
O4 Al5 Al4A 1_665 2 41.826(15)
Cr4B Al5 Al4A 1_565 2 59.7
Al4A Al5 Al4A 1_565 2 59.719(10)
Cr4B Al5 Al4A 2 2 0.0
O5 Al5 Cr4B 3 3_665 94.97(2)
O5 Al5 Cr4B 2_565 3_665 138.301(15)
O5 Al5 Cr4B 1_665 3_665 138.301(15)
O4 Al5 Cr4B 3 3_665 41.826(15)
O4 Al5 Cr4B 2_565 3_665 41.826(15)
O4 Al5 Cr4B 1_665 3_665 85.22(2)
Cr4B Al5 Cr4B 1_565 3_665 59.719(10)
Al4A Al5 Cr4B 1_565 3_665 59.719(10)
Cr4B Al5 Cr4B 2 3_665 59.719(10)
Al4A Al5 Cr4B 2 3_665 59.719(10)
O5 Al5 Al4A 3 3_665 94.97(2)
O5 Al5 Al4A 2_565 3_665 138.301(15)
O5 Al5 Al4A 1_665 3_665 138.301(15)
O4 Al5 Al4A 3 3_665 41.826(15)
O4 Al5 Al4A 2_565 3_665 41.826(15)
O4 Al5 Al4A 1_665 3_665 85.22(2)
Cr4B Al5 Al4A 1_565 3_665 59.7
Al4A Al5 Al4A 1_565 3_665 59.719(10)
Cr4B Al5 Al4A 2 3_665 59.7
Al4A Al5 Al4A 2 3_665 59.719(10)
Cr4B Al5 Al4A 3_665 3_665 0.0
O4 Mg1A O4 1_655 2_565 108.66(2)
O4 Mg1A O4 1_655 3_445 108.66(2)
O4 Mg1A O4 2_565 3_445 108.66(2)
O4 Mg1A O6 1_655 . 110.27(2)
O4 Mg1A O6 2_565 . 110.27(2)
O4 Mg1A O6 3_445 . 110.27(2)
O4 Mg1A Al5 1_655 1_445 121.368(4)
O4 Mg1A Al5 2_565 1_445 121.369(4)
O4 Mg1A Al5 3_445 1_445 29.94(2)
O6 Mg1A Al5 . 1_445 80.334(11)
O4 Mg1A Al5 1_655 . 121.368(4)
O4 Mg1A Al5 2_565 . 29.94(2)
O4 Mg1A Al5 3_445 . 121.368(4)
O6 Mg1A Al5 . . 80.336(11)
Al5 Mg1A Al5 1_445 . 117.240(6)
O4 Mg1A Al5 1_655 1_545 29.94(2)
O4 Mg1A Al5 2_565 1_545 121.369(4)
O4 Mg1A Al5 3_445 1_545 121.369(4)
O6 Mg1A Al5 . 1_545 80.334(11)
Al5 Mg1A Al5 1_445 1_545 117.239(6)
Al5 Mg1A Al5 . 1_545 117.240(6)
O4 Mg1A Al3A 1_655 2 80.84(2)
O4 Mg1A Al3A 2_565 2 122.16(2)
O4 Mg1A Al3A 3_445 2 122.16(2)
O6 Mg1A Al3A . 2 29.432(6)
Al5 Mg1A Al3A 1_445 2 95.507(12)
Al5 Mg1A Al3A . 2 95.508(12)
Al5 Mg1A Al3A 1_545 2 50.903(10)
O4 Mg1A Cr3B 1_655 2 80.84(2)
O4 Mg1A Cr3B 2_565 2 122.16(2)
O4 Mg1A Cr3B 3_445 2 122.16(2)
O6 Mg1A Cr3B . 2 29.432(6)
Al5 Mg1A Cr3B 1_445 2 95.507(12)
Al5 Mg1A Cr3B . 2 95.508(12)
Al5 Mg1A Cr3B 1_545 2 50.903(10)
Al3A Mg1A Cr3B 2 2 0.000(5)
O4 Mg1A Al3A 1_655 3 122.16(2)
O4 Mg1A Al3A 2_565 3 80.84(2)
O4 Mg1A Al3A 3_445 3 122.16(2)
O6 Mg1A Al3A . 3 29.432(6)
Al5 Mg1A Al3A 1_445 3 95.508(12)
Al5 Mg1A Al3A . 3 50.904(10)
Al5 Mg1A Al3A 1_545 3 95.508(12)
Al3A Mg1A Al3A 2 3 50.371(11)
Cr3B Mg1A Al3A 2 3 50.4
O4 Mg1A Cr3B 1_655 3 122.16(2)
O4 Mg1A Cr3B 2_565 3 80.84(2)
O4 Mg1A Cr3B 3_445 3 122.16(2)
O6 Mg1A Cr3B . 3 29.432(6)
Al5 Mg1A Cr3B 1_445 3 95.508(12)
Al5 Mg1A Cr3B . 3 50.904(10)
Al5 Mg1A Cr3B 1_545 3 95.508(12)
Al3A Mg1A Cr3B 2 3 50.371(11)
Cr3B Mg1A Cr3B 2 3 50.371(11)
Al3A Mg1A Cr3B 3 3 0.000(15)
O5 Mg2A O5 1_655 2_665 109.66(2)
O5 Mg2A O5 1_655 3 109.66(2)
O5 Mg2A O5 2_665 3 109.66(2)
O5 Mg2A O1 1_655 . 109.28(2)
O5 Mg2A O1 2_665 . 109.28(2)
O5 Mg2A O1 3 . 109.28(2)
O5 Mg2A Al5 1_655 1_655 121.522(3)
O5 Mg2A Al5 2_665 1_655 29.45(2)
O5 Mg2A Al5 3 1_655 121.522(3)
O1 Mg2A Al5 . 1_655 79.835(12)
O5 Mg2A Al5 1_655 1_545 29.45(2)
O5 Mg2A Al5 2_665 1_545 121.522(3)
O5 Mg2A Al5 3 1_545 121.522(3)
O1 Mg2A Al5 . 1_545 79.835(12)
Al5 Mg2A Al5 1_655 1_545 116.954(7)
O5 Mg2A Al5 1_655 . 121.521(4)
O5 Mg2A Al5 2_665 . 121.521(3)
O5 Mg2A Al5 3 . 29.45(2)
O1 Mg2A Al5 . . 79.834(12)
Al5 Mg2A Al5 1_655 . 116.954(7)
Al5 Mg2A Al5 1_545 . 116.954(7)
O5 Mg2A Al3A 1_655 2 29.673(12)
O5 Mg2A Al3A 2_665 2 121.37(3)
O5 Mg2A Al3A 3 2 79.990(15)
O1 Mg2A Al3A . 2 121.802(9)
Al5 Mg2A Al3A 1_655 2 144.821(12)
Al5 Mg2A Al3A 1_545 2 50.834(9)
Al5 Mg2A Al3A . 2 95.349(7)
O5 Mg2A Al3A 1_655 1_655 29.674(12)
O5 Mg2A Al3A 2_665 1_655 79.990(15)
O5 Mg2A Al3A 3 1_655 121.37(3)
O1 Mg2A Al3A . 1_655 121.802(9)
Al5 Mg2A Al3A 1_655 1_655 95.348(7)
Al5 Mg2A Al3A 1_545 1_655 50.834(8)
Al5 Mg2A Al3A . 1_655 144.822(12)
Al3A Mg2A Al3A 2 1_655 50.270(9)
O5 Mg2A Al3A 1_655 3_655 79.990(15)
O5 Mg2A Al3A 2_665 3_655 29.674(12)
O5 Mg2A Al3A 3 3_655 121.37(3)
O1 Mg2A Al3A . 3_655 121.802(9)
Al5 Mg2A Al3A 1_655 3_655 50.834(9)
Al5 Mg2A Al3A 1_545 3_655 95.348(7)
Al5 Mg2A Al3A . 3_655 144.822(12)
Al3A Mg2A Al3A 2 3_655 94.786(12)
Al3A Mg2A Al3A 1_655 3_655 50.318(10)
O5 Mg2A Al3A 1_655 2_665 121.37(3)
O5 Mg2A Al3A 2_665 2_665 29.673(12)
O5 Mg2A Al3A 3 2_665 79.990(15)
O1 Mg2A Al3A . 2_665 121.802(9)
Al5 Mg2A Al3A 1_655 2_665 50.834(8)
Al5 Mg2A Al3A 1_545 2_665 144.821(12)
Al5 Mg2A Al3A . 2_665 95.349(7)
Al3A Mg2A Al3A 2 2_665 116.397(17)
Al3A Mg2A Al3A 1_655 2_665 94.786(12)
Al3A Mg2A Al3A 3_655 2_665 50.270(9)
O5 Mg2A Al3A 1_655 3 79.989(15)
O5 Mg2A Al3A 2_665 3 121.37(3)
O5 Mg2A Al3A 3 3 29.674(12)
O1 Mg2A Al3A . 3 121.802(9)
Al5 Mg2A Al3A 1_655 3 144.822(12)
Al5 Mg2A Al3A 1_545 3 95.349(7)
Al5 Mg2A Al3A . 3 50.835(9)
Al3A Mg2A Al3A 2 3 50.317(10)
Al3A Mg2A Al3A 1_655 3 94.786(12)
Al3A Mg2A Al3A 3_655 3 116.397(17)
Al3A Mg2A Al3A 2_665 3 94.786(12)
O3 Mg3 O3 3_445 2_565 103.70(3)
O3 Mg3 O3 3_445 1_655 103.70(3)
O3 Mg3 O3 2_565 1_655 103.70(3)
O3 Mg3 O8 3_445 3_655 160.59(4)
O3 Mg3 O8 2_565 3_655 88.06(2)
O3 Mg3 O8 1_655 3_655 88.06(2)
O3 Mg3 O8 3_445 1_565 88.06(2)
O3 Mg3 O8 2_565 1_565 88.06(2)
O3 Mg3 O8 1_655 1_565 160.59(4)
O8 Mg3 O8 3_655 1_565 76.80(3)
O3 Mg3 O8 3_445 2_445 88.064(19)
O3 Mg3 O8 2_565 2_445 160.59(4)
O3 Mg3 O8 1_655 2_445 88.06(2)
O8 Mg3 O8 3_655 2_445 76.80(3)
O8 Mg3 O8 1_565 2_445 76.80(3)
O3 Mg3 Al3A 3_445 . 82.33(2)
O3 Mg3 Al3A 2_565 . 126.66(2)
O3 Mg3 Al3A 1_655 . 126.66(2)
O8 Mg3 Al3A 3_655 . 78.26(3)
O8 Mg3 Al3A 1_565 . 38.697(14)
O8 Mg3 Al3A 2_445 . 38.697(14)
O3 Mg3 Al3A 3_445 3 126.66(2)
O3 Mg3 Al3A 2_565 3 82.33(2)
O3 Mg3 Al3A 1_655 3 126.66(2)
O8 Mg3 Al3A 3_655 3 38.697(14)
O8 Mg3 Al3A 1_565 3 38.697(14)
O8 Mg3 Al3A 2_445 3 78.26(3)
Al3A Mg3 Al3A . 3 55.352(15)
O3 Mg3 Cr3B 3_445 3 126.66(2)
O3 Mg3 Cr3B 2_565 3 82.33(2)
O3 Mg3 Cr3B 1_655 3 126.66(2)
O8 Mg3 Cr3B 3_655 3 38.697(14)
O8 Mg3 Cr3B 1_565 3 38.697(14)
O8 Mg3 Cr3B 2_445 3 78.26(3)
Al3A Mg3 Cr3B . 3 55.4
Al3A Mg3 Cr3B 3 3 0.000(16)
O3 Mg3 Al3A 3_445 2 126.66(2)
O3 Mg3 Al3A 2_565 2 126.66(2)
O3 Mg3 Al3A 1_655 2 82.33(2)
O8 Mg3 Al3A 3_655 2 38.697(14)
O8 Mg3 Al3A 1_565 2 78.26(3)
O8 Mg3 Al3A 2_445 2 38.697(14)
Al3A Mg3 Al3A . 2 55.352(15)
Al3A Mg3 Al3A 3 2 55.351(15)
Cr3B Mg3 Al3A 3 2 55.4
O3 Mg3 Cr3B 3_445 2 126.66(2)
O3 Mg3 Cr3B 2_565 2 126.66(2)
O3 Mg3 Cr3B 1_655 2 82.33(2)
O8 Mg3 Cr3B 3_655 2 38.697(14)
O8 Mg3 Cr3B 1_565 2 78.26(3)
O8 Mg3 Cr3B 2_445 2 38.697(14)
Al3A Mg3 Cr3B . 2 55.4
Al3A Mg3 Cr3B 3 2 55.351(15)
Cr3B Mg3 Cr3B 3 2 55.351(15)
Al3A Mg3 Cr3B 2 2 0.000(6)
Cr4B O1 Al4A 2_655 2_655 0.0
Cr4B O1 Al4A 2_655 . 95.9
Al4A O1 Al4A 2_655 . 95.86(4)
Cr4B O1 Cr4B 2_655 3_665 95.86(4)
Al4A O1 Cr4B 2_655 3_665 95.86(4)
Al4A O1 Cr4B . 3_665 95.9
Cr4B O1 Al4A 2_655 3_665 95.9
Al4A O1 Al4A 2_655 3_665 95.86(4)
Al4A O1 Al4A . 3_665 95.86(4)
Cr4B O1 Al4A 3_665 3_665 0.0
Cr4B O1 Mg2A 2_655 . 121.00(3)
Al4A O1 Mg2A 2_655 . 121.00(3)
Al4A O1 Mg2A . . 121.00(3)
Cr4B O1 Mg2A 3_665 . 121.00(3)
Al4A O1 Mg2A 3_665 . 121.00(3)
Al2 O2 Al1 . . 123.53(3)
Al2 O2 Al1 . 2_655 123.53(3)
Al1 O2 Al1 . 2_655 92.42(4)
Al2 O2 Al1 . 3_665 123.53(3)
Al1 O2 Al1 . 3_665 92.42(4)
Al1 O2 Al1 2_655 3_665 92.42(4)
Be1 O3 Al1 1_445 2_445 89.25(5)
Be1 O3 Al1 1_445 1_455 89.25(5)
Al1 O3 Al1 2_445 1_455 98.09(3)
Be1 O3 Mg3 1_445 1_455 125.79(8)
Al1 O3 Mg3 2_445 1_455 122.63(2)
Al1 O3 Mg3 1_455 1_455 122.63(2)
Cr4B O4 Al4A 1_455 1_455 0.0
Cr4B O4 Cr4B 1_455 2_445 95.81(3)
Al4A O4 Cr4B 1_455 2_445 95.81(3)
Cr4B O4 Al4A 1_455 2_445 95.8
Al4A O4 Al4A 1_455 2_445 95.81(3)
Cr4B O4 Al4A 2_445 2_445 0.0
Cr4B O4 Al5 1_455 1_445 96.34(3)
Al4A O4 Al5 1_455 1_445 96.34(3)
Cr4B O4 Al5 2_445 1_445 96.34(3)
Al4A O4 Al5 2_445 1_445 96.34(3)
Cr4B O4 Cr1B 1_455 1_455 121.23(2)
Al4A O4 Cr1B 1_455 1_455 121.23(2)
Cr4B O4 Cr1B 2_445 1_455 121.23(2)
Al4A O4 Cr1B 2_445 1_455 121.23(2)
Al5 O4 Cr1B 1_445 1_455 119.86(4)
Cr4B O4 Mg1A 1_455 1_455 121.23(2)
Al4A O4 Mg1A 1_455 1_455 121.23(2)
Cr4B O4 Mg1A 2_445 1_455 121.23(2)
Al4A O4 Mg1A 2_445 1_455 121.23(2)
Al5 O4 Mg1A 1_445 1_455 119.86(4)
Cr1B O4 Mg1A 1_455 1_455 0.0
Al5 O5 Cr3B 1_445 2_455 97.03(3)
Al5 O5 Al3A 1_445 2_455 97.03(3)
Cr3B O5 Al3A 2_455 2_455 0.0
Al5 O5 Al3A 1_445 . 97.03(3)
Cr3B O5 Al3A 2_455 . 95.4
Al3A O5 Al3A 2_455 . 95.38(3)
Al5 O5 Cr2B 1_445 1_455 120.65(4)
Cr3B O5 Cr2B 2_455 1_455 120.46(2)
Al3A O5 Cr2B 2_455 1_455 120.46(2)
Al3A O5 Cr2B . 1_455 120.46(2)
Al5 O5 Mg2A 1_445 1_455 120.65(4)
Cr3B O5 Mg2A 2_455 1_455 120.46(2)
Al3A O5 Mg2A 2_455 1_455 120.46(2)
Al3A O5 Mg2A . 1_455 120.46(2)
Cr2B O5 Mg2A 1_455 1_455 0.0
Cr3B O6 Al3A 3 3 0.0
Cr3B O6 Cr3B 3 2 96.97(4)
Al3A O6 Cr3B 3 2 96.97(4)
Cr3B O6 Al3A 3 2 97.0
Al3A O6 Al3A 3 2 96.97(4)
Cr3B O6 Al3A 2 2 0.0
Cr3B O6 Al3A 3 . 97.0
Al3A O6 Al3A 3 . 96.97(4)
Cr3B O6 Al3A 2 . 97.0
Al3A O6 Al3A 2 . 96.97(4)
Cr3B O6 Mg1A 3 . 120.16(3)
Al3A O6 Mg1A 3 . 120.16(3)
Cr3B O6 Mg1A 2 . 120.16(3)
Al3A O6 Mg1A 2 . 120.16(3)
Al3A O6 Mg1A . . 120.16(3)
Be1 O7 Cr3B . 2_565 121.57(3)
Be1 O7 Al3A . 2_565 121.57(3)
Cr3B O7 Al3A 2_565 2_565 0.0
Be1 O7 Al3A . 1_665 121.57(3)
Cr3B O7 Al3A 2_565 1_665 95.1
Al3A O7 Al3A 2_565 1_665 95.10(4)
Be1 O7 Cr3B . 1_665 121.57(3)
Cr3B O7 Cr3B 2_565 1_665 95.10(4)
Al3A O7 Cr3B 2_565 1_665 95.10(4)
Al3A O7 Cr3B 1_665 1_665 0.000(18)
Be1 O7 Cr3B . 3 121.57(3)
Cr3B O7 Cr3B 2_565 3 95.10(4)
Al3A O7 Cr3B 2_565 3 95.10(4)
Al3A O7 Cr3B 1_665 3 95.10(4)
Cr3B O7 Cr3B 1_665 3 95.10(4)
Be1 O7 Al3A . 3 121.57(3)
Cr3B O7 Al3A 2_565 3 95.1
Al3A O7 Al3A 2_565 3 95.10(4)
Al3A O7 Al3A 1_665 3 95.10(4)
Cr3B O7 Al3A 1_665 3 95.1
Cr3B O7 Al3A 3 3 0.0
Al2 O8 Cr3B 1_445 3_545 123.84(2)
Al2 O8 Al3A 1_445 3_545 123.84(2)
Cr3B O8 Al3A 3_545 3_545 0.0
Al2 O8 Al3A 1_445 1_545 123.84(2)
Cr3B O8 Al3A 3_545 1_545 95.5
Al3A O8 Al3A 3_545 1_545 95.47(4)
Al2 O8 Cr3B 1_445 1_545 123.84(2)
Cr3B O8 Cr3B 3_545 1_545 95.47(4)
Al3A O8 Cr3B 3_545 1_545 95.47(4)
Al3A O8 Cr3B 1_545 1_545 0.000(17)
Al2 O8 Mg3 1_445 1_545 116.60(4)
Cr3B O8 Mg3 3_545 1_545 95.04(3)
Al3A O8 Mg3 3_545 1_545 95.04(3)
Al3A O8 Mg3 1_545 1_545 95.04(3)
Cr3B O8 Mg3 1_545 1_545 95.04(3)
loop_
_geom_bond_atom_site_label_1
_geom_bond_atom_site_label_2
_geom_bond_site_symmetry_2
_geom_bond_distance
Be1 O7 . 1.602(2)
Be1 O3 1_665 1.6615(13)
Be1 O3 2_565 1.6615(13)
Be1 O3 3 1.6615(13)
Be1 Al1 2 2.4926(17)
Be1 Al1 1_565 2.4926(17)
Be1 Al1 3_665 2.4926(17)
Al1 O3 7 1.8799(5)
Al1 O3 1_655 1.8799(5)
Al1 O3 9_665 1.8799(5)
Al1 O3 3_545 1.8799(5)
Al1 O2 . 1.9666(6)
Al1 O2 7_655 1.9667(6)
Al1 Be1 7_665 2.4926(17)
Al1 Be1 1_545 2.4926(17)
Al1 Al1 2_545 2.83940(15)
Al1 Al1 2_655 2.83940(14)
Al1 Al1 3_665 2.83940(15)
Al1 Al1 3_655 2.83940(14)
Al2 O2 . 1.7765(12)
Al2 O8 1_665 1.7874(7)
Al2 O8 2 1.7874(7)
Al2 O8 3_655 1.7874(7)
Al3A O6 . 1.8969(6)
Al3A O5 3_445 1.9189(5)
Al3A O5 . 1.9189(5)
Al3A O8 1_565 1.9193(5)
Al3A O8 2_445 1.9193(5)
Al3A O7 1_445 1.9232(6)
Al3A Cr3B 3_445 2.8381(5)
Al3A Al3A 3_445 2.8381(5)
Al3A Al3A 2_455 2.8381(5)
Al3A Cr3B 2_455 2.8381(5)
Al3A Cr3B 3 2.8407(5)
Al3A Al3A 3 2.8407(5)
Al4A O1 7_656 1.9124(6)
Al4A O1 . 1.9125(6)
Al4A O4 9_666 1.9133(5)
Al4A O4 3_545 1.9133(5)
Al4A O4 7_556 1.9133(5)
Al4A O4 1_655 1.9133(5)
Al4A Al4A 2_545 2.83940(14)
Al4A Al4A 2_655 2.83940(14)
Al4A Cr4B 2_545 2.83940(14)
Al4A Cr4B 2_655 2.83940(14)
Al4A Al4A 3_665 2.83940(14)
Al4A Cr4B 3_665 2.83940(14)
Al5 O5 3 1.9037(7)
Al5 O5 2_565 1.9037(7)
Al5 O5 1_665 1.9037(7)
Al5 O4 3 1.9136(8)
Al5 O4 2_565 1.9136(8)
Al5 O4 1_665 1.9136(8)
Al5 Cr4B 1_565 2.8515(4)
Al5 Al4A 1_565 2.8515(4)
Al5 Cr4B 2 2.8515(4)
Al5 Al4A 2 2.8515(4)
Al5 Cr4B 3_665 2.8515(4)
Al5 Al4A 3_665 2.8515(4)
Mg1A O4 1_655 1.9295(7)
Mg1A O4 2_565 1.9296(7)
Mg1A O4 3_445 1.9296(7)
Mg1A O6 . 1.9537(12)
Mg1A Al5 1_445 3.3259(2)
Mg1A Al5 1_545 3.3259(2)
Mg1A Al3A 2 3.3376(6)
Mg1A Cr3B 2 3.3376(6)
Mg1A Al3A 3 3.3376(6)
Mg1A Cr3B 3 3.3376(6)
Mg2A O5 1_655 1.9300(7)
Mg2A O5 2_665 1.9300(7)
Mg2A O5 3 1.9300(7)
Mg2A O1 . 1.9361(13)
Mg2A Al5 1_655 3.3310(2)
Mg2A Al5 1_545 3.3310(2)
Mg2A Al3A 2 3.3410(3)
Mg2A Al3A 1_655 3.3410(3)
Mg2A Al3A 3_655 3.3410(3)
Mg2A Al3A 2_665 3.3410(3)
Mg2A Al3A 3 3.3410(3)
Mg3 O3 3_445 2.0173(7)
Mg3 O3 2_565 2.0173(7)
Mg3 O3 1_655 2.0173(7)
Mg3 O8 3_655 2.2181(8)
Mg3 O8 1_565 2.2181(8)
Mg3 O8 2_445 2.2181(8)
Mg3 Al3A 3 3.0580(7)
Mg3 Cr3B 3 3.0580(7)
Mg3 Al3A 2 3.0580(7)
Mg3 Cr3B 2 3.0580(7)
O1 Cr4B 2_655 1.9125(6)
O1 Al4A 2_655 1.9125(6)
O1 Cr4B 3_665 1.9125(6)
O1 Al4A 3_665 1.9125(6)
O2 Al1 2_655 1.9666(6)
O2 Al1 3_665 1.9666(6)
O3 Be1 1_445 1.6616(13)
O3 Al1 2_445 1.8799(5)
O3 Al1 1_455 1.8799(5)
O3 Mg3 1_455 2.0173(7)
O4 Cr4B 1_455 1.9133(5)
O4 Al4A 1_455 1.9133(5)
O4 Cr4B 2_445 1.9133(5)
O4 Al4A 2_445 1.9133(5)
O4 Al5 1_445 1.9136(8)
O4 Cr1B 1_455 1.9295(7)
O4 Mg1A 1_455 1.9295(7)
O5 Al5 1_445 1.9036(7)
O5 Cr3B 2_455 1.9188(5)
O5 Al3A 2_455 1.9188(5)
O5 Cr2B 1_455 1.9300(7)
O5 Mg2A 1_455 1.9300(7)
O6 Cr3B 3 1.8969(6)
O6 Al3A 3 1.8969(6)
O6 Cr3B 2 1.8969(6)
O6 Al3A 2 1.8969(6)
O7 Cr3B 2_565 1.9232(6)
O7 Al3A 2_565 1.9232(6)
O7 Al3A 1_665 1.9232(6)
O7 Cr3B 1_665 1.9232(6)
O7 Cr3B 3 1.9232(6)
O7 Al3A 3 1.9232(6)
O8 Al2 1_445 1.7874(7)
O8 Cr3B 3_545 1.9193(5)
O8 Al3A 3_545 1.9193(5)
O8 Al3A 1_545 1.9193(5)
O8 Cr3B 1_545 1.9193(5)
O8 Mg3 1_545 2.2181(8)

_cod_database_fobs_code 2241752
