data_global _chemical_name_mineral 'Senaite' loop_ _publ_author_name 'Armbruster T' 'Kunz M' _journal_name_full 'European Journal of Mineralogy' _journal_volume 2 _journal_year 1990 _journal_page_first 163 _journal_page_last 170 _publ_section_title ; Cation arrangement in a unusual uranium-rich senaite: crystal structure study at 130 K ; _database_code_amcsd 0006379 _chemical_formula_sum 'Pb.508 U.466 Fe8.558 Ti10.944 O38' _cell_length_a 10.439 _cell_length_b 10.439 _cell_length_c 21.091 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 1990.424 _exptl_crystal_density_diffrn 4.570 _symmetry_space_group_name_H-M 'R -3' loop_ _space_group_symop_operation_xyz 'x,y,z' '2/3+x,1/3+y,1/3+z' '1/3+x,2/3+y,2/3+z' 'y,-x+y,-z' '2/3+y,1/3-x+y,1/3-z' '1/3+y,2/3-x+y,2/3-z' '-x+y,-x,z' '2/3-x+y,1/3-x,1/3+z' '1/3-x+y,2/3-x,2/3+z' '-x,-y,-z' '2/3-x,1/3-y,1/3-z' '1/3-x,2/3-y,2/3-z' '-y,x-y,z' '2/3-y,1/3+x-y,1/3+z' '1/3-y,2/3+x-y,2/3+z' 'x-y,x,-z' '2/3+x-y,1/3+x,1/3-z' '1/3+x-y,2/3+x,2/3-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv PbA 0.00000 0.00000 0.01340 0.25400 0.02926 UM1 0.00000 0.00000 0.50000 0.46600 0.00937 FeM2 0.00000 0.00000 0.31020 0.66700 0.00836 FeM3 0.18430 0.14380 0.16560 0.77800 0.00988 TiM4 -0.08420 0.24460 0.39200 0.92500 0.01127 TiM5 0.07660 -0.24160 0.39840 0.89900 0.01001 FeM6a 0.00000 0.00000 0.39040 0.09300 0.02280 FeM6b 0.00000 0.00000 0.36430 0.09300 0.02280 FeM7 0.10990 0.36640 0.16600 0.11800 0.03432 FeM8 0.17600 0.11890 0.05640 0.13300 0.05915 FeM9 0.17740 0.12700 0.27320 0.11300 0.03116 O1 -0.13110 0.05500 0.43810 1.00000 0.01697 O2 -0.28760 -0.49250 0.44430 1.00000 0.01735 O3 0.35830 0.25700 0.55840 1.00000 0.01343 O4 -0.40740 -0.43950 0.55070 1.00000 0.01570 O5 0.05220 0.19740 0.33520 1.00000 0.01507 O6 0.36450 0.26670 0.33960 1.00000 0.01748 O7 0.00000 0.00000 0.21420 1.00000 0.01343 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 PbA 0.03280 0.03280 0.02220 0.01640 0.00000 0.00000 UM1 0.00970 0.00970 0.00860 0.00480 0.00000 0.00000 FeM2 0.00860 0.00860 0.00800 0.00430 0.00000 0.00000 FeM3 0.00900 0.00950 0.01120 0.00440 0.00090 0.00010 TiM4 0.00970 0.01170 0.01150 0.00460 0.00230 -0.00090 TiM5 0.01020 0.01180 0.00780 0.00540 0.00060 0.00030 FeM7 0.03100 0.02700 0.04500 0.01400 0.00000 -0.00400 FeM8 0.04000 0.04000 0.10000 0.01600 0.01100 0.01800 FeM9 0.03000 0.02300 0.03700 0.01000 -0.00600 -0.00200 O1 0.01200 0.01300 0.02100 0.00300 0.00300 -0.00200 O2 0.01600 0.01400 0.02300 0.00800 0.00400 0.00200 O3 0.01700 0.01100 0.01400 0.00900 0.00000 0.00000 O4 0.01700 0.01200 0.01900 0.00800 -0.00200 -0.00100 O5 0.01900 0.02000 0.01600 0.00900 0.00600 0.00700 O6 0.02000 0.02300 0.01500 0.01400 0.00000 0.00000 O7 0.00900 0.00900 0.02200 0.00400 0.00000 0.00000