data_global _amcsd_formula_title 'Na6[(UO2)(MoO4)4]' loop_ _publ_author_name 'Krivovichev S V' 'Burns P C' _journal_name_full 'The Canadian Mineralogist' _journal_volume 39 _journal_year 2001 _journal_page_first 197 _journal_page_last 206 _publ_section_title ; Crystal chemistry of uranyl molybdates. III. New structural themes in Na6[(UO2)2O(MoO4)4], Na6[(UO2)(MoO4)4] and K6[(UO2)2O(MoO4)4] ; _database_code_amcsd 0005714 _chemical_formula_sum 'U Mo4 Na6 O18' _cell_length_a 7.0958 _cell_length_b 9.566 _cell_length_c 13.415 _cell_angle_alpha 73.692 _cell_angle_beta 86.621 _cell_angle_gamma 82.940 _cell_volume 867.041 _exptl_crystal_density_diffrn 4.013 _symmetry_space_group_name_H-M 'P -1' loop_ _space_group_symop_operation_xyz 'x,y,z' '-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 U 0.07313 0.81676 0.32694 0.01380 Mo(1) 0.52738 0.49016 0.67448 0.01790 Mo(2) 0.23814 0.90941 0.56699 0.01800 Mo(3) -0.34364 0.98742 0.15007 0.01860 Mo(4) -0.07375 0.37198 0.90483 0.02170 Na(1) 0.02390 0.58860 0.61290 0.03380 Na(2) 0.39590 0.24880 0.56160 0.02700 Na(3) -0.20800 0.31760 0.16050 0.03170 Na(4) -0.18780 0.96650 -0.07250 0.03860 Na(5) -0.27300 0.79150 0.72020 0.04030 Na(6) -0.57260 0.34040 0.96820 0.03950 O(1) 0.00250 0.64430 0.40510 0.02200 O(2) 0.11690 0.09190 0.54290 0.02000 O(3) 0.26810 0.84590 0.45370 0.02300 O(4) 0.13500 0.99460 0.25170 0.02300 O(5) -0.24300 0.88130 0.27300 0.02400 O(6) -0.27790 0.39820 0.98010 0.02600 O(7) 0.69180 0.61650 0.62000 0.02800 O(8) -0.08870 0.24490 0.82940 0.03200 O(9) 0.44370 0.51250 0.79430 0.03400 O(10) 0.63050 0.30510 0.68760 0.02600 O(11) 0.11380 0.30690 0.99050 0.03400 O(12) -0.03440 0.54270 0.81640 0.04400 O(13) -0.50860 0.13510 0.15840 0.03800 O(14) 0.33980 0.52120 0.59010 0.03000 O(15) -0.44960 0.87690 0.09190 0.03700 O(16) 0.11330 0.79190 0.66470 0.03200 O(17) -0.15890 0.06260 0.06990 0.03400 O(18) 0.46360 0.90670 0.61010 0.03900 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 U 0.01600 0.01450 0.01170 -0.00290 0.00010 -0.00470 Mo(1) 0.01490 0.02020 0.01940 0.00040 0.00020 -0.00810 Mo(2) 0.02360 0.01700 0.01410 0.00190 -0.00270 -0.00660 Mo(3) 0.01690 0.02310 0.01460 -0.00260 -0.00200 -0.00290 Mo(4) 0.02190 0.03220 0.01510 -0.01050 0.00320 -0.01090 Na(1) 0.02200 0.03100 0.05700 -0.00600 0.00300 -0.02600 Na(2) 0.02300 0.03700 0.02100 -0.00600 0.00400 -0.00900 Na(3) 0.04000 0.03300 0.02200 -0.00200 -0.00700 -0.00600 Na(4) 0.03300 0.05900 0.02200 -0.00900 -0.00100 -0.00500 Na(5) 0.02800 0.05100 0.05600 -0.00200 -0.00200 -0.03900 Na(6) 0.02700 0.04000 0.05000 -0.01300 -0.00500 -0.00500 O(1) 0.02800 0.01600 0.02400 -0.00800 0.00500 -0.00900 O(2) 0.02500 0.01400 0.01900 0.00100 0.00200 -0.00600 O(3) 0.02200 0.03300 0.01700 0.00100 -0.00300 -0.01300 O(4) 0.03300 0.01800 0.01900 -0.00800 0.00100 -0.00200 O(5) 0.01700 0.03400 0.01800 0.00200 -0.00400 -0.00200 O(6) 0.02500 0.03400 0.01800 -0.00500 0.00300 -0.00600 O(7) 0.02000 0.02200 0.04100 -0.00300 0.00200 -0.00700 O(8) 0.03700 0.04100 0.02500 -0.01000 0.00100 -0.02100 O(9) 0.03900 0.03500 0.02900 0.00500 0.00100 -0.01300 O(10) 0.02500 0.02300 0.03000 -0.00200 0.00200 -0.00700 O(11) 0.03100 0.04300 0.03400 -0.01000 -0.00100 -0.01900 O(12) 0.05700 0.05000 0.02700 -0.02400 0.01500 -0.01100 O(13) 0.04900 0.03600 0.02400 0.01100 0.00300 -0.00500 O(14) 0.02200 0.04300 0.02600 0.00200 -0.00300 -0.01300 O(15) 0.05400 0.03500 0.02300 -0.00800 -0.01700 -0.00400 O(16) 0.05700 0.01900 0.01900 -0.00500 0.00200 -0.00200 O(17) 0.02000 0.04200 0.02700 -0.00700 0.00000 0.01300 O(18) 0.03800 0.05200 0.03400 0.01100 -0.02000 -0.02600