Na3Tl3[(UO2)(MoO4)4] Krivovichev S V, Burns P C The Canadian Mineralogist 41 (2003) 707-719 Crystal chemistry of uranyl molybdates. VIII. Crystal structures of Na3Tl3[(UO2)(MoO4)4], Na13-xTl3+x[(UO2)(MoO4)3]4(H2O)6+x (x=0.1), Na3Tl5[(UO2)(MoO4)2]2(H2O)3 and Na2[(UO2)(MoO4)2](H2O)4 Sample 1 _database_code_amcsd 0005855 CELL PARAMETERS: 20.5823 7.4391 26.2514 90.000 90.000 90.000 SPACE GROUP: Pbcn X-RAY WAVELENGTH: 1.541838 Cell Volume: 4019.451 Density (g/cm3): 5.260 MAX. ABS. INTENSITY / VOLUME**2: 48.76750405 RIR: 3.019 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 6.73 1.00 13.1257 0 0 2 2 7.99 23.11 11.0669 1 0 2 4 10.92 67.23 8.0987 2 0 2 4 12.65 47.01 6.9962 1 1 0 4 13.10 19.12 6.7602 1 1 1 8 13.49 2.05 6.5628 0 0 4 2 14.35 2.47 6.1739 1 1 2 8 14.57 1.43 6.0803 3 0 2 4 15.08 2.21 5.8759 2 1 1 8 16.02 2.43 5.5334 2 0 4 4 17.23 1.94 5.1456 4 0 0 2 17.59 4.67 5.0434 3 1 0 4 17.87 1.51 4.9646 2 1 3 8 17.91 39.96 4.9528 3 1 1 8 18.52 11.62 4.7906 4 0 2 4 18.54 16.17 4.7865 1 1 4 8 18.85 2.19 4.7078 3 1 2 8 20.32 14.53 4.3696 3 1 3 8 20.76 6.06 4.2796 1 0 6 4 21.16 3.02 4.1993 1 1 5 8 21.27 3.76 4.1779 4 1 1 8 21.95 3.76 4.0493 4 0 4 4 22.07 1.53 4.0277 4 1 2 8 22.08 30.37 4.0265 2 0 6 4 22.46 1.43 3.9594 2 1 5 8 22.64 12.21 3.9278 5 0 2 4 23.35 5.47 3.8097 4 1 3 8 23.92 3.48 3.7195 0 2 0 2 24.17 4.57 3.6828 0 2 1 4 24.47 8.46 3.6372 3 1 5 8 24.56 3.41 3.6252 1 2 1 8 24.88 19.10 3.5786 0 2 2 4 24.95 7.56 3.5684 5 1 1 8 25.46 7.84 3.4981 2 2 0 4 25.65 14.10 3.4734 5 1 2 8 25.69 11.44 3.4674 2 2 1 8 25.97 3.98 3.4304 6 0 0 2 26.03 31.58 3.4231 0 2 3 4 26.37 5.03 3.3801 2 2 2 8 26.39 1.35 3.3767 1 2 3 8 26.77 6.02 3.3307 5 1 3 8 26.86 4.30 3.3189 6 0 2 4 26.98 3.54 3.3053 1 1 7 8 27.06 6.18 3.2948 4 1 5 8 27.18 87.63 3.2814 0 0 8 2 27.46 53.07 3.2482 2 2 3 8 27.53 6.13 3.2405 1 0 8 4 27.56 3.79 3.2360 0 2 4 4 28.26 57.76 3.1575 5 1 4 8 28.92 9.03 3.0870 2 2 4 8 29.15 2.41 3.0630 3 2 3 8 29.38 100.00 3.0401 6 0 4 4 29.43 10.77 3.0351 0 2 5 4 29.64 2.16 3.0144 4 2 0 4 29.69 13.79 3.0094 3 1 7 8 29.75 6.49 3.0026 1 2 5 8 29.80 2.34 2.9981 5 0 6 4 29.83 20.16 2.9948 4 2 1 8 30.08 12.79 2.9709 1 1 8 8 30.09 9.29 2.9701 5 1 5 8 30.19 1.18 2.9603 3 0 8 4 30.42 3.41 2.9380 4 2 2 8 30.46 4.63 2.9347 6 1 3 8 30.71 32.83 2.9111 2 2 5 8 31.39 10.73 2.8501 4 2 3 8 31.57 10.59 2.8339 0 2 6 4 32.19 8.12 2.7808 5 1 6 8 32.25 1.05 2.7756 3 2 5 8 32.63 1.66 2.7447 5 2 1 8 32.69 4.94 2.7393 4 2 4 8 32.75 5.99 2.7345 7 1 0 4 32.78 1.92 2.7322 2 2 6 8 32.93 6.97 2.7198 7 1 1 8 33.19 3.23 2.6996 6 0 6 4 33.45 4.77 2.6791 6 1 5 8 33.47 2.34 2.6770 7 1 2 8 34.23 1.15 2.6194 1 2 7 8 34.30 4.66 2.6142 4 2 5 8 34.53 6.98 2.5977 5 1 7 8 35.08 1.07 2.5580 2 2 7 8 35.28 1.74 2.5437 2 0 10 4 35.37 1.20 2.5376 6 1 6 8 35.55 6.19 2.5250 3 1 9 8 35.56 1.53 2.5247 8 0 2 4 35.60 3.27 2.5217 6 2 0 4 35.77 6.24 2.5101 6 2 1 8 36.19 2.23 2.4823 4 2 6 8 36.28 11.43 2.4764 6 2 2 8 36.50 2.48 2.4619 1 3 0 4 36.52 1.46 2.4607 0 2 8 4 36.65 2.34 2.4518 3 0 10 4 37.13 2.74 2.4211 8 1 1 8 37.45 4.37 2.4016 4 1 9 8 37.46 3.17 2.4006 2 3 1 8 37.55 1.24 2.3953 8 0 4 4 37.58 3.35 2.3932 2 2 8 8 37.94 2.92 2.3712 6 0 8 4 38.24 4.76 2.3539 6 2 4 8 38.31 7.10 2.3495 4 2 7 8 38.50 3.75 2.3384 4 0 10 4 38.67 2.79 2.3286 3 1 10 8 38.77 7.38 2.3229 3 3 1 8 38.84 2.31 2.3188 7 1 6 8 38.88 4.43 2.3162 3 2 8 8 39.08 3.08 2.3051 1 3 4 8 39.21 2.94 2.2978 7 2 1 8 39.25 3.14 2.2953 0 2 9 4 39.50 2.04 2.2811 1 2 9 8 40.26 1.21 2.2402 2 2 9 8 40.44 1.15 2.2305 7 2 3 8 40.53 1.37 2.2258 4 3 1 8 40.64 1.76 2.2199 4 2 8 8 40.66 1.19 2.2190 2 1 11 8 40.77 2.65 2.2134 5 0 10 4 40.84 1.98 2.2095 7 1 7 8 41.32 4.27 2.1848 6 2 6 8 41.45 1.08 2.1784 9 1 1 8 41.73 1.06 2.1644 4 3 3 8 41.88 1.20 2.1572 3 1 11 8 42.13 3.29 2.1448 0 2 10 4 42.56 1.73 2.1241 5 3 0 4 42.62 2.43 2.1215 5 1 10 8 42.63 5.44 2.1208 9 1 3 8 42.71 4.19 2.1172 5 3 1 8 42.73 1.22 2.1159 8 2 0 4 42.82 1.14 2.1118 7 2 5 8 42.88 6.99 2.1091 8 2 1 8 43.06 7.12 2.1007 7 1 8 8 43.14 1.37 2.0968 5 3 2 8 43.16 7.58 2.0962 4 2 9 8 43.23 6.92 2.0926 6 2 7 8 43.31 1.36 2.0890 8 2 2 8 43.34 2.75 2.0879 1 1 12 8 43.54 1.68 2.0787 4 1 11 8 43.86 4.32 2.0641 5 3 3 8 43.99 1.26 2.0582 10 0 0 2 44.03 4.30 2.0567 8 2 3 8 44.25 1.76 2.0471 3 2 10 8 44.85 8.33 2.0209 5 3 4 8 44.92 1.95 2.0180 9 1 5 8 45.14 7.91 2.0086 0 2 11 4 45.23 1.60 2.0047 5 2 9 8 45.25 1.53 2.0038 6 3 1 8 45.36 2.31 1.9995 6 2 8 8 45.47 6.12 1.9949 7 1 9 8 45.82 3.08 1.9804 3 3 7 8 45.88 2.36 1.9781 10 1 1 8 46.04 7.93 1.9714 2 2 11 8 46.09 2.68 1.9693 1 3 8 8 46.10 4.28 1.9690 5 3 5 8 46.26 4.45 1.9625 8 2 5 8 46.29 1.75 1.9614 10 1 2 8 46.76 1.94 1.9428 9 2 1 8 46.83 1.98 1.9401 1 1 13 8 47.04 1.21 1.9318 5 0 12 4 47.37 1.02 1.9192 4 3 7 8 47.75 1.04 1.9049 8 2 6 8 48.02 2.04 1.8945 6 1 11 8 48.04 1.41 1.8937 7 1 10 8 48.13 4.15 1.8907 7 3 1 8 48.38 1.76 1.8813 1 3 9 8 48.56 1.67 1.8747 3 1 13 8 48.66 3.66 1.8711 4 2 11 8 48.70 10.50 1.8698 5 1 12 8 48.98 4.04 1.8598 0 4 0 2 49.09 1.05 1.8557 10 1 5 8 49.12 1.20 1.8548 2 2 12 8 49.19 1.37 1.8524 11 0 2 4 49.31 2.72 1.8482 5 3 7 8 49.40 2.97 1.8447 2 0 14 4 49.41 16.64 1.8445 6 0 12 4 49.46 3.96 1.8428 8 2 7 8 49.50 5.00 1.8414 0 4 2 4 49.61 1.53 1.8375 8 0 10 4 50.08 3.42 1.8215 3 3 9 8 50.16 3.06 1.8186 6 2 10 8 50.17 1.25 1.8182 3 2 12 8 50.28 4.28 1.8146 11 1 0 4 50.44 1.26 1.8093 7 2 9 8 50.52 1.10 1.8067 10 1 6 8 50.82 8.31 1.7967 10 2 1 8 51.04 8.73 1.7893 0 4 4 4 51.20 1.43 1.7842 10 2 2 8 51.23 1.34 1.7831 5 3 8 8 51.70 2.15 1.7681 1 2 13 8 51.86 3.62 1.7629 2 4 4 8 51.91 2.24 1.7614 5 1 13 8 52.11 1.34 1.7551 7 0 12 4 52.16 1.59 1.7535 10 1 7 8 52.30 1.62 1.7492 9 1 9 8 52.31 1.37 1.7490 11 1 4 8 52.31 6.42 1.7489 2 2 13 8 52.48 1.89 1.7436 10 0 8 4 53.24 1.60 1.7204 11 0 6 4 53.36 1.42 1.7171 5 3 9 8 53.42 1.92 1.7152 12 0 0 2 53.50 3.26 1.7127 8 2 9 8 53.54 4.17 1.7116 0 4 6 4 53.91 2.70 1.7007 12 0 2 4 54.22 2.91 1.6918 7 3 7 8 54.60 1.31 1.6809 5 4 2 8 54.71 1.53 1.6777 4 2 13 8 54.83 1.30 1.6744 0 2 14 4 55.06 2.60 1.6680 12 1 1 8 55.23 1.10 1.6632 5 1 14 8 55.36 2.37 1.6595 12 0 4 4 55.53 1.26 1.6549 6 3 9 8 55.58 1.80 1.6534 3 1 15 8 55.67 1.45 1.6509 9 3 3 8 56.03 1.14 1.6414 7 3 8 8 56.05 6.29 1.6407 0 0 16 2 56.25 1.79 1.6355 1 0 16 4 56.25 1.06 1.6353 1 3 12 8 56.27 9.00 1.6350 6 4 0 4 56.58 1.66 1.6266 3 2 14 8 56.70 5.24 1.6234 10 2 7 8 56.74 3.83 1.6224 6 4 2 8 56.91 4.88 1.6180 0 4 8 4 57.14 3.11 1.6119 9 1 11 8 57.57 1.41 1.6011 9 3 5 8 57.71 1.50 1.5974 1 1 16 8 57.73 1.62 1.5969 12 0 6 4 58.03 1.49 1.5894 7 3 9 8 58.09 5.36 1.5880 11 1 8 8 58.15 4.55 1.5865 6 4 4 8 58.28 1.02 1.5832 8 2 11 8 58.39 1.87 1.5804 5 4 6 8 58.65 1.53 1.5741 5 1 15 8 59.30 1.03 1.5584 10 3 3 8 59.45 1.62 1.5548 12 2 1 8 60.41 4.13 1.5324 10 2 9 8 60.45 2.26 1.5315 6 4 6 8 60.66 1.87 1.5266 12 1 7 8 60.78 3.12 1.5239 5 3 12 8 60.95 2.66 1.5201 12 0 8 4 61.06 2.32 1.5175 0 4 10 4 61.15 1.12 1.5155 12 2 4 8 61.24 1.35 1.5135 4 2 15 8 61.25 1.34 1.5134 1 4 10 8 62.15 1.54 1.4936 11 3 0 4 62.53 1.25 1.4853 13 1 5 8 63.15 1.05 1.4723 11 3 3 8 63.57 2.56 1.4635 5 3 13 8 63.58 9.30 1.4634 6 4 8 8 63.92 1.66 1.4564 11 3 4 8 64.23 1.08 1.4501 12 1 9 8 64.82 1.60 1.4384 12 2 7 8 64.85 2.05 1.4378 6 2 15 8 64.95 1.66 1.4359 12 0 10 4 65.02 1.09 1.4344 3 5 3 8 65.92 2.61 1.4169 0 4 12 4 66.45 1.12 1.4069 7 1 16 8 66.63 1.22 1.4037 2 4 12 8 67.22 1.52 1.3926 12 3 3 8 67.49 1.99 1.3878 6 4 10 8 68.24 1.23 1.3744 4 2 17 8 68.35 1.50 1.3723 10 4 2 8 68.57 3.88 1.3685 5 5 4 8 68.75 1.31 1.3654 14 2 1 8 68.93 1.48 1.3623 12 3 5 8 69.10 1.87 1.3594 11 3 8 8 69.66 1.11 1.3498 12 0 12 4 69.97 1.70 1.3446 7 1 17 8 71.44 1.46 1.3204 0 4 14 4 72.12 1.94 1.3096 6 4 12 8 73.06 1.94 1.2952 0 2 19 4 73.27 1.13 1.2920 9 3 13 8 73.67 1.32 1.2859 7 3 15 8 73.73 1.15 1.2850 2 2 19 8 73.76 1.02 1.2845 14 2 7 8 75.79 1.31 1.2551 10 2 15 8 77.01 6.09 1.2382 12 4 4 8 77.38 1.51 1.2332 5 1 20 8 77.60 1.53 1.2304 0 4 16 4 77.71 1.04 1.2288 13 1 13 8 77.93 2.02 1.2259 6 0 20 4 78.46 1.33 1.2189 2 6 3 8 78.61 1.27 1.2170 11 1 16 8 80.07 1.07 1.1985 2 6 5 8 81.69 1.90 1.1787 5 5 12 8 81.82 1.13 1.1772 2 2 21 8 83.47 2.20 1.1581 6 4 16 8 89.25 1.07 1.0975 11 5 8 8 89.77 2.79 1.0924 12 4 12 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.