F6 U Levy J, Taylor J, Wilson P Journal of the Chemical Society, Dalton Transactions, Inorganic Chemistry 1976 (1976) 219-224 Structure of fluorides. Part XII. single-crystal neutron diffraction study of uranium hexafluoride at 293 K _cod_database_code 1008004 _database_code_amcsd 0015952 CELL PARAMETERS: 9.9000 8.9620 5.2070 90.000 90.000 90.000 SPACE GROUP: Pnma X-RAY WAVELENGTH: 1.541838 Cell Volume: 461.985 Density (g/cm3): 5.060 MAX. ABS. INTENSITY / VOLUME**2: 135.8646713 RIR: 8.742 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 19.26 42.81 4.6084 1 0 1 4 19.72 25.75 4.5022 0 1 1 4 19.81 54.56 4.4810 0 2 0 2 20.50 100.00 4.3330 2 1 0 4 21.68 69.71 4.0983 1 1 1 8 24.82 14.07 3.5876 2 0 1 4 27.77 31.53 3.2127 1 2 1 8 31.96 12.43 2.8006 2 2 1 8 32.11 12.65 2.7874 3 0 1 4 33.67 15.51 2.6616 3 1 1 8 34.45 1.85 2.6035 0 0 2 2 34.62 3.00 2.5912 0 3 1 4 35.09 21.52 2.5577 2 3 0 4 35.66 3.16 2.5179 1 0 2 4 35.82 7.35 2.5067 1 3 1 8 36.30 2.38 2.4750 4 0 0 2 37.09 12.49 2.4240 1 1 2 8 38.02 15.43 2.3668 3 2 1 8 39.09 2.63 2.3042 2 0 2 4 39.24 5.58 2.2957 2 3 1 8 40.05 3.78 2.2511 0 2 2 4 40.25 6.53 2.2405 0 4 0 2 40.42 7.84 2.2316 2 1 2 8 41.12 9.61 2.1951 1 2 2 8 41.64 5.77 2.1689 4 1 1 8 41.69 12.41 2.1665 4 2 0 4 44.32 6.61 2.0440 3 0 2 4 44.45 13.43 2.0380 3 3 1 8 44.99 7.76 2.0150 1 4 1 8 45.52 8.54 1.9928 3 1 2 8 47.21 5.35 1.9252 1 3 2 8 47.87 3.63 1.9004 2 4 1 8 48.98 5.26 1.8596 3 2 2 8 49.23 1.91 1.8507 5 0 1 4 49.99 4.58 1.8245 2 3 2 8 50.34 6.90 1.8125 5 1 1 8 50.91 3.05 1.7938 4 0 2 4 51.03 4.78 1.7898 4 3 1 8 52.39 5.64 1.7463 3 4 1 8 53.57 3.51 1.7106 5 2 1 8 53.80 5.63 1.7040 0 1 3 4 54.00 1.63 1.6982 0 4 2 4 54.11 1.28 1.6948 0 5 1 4 54.39 5.62 1.6869 3 3 2 8 54.44 6.02 1.6853 2 5 0 4 54.85 4.38 1.6738 1 4 2 8 54.97 4.11 1.6705 1 5 1 8 55.15 3.61 1.6653 4 2 2 8 55.31 6.11 1.6610 4 4 0 4 56.16 4.92 1.6379 2 0 3 4 56.73 3.90 1.6227 6 1 0 4 58.57 3.38 1.5760 5 0 2 4 58.68 7.05 1.5733 5 3 1 8 59.56 2.40 1.5522 5 1 2 8 60.15 8.59 1.5384 2 2 3 8 61.40 2.09 1.5100 3 4 2 8 61.51 2.72 1.5076 3 5 1 8 61.82 7.42 1.5007 0 3 3 4 62.15 3.66 1.4937 0 6 0 2 62.47 3.65 1.4867 5 2 2 8 62.59 1.96 1.4841 6 2 1 8 63.73 2.12 1.4602 1 5 2 8 64.52 3.52 1.4443 6 3 0 4 65.41 1.82 1.4269 5 4 1 8 65.72 2.35 1.4209 1 6 1 8 66.04 1.62 1.4148 2 5 2 8 66.63 5.94 1.4035 4 1 3 8 66.81 1.71 1.4003 4 4 2 8 66.91 1.36 1.3984 4 5 1 8 67.15 1.56 1.3939 5 3 2 8 67.98 1.28 1.3789 2 6 1 8 68.08 1.85 1.3771 6 1 2 8 68.78 1.34 1.3648 7 0 1 4 69.69 1.18 1.3493 7 1 1 8 69.79 2.08 1.3476 3 5 2 8 71.33 4.83 1.3223 2 4 3 8 71.69 1.95 1.3166 3 6 1 8 72.38 2.44 1.3056 7 2 1 8 73.46 1.88 1.2890 5 4 2 8 73.56 2.15 1.2875 5 5 1 8 73.57 1.19 1.2874 6 4 1 8 73.85 1.57 1.2833 4 3 3 8 74.24 1.57 1.2775 1 1 4 8 76.38 2.06 1.2469 0 5 3 4 76.87 1.66 1.2402 1 2 4 8 76.92 1.90 1.2395 2 7 0 4 77.07 1.52 1.2375 8 0 0 2 77.36 1.62 1.2336 1 7 1 8 77.55 1.77 1.2310 7 1 2 8 78.85 1.41 1.2140 6 5 0 4 79.47 1.58 1.2060 3 6 2 8 79.94 1.41 1.2000 3 1 4 8 80.28 1.67 1.1959 6 0 3 4 80.52 1.54 1.1928 8 2 0 4 81.19 1.44 1.1848 1 3 4 8 82.81 1.60 1.1656 7 4 1 8 83.71 2.27 1.1554 6 2 3 8 84.39 1.01 1.1478 4 6 2 8 84.42 1.13 1.1474 7 3 2 8 87.15 1.26 1.1184 1 4 4 8 87.63 2.04 1.1135 4 5 3 8 88.62 2.21 1.1037 2 6 3 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.