Vesuvianite Groat L A, Hawthorne F C, Ercit T S The Canadian Mineralogist 30 (1992) 1065-1075 The role of fluorine in vesuvianite: A crystal-structure study Sample: V33 _database_code_amcsd 0005285 CELL PARAMETERS: 15.5380 15.5380 11.7860 90.000 90.000 90.000 SPACE GROUP: P4/nnc X-RAY WAVELENGTH: 1.541838 Cell Volume: 2845.488 Density (g/cm3): 3.608 MAX. ABS. INTENSITY / VOLUME**2: 8.475347062 RIR: 0.765 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 8.05 12.62 10.9870 1 1 0 4 9.42 12.97 9.3902 1 0 1 8 11.39 20.89 7.7690 2 0 0 4 14.80 7.11 5.9859 2 1 1 16 15.03 17.31 5.8930 0 0 2 2 16.13 3.95 5.4935 2 2 0 4 17.07 6.15 5.1932 1 1 2 8 18.05 17.79 4.9135 3 1 0 8 18.90 3.51 4.6951 2 0 2 8 19.75 2.38 4.4944 2 1 2 16 21.96 6.42 4.0474 3 2 1 16 22.12 21.03 4.0183 2 2 2 8 23.36 1.54 3.8088 1 0 3 8 23.57 4.12 3.7738 3 1 2 16 25.61 1.41 3.4786 3 2 2 16 25.64 31.57 3.4744 4 2 0 8 26.06 3.29 3.4199 2 1 3 16 27.50 14.89 3.2433 4 0 2 8 28.52 1.75 3.1301 3 0 3 8 29.10 5.12 3.0684 3 1 3 16 29.31 1.73 3.0473 5 1 0 8 29.73 13.12 3.0049 4 3 1 16 29.85 3.96 2.9929 4 2 2 16 30.33 61.42 2.9465 0 0 4 2 30.80 12.37 2.9033 3 2 3 16 31.43 7.90 2.8459 1 1 4 8 31.93 1.48 2.8026 5 2 1 16 32.57 100.00 2.7488 4 3 2 16 32.60 47.31 2.7468 4 4 0 4 32.93 1.03 2.7196 4 1 3 16 34.46 2.27 2.6026 4 2 3 16 34.54 26.35 2.5966 2 2 4 8 34.61 64.51 2.5914 5 2 2 16 34.64 1.70 2.5897 6 0 0 4 35.53 12.70 2.5270 3 1 4 16 36.58 71.21 2.4568 6 2 0 8 36.88 13.97 2.4373 5 0 3 8 36.88 1.51 2.4373 4 3 3 16 36.96 1.90 2.4323 3 2 4 16 37.35 1.23 2.4078 5 1 3 16 37.95 6.90 2.3708 6 0 2 8 38.34 6.07 2.3476 4 0 4 8 38.41 3.75 2.3437 6 1 2 16 38.63 4.19 2.3305 1 0 5 8 38.72 7.81 2.3255 5 2 3 16 38.79 7.46 2.3212 4 1 4 16 39.24 8.74 2.2957 3 3 4 8 39.66 2.42 2.2728 6 3 1 16 40.13 3.77 2.2472 4 2 4 16 40.41 5.40 2.2323 2 1 5 16 40.92 4.48 2.2053 5 3 3 16 41.08 15.61 2.1974 7 1 0 8 41.39 5.75 2.1814 7 0 1 8 41.82 5.58 2.1602 7 1 1 16 42.12 1.29 2.1455 3 0 5 8 42.20 4.93 2.1415 6 1 3 16 42.27 2.43 2.1382 4 3 4 16 42.54 14.12 2.1253 3 1 5 16 42.66 10.44 2.1196 6 4 1 16 43.07 1.78 2.1002 7 2 1 16 43.44 7.42 2.0830 6 2 3 16 43.85 1.25 2.0645 5 4 3 16 43.92 1.59 2.0615 5 2 4 16 43.98 5.60 2.0589 7 1 2 16 44.40 16.23 2.0402 7 3 0 8 44.78 3.59 2.0237 6 4 2 16 45.10 5.80 2.0103 7 3 1 16 45.46 6.23 1.9953 6 3 3 16 45.92 2.54 1.9764 5 3 4 16 46.28 8.64 1.9617 6 5 1 16 47.08 1.77 1.9301 6 1 4 16 47.14 3.72 1.9280 7 3 2 16 47.40 4.83 1.9178 7 1 3 16 47.76 5.74 1.9044 2 0 6 8 47.82 1.16 1.9020 8 1 1 16 47.82 1.09 1.9020 7 4 1 16 48.14 2.40 1.8903 2 1 6 16 48.23 4.67 1.8869 6 2 4 16 48.28 1.14 1.8849 6 5 2 16 48.30 10.28 1.8843 8 2 0 8 48.47 1.12 1.8780 4 3 5 16 48.47 3.51 1.8780 5 0 5 8 48.54 1.12 1.8754 7 2 3 16 48.85 3.17 1.8645 5 1 5 16 50.53 2.56 1.8063 7 5 0 8 50.88 1.12 1.7947 8 2 2 16 51.91 16.71 1.7615 7 1 4 16 51.91 2.22 1.7615 5 5 4 8 52.32 1.82 1.7487 6 6 2 8 52.69 1.33 1.7372 8 4 0 8 52.92 1.24 1.7303 8 1 3 16 53.40 1.45 1.7159 9 1 0 8 53.90 1.53 1.7009 6 2 5 16 54.72 15.82 1.6774 7 3 4 16 55.12 5.17 1.6663 8 4 2 16 55.33 24.44 1.6604 4 3 6 16 56.41 1.12 1.6312 8 5 1 16 56.69 22.62 1.6238 5 2 6 16 56.75 1.53 1.6223 9 3 1 16 56.77 7.18 1.6216 8 0 4 8 56.82 30.84 1.6204 9 2 2 16 58.11 1.94 1.5874 8 2 4 16 58.83 5.25 1.5696 7 7 0 4 59.02 1.45 1.5650 6 0 6 8 59.35 9.23 1.5572 6 1 6 16 59.43 8.25 1.5553 6 6 4 8 59.49 2.15 1.5538 8 6 0 8 59.70 2.18 1.5488 7 6 3 16 59.70 1.32 1.5488 9 2 3 16 59.97 1.49 1.5427 7 3 5 16 60.08 5.51 1.5399 7 5 4 16 60.33 1.68 1.5342 6 2 6 16 60.38 2.78 1.5330 10 1 1 16 60.79 9.60 1.5236 10 2 0 8 60.94 1.38 1.5203 6 5 5 16 61.00 1.77 1.5189 8 5 3 16 61.44 6.53 1.5092 9 5 0 8 61.94 2.88 1.4981 6 3 6 16 62.02 6.54 1.4965 8 4 4 16 62.06 2.99 1.4955 10 1 2 16 63.02 1.77 1.4751 10 2 2 16 63.10 5.19 1.4733 0 0 8 2 63.60 1.65 1.4629 7 6 4 16 64.15 1.77 1.4516 6 4 6 16 64.60 1.20 1.4427 10 4 0 8 64.80 1.70 1.4387 10 1 3 16 65.73 1.92 1.4205 10 2 3 16 66.46 2.44 1.4067 11 1 0 8 67.63 8.60 1.3853 7 7 4 8 68.24 2.55 1.3744 8 6 4 16 68.30 3.43 1.3734 8 8 0 4 68.43 1.26 1.3710 9 2 5 16 68.49 3.19 1.3699 8 7 3 16 68.90 1.79 1.3628 11 3 0 8 69.49 1.11 1.3527 10 5 2 16 69.49 1.25 1.3527 11 2 2 16 69.70 1.06 1.3491 9 6 3 16 70.05 13.67 1.3432 9 5 4 16 70.45 1.31 1.3365 7 1 7 16 70.71 2.46 1.3324 10 6 0 8 71.07 2.66 1.3264 5 1 8 16 72.85 5.34 1.2983 4 4 8 8 73.02 1.86 1.2957 10 4 4 16 73.07 6.93 1.2950 11 4 2 16 74.13 8.08 1.2791 9 2 6 16 74.78 4.22 1.2695 11 1 4 16 75.20 5.79 1.2635 6 2 8 16 75.30 1.17 1.2621 8 5 6 16 75.41 2.23 1.2605 12 1 2 16 77.59 1.02 1.2305 10 4 5 16 77.74 2.31 1.2284 12 4 0 8 78.25 3.31 1.2218 12 4 1 16 79.41 1.52 1.2068 4 3 9 16 82.31 1.44 1.1714 12 5 2 16 83.47 1.22 1.1581 12 6 0 8 85.21 1.54 1.1388 10 1 7 16 86.24 1.09 1.1278 9 9 4 8 87.21 1.65 1.1178 9 1 8 16 87.99 2.19 1.1099 14 0 0 4 88.50 2.95 1.1048 11 7 4 16 88.50 2.86 1.1048 13 1 4 16 88.78 4.74 1.1020 4 3 10 16 89.00 4.67 1.0999 11 4 6 16 89.12 1.81 1.0987 14 2 0 8 89.47 1.42 1.0953 9 3 8 16 89.91 3.82 1.0911 5 2 10 16 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.