Vesuvianite Ohkawa M, Yoshiasa A, Takeno S American Mineralogist 77 (1992) 945-953 Crystal chemistry of vesuvianite: Site preferences of square-pyramidal coordinated sites sample #4 from Chichibu _database_code_amcsd 0001540 CELL PARAMETERS: 15.5460 15.5460 11.8280 90.000 90.000 90.000 SPACE GROUP: P4/nnc X-RAY WAVELENGTH: 1.541838 Cell Volume: 2858.569 Density (g/cm3): 3.351 MAX. ABS. INTENSITY / VOLUME**2: 8.059536018 RIR: 0.783 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 8.04 9.03 10.9927 1 1 0 4 9.40 3.22 9.4132 1 0 1 8 14.98 12.88 5.9140 0 0 2 2 16.13 2.35 5.4963 2 2 0 4 17.02 2.20 5.2081 1 1 2 8 18.85 6.04 4.7066 2 0 2 8 21.94 2.10 4.0509 3 2 1 16 22.08 12.18 4.0261 2 2 2 8 22.88 3.09 3.8865 4 0 0 4 25.57 2.35 3.4840 3 2 2 16 25.63 11.04 3.4762 4 2 0 8 27.46 8.84 3.2479 4 0 2 8 28.07 1.54 3.1793 4 1 2 16 29.03 6.72 3.0757 3 1 3 16 29.29 12.96 3.0488 5 1 0 8 29.71 9.13 3.0070 4 3 1 16 29.81 6.86 2.9968 4 2 2 16 30.22 52.52 2.9570 0 0 4 2 30.27 1.10 2.9523 5 1 1 16 30.73 5.51 2.9096 3 2 3 16 31.33 3.57 2.8555 1 1 4 8 32.39 1.12 2.7638 2 0 4 8 32.54 100.00 2.7520 4 3 2 16 32.58 27.90 2.7482 4 4 0 4 33.61 4.50 2.6661 5 3 0 8 34.39 2.76 2.6074 4 2 3 16 34.44 35.87 2.6041 2 2 4 8 34.57 63.37 2.5942 5 2 2 16 35.42 5.41 2.5339 3 1 4 16 35.95 2.29 2.4981 6 1 1 16 36.56 45.92 2.4580 6 2 0 8 36.81 8.25 2.4414 5 0 3 8 36.86 1.81 2.4386 3 2 4 16 37.28 1.27 2.4118 5 1 3 16 37.83 1.73 2.3783 5 4 1 16 37.91 5.62 2.3732 6 0 2 8 38.25 8.65 2.3533 4 0 4 8 38.37 2.39 2.3460 6 1 2 16 38.49 1.81 2.3387 1 0 5 8 38.66 3.12 2.3292 5 2 3 16 38.70 8.26 2.3268 4 1 4 16 39.15 5.54 2.3012 3 3 4 8 39.63 3.72 2.2742 6 3 1 16 40.27 3.16 2.2395 2 1 5 16 40.86 3.99 2.2086 5 3 3 16 41.05 7.69 2.1985 7 1 0 8 41.37 4.06 2.1827 7 0 1 8 41.79 5.82 2.1615 7 1 1 16 41.98 1.82 2.1520 3 0 5 8 42.14 1.23 2.1446 6 1 3 16 42.17 2.86 2.1427 4 3 4 16 42.40 13.86 2.1316 3 1 5 16 42.63 9.36 2.1209 6 4 1 16 43.38 7.71 2.0859 6 2 3 16 43.79 4.07 2.0673 5 4 3 16 43.83 2.22 2.0657 5 2 4 16 43.94 3.55 2.0607 7 1 2 16 44.38 8.21 2.0413 7 3 0 8 44.74 4.79 2.0255 6 4 2 16 45.07 5.51 2.0116 7 3 1 16 45.14 1.06 2.0085 7 2 2 16 45.40 11.17 1.9979 6 3 3 16 46.25 5.45 1.9629 6 5 1 16 46.99 1.84 1.9336 6 1 4 16 47.10 2.51 1.9296 7 3 2 16 47.34 5.27 1.9202 7 1 3 16 47.59 4.06 1.9108 2 0 6 8 47.79 2.31 1.9031 7 4 1 16 47.97 1.93 1.8966 2 1 6 16 48.14 2.55 1.8902 6 2 4 16 48.27 5.78 1.8852 8 2 0 8 48.35 2.31 1.8826 5 0 5 8 48.35 2.41 1.8826 4 3 5 16 48.72 3.31 1.8690 5 1 5 16 49.84 1.50 1.8297 3 1 6 16 50.83 1.51 1.7962 8 2 2 16 51.13 1.19 1.7865 7 5 1 16 51.82 12.66 1.7643 7 1 4 16 51.82 1.36 1.7643 5 5 4 8 52.02 1.34 1.7581 4 0 6 8 52.53 1.30 1.7420 6 4 4 16 53.37 3.50 1.7168 9 1 0 8 53.78 1.48 1.7045 6 2 5 16 54.63 10.77 1.6799 7 3 4 16 54.64 1.07 1.6798 1 0 7 8 55.07 3.55 1.6676 8 4 2 16 55.17 23.00 1.6649 4 3 6 16 55.51 1.06 1.6554 5 1 6 16 56.53 20.60 1.6280 5 2 6 16 56.68 9.08 1.6240 8 0 4 8 56.71 1.78 1.6232 9 3 1 16 56.77 28.96 1.6216 9 2 2 16 58.20 1.35 1.5851 5 3 6 16 58.80 6.92 1.5704 7 7 0 4 59.19 8.82 1.5609 6 1 6 16 59.34 9.39 1.5574 6 6 4 8 59.85 1.16 1.5455 7 3 5 16 59.99 3.52 1.5420 7 5 4 16 60.17 2.37 1.5379 6 2 6 16 60.35 1.64 1.5338 10 1 1 16 60.76 5.73 1.5244 10 2 0 8 61.40 3.71 1.5100 9 5 0 8 61.78 2.72 1.5016 6 3 6 16 61.93 7.30 1.4984 8 4 4 16 62.01 2.94 1.4965 10 1 2 16 62.56 1.22 1.4847 9 1 4 16 62.86 4.57 1.4785 0 0 8 2 62.91 1.23 1.4774 10 3 1 16 62.97 1.11 1.4762 10 2 2 16 63.51 1.66 1.4648 7 6 4 16 65.67 1.75 1.4218 10 2 3 16 67.54 9.07 1.3869 7 7 4 8 68.15 1.16 1.3760 8 6 4 16 68.26 1.96 1.3741 8 8 0 4 68.42 1.80 1.3712 8 7 3 16 68.86 2.87 1.3635 11 3 0 8 69.44 1.23 1.3536 11 2 2 16 69.96 10.55 1.3448 9 5 4 16 70.26 1.28 1.3397 7 1 7 16 70.66 1.11 1.3331 10 6 0 8 70.83 2.12 1.3303 5 1 8 16 70.86 1.03 1.3299 6 4 7 16 72.61 5.16 1.3020 4 4 8 8 72.80 1.08 1.2992 8 6 5 16 73.01 6.81 1.2959 11 4 2 16 73.97 7.17 1.2814 9 2 6 16 74.69 2.41 1.2709 11 1 4 16 74.96 5.93 1.2670 6 2 8 16 75.35 1.91 1.2613 12 1 2 16 75.57 1.22 1.2583 8 2 7 16 77.70 1.21 1.2290 12 4 0 8 78.19 3.26 1.2224 12 4 1 16 79.11 1.62 1.2105 4 3 9 16 80.05 1.38 1.1987 10 5 5 16 82.25 1.05 1.1721 12 5 2 16 85.01 1.48 1.1410 10 1 7 16 86.96 1.22 1.1203 9 1 8 16 87.94 1.34 1.1104 14 0 0 4 88.40 2.05 1.1058 13 1 4 16 88.40 2.08 1.1058 11 7 4 16 88.43 4.00 1.1055 4 3 10 16 88.83 4.09 1.1015 11 4 6 16 89.22 1.12 1.0977 9 3 8 16 89.56 3.13 1.0945 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.