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 #1 from Sauland
_database_code_amcsd 0001537
CELL PARAMETERS: 15.5170 15.5170 11.7810 90.000 90.000 90.000
SPACE GROUP: P4/nnc
X-RAY WAVELENGTH: 1.541838
Cell Volume: 2836.597
Density (g/cm3): 3.391
MAX. ABS. INTENSITY / VOLUME**2: 8.444512181
RIR: 0.811
RIR based on corundum from Acta Crystallographica A38 (1982) 733-739
2-THETA INTENSITY D-SPACING H K L Multiplicity
8.06 6.55 10.9722 1 1 0 4
9.43 2.59 9.3831 1 0 1 8
15.04 10.92 5.8905 0 0 2 2
16.16 1.89 5.4861 2 2 0 4
17.08 1.97 5.1899 1 1 2 8
18.92 5.98 4.6915 2 0 2 8
21.99 2.17 4.0424 3 2 1 16
22.14 12.12 4.0146 2 2 2 8
22.93 2.40 3.8793 4 0 0 4
25.64 2.45 3.4750 3 2 2 16
25.67 11.69 3.4697 4 2 0 8
27.53 8.86 3.2398 4 0 2 8
28.14 1.10 3.1714 4 1 2 16
29.13 5.63 3.0660 3 1 3 16
29.35 11.60 3.0431 5 1 0 8
29.77 8.51 3.0010 4 3 1 16
29.89 5.95 2.9896 4 2 2 16
30.35 53.66 2.9453 0 0 4 2
30.82 5.17 2.9008 3 2 3 16
31.45 5.02 2.8446 1 1 4 8
32.61 100.00 2.7457 4 3 2 16
32.65 27.31 2.7430 4 4 0 4
33.68 3.41 2.6611 5 3 0 8
34.49 2.31 2.6002 4 2 3 16
34.57 31.33 2.5949 2 2 4 8
34.66 56.53 2.5884 5 2 2 16
35.55 5.85 2.5253 3 1 4 16
36.02 1.68 2.4932 6 1 1 16
36.63 46.24 2.4535 6 2 0 8
36.92 9.20 2.4349 5 0 3 8
36.98 1.87 2.4306 3 2 4 16
37.39 1.41 2.4054 5 1 3 16
37.90 2.03 2.3737 5 4 1 16
38.00 5.62 2.3680 6 0 2 8
38.37 6.55 2.3458 4 0 4 8
38.46 2.35 2.3409 6 1 2 16
38.65 2.73 2.3295 1 0 5 8
38.76 3.76 2.3231 5 2 3 16
38.83 7.44 2.3194 4 1 4 16
39.28 6.64 2.2939 3 3 4 8
39.71 3.97 2.2698 6 3 1 16
40.43 3.27 2.2311 2 1 5 16
40.97 4.32 2.2030 5 3 3 16
41.13 8.59 2.1944 7 1 0 8
41.45 4.03 2.1785 7 0 1 8
41.87 5.83 2.1573 7 1 1 16
42.14 1.82 2.1442 3 0 5 8
42.25 2.09 2.1392 6 1 3 16
42.31 2.42 2.1363 4 3 4 16
42.56 13.20 2.1240 3 1 5 16
42.72 9.94 2.1168 6 4 1 16
43.49 7.11 2.0807 6 2 3 16
43.90 3.40 2.0623 5 4 3 16
43.96 1.70 2.0597 5 2 4 16
44.04 3.59 2.0564 7 1 2 16
44.47 7.85 2.0375 7 3 0 8
44.84 4.52 2.0212 6 4 2 16
45.16 5.25 2.0077 7 3 1 16
45.51 9.89 1.9931 6 3 3 16
45.96 1.34 1.9745 5 3 4 16
46.35 5.70 1.9591 6 5 1 16
47.13 1.76 1.9283 6 1 4 16
47.20 2.23 1.9255 7 3 2 16
47.46 5.03 1.9156 7 1 3 16
47.78 4.91 1.9035 2 0 6 8
47.89 1.94 1.8995 7 4 1 16
48.16 1.86 1.8893 2 1 6 16
48.28 2.96 1.8851 6 2 4 16
48.37 5.83 1.8817 8 2 0 8
48.51 2.45 1.8766 5 0 5 8
48.51 1.94 1.8766 4 3 5 16
48.89 2.87 1.8630 5 1 5 16
50.95 1.48 1.7925 8 2 2 16
51.97 14.09 1.7597 7 1 4 16
51.97 1.40 1.7597 5 5 4 8
52.39 1.08 1.7465 6 6 2 8
53.47 3.31 1.7136 9 1 0 8
53.95 1.52 1.6994 6 2 5 16
54.78 11.11 1.6756 7 3 4 16
55.19 3.48 1.6642 8 4 2 16
55.37 23.05 1.6593 4 3 6 16
56.73 19.78 1.6226 5 2 6 16
56.83 1.65 1.6201 9 3 1 16
56.84 8.39 1.6199 8 0 4 8
56.90 27.25 1.6183 9 2 2 16
58.92 6.72 1.5675 7 7 0 4
59.07 1.09 1.5638 6 0 6 8
59.40 7.92 1.5560 6 1 6 16
59.50 8.79 1.5536 6 6 4 8
59.78 1.02 1.5470 7 6 3 16
60.03 1.29 1.5412 7 3 5 16
60.15 3.59 1.5382 7 5 4 16
60.38 1.70 1.5330 6 2 6 16
60.47 1.75 1.5309 10 1 1 16
60.88 5.62 1.5216 10 2 0 8
61.53 3.66 1.5071 9 5 0 8
62.00 2.37 1.4969 6 3 6 16
62.09 6.47 1.4948 8 4 4 16
62.15 2.48 1.4935 10 1 2 16
63.04 1.28 1.4746 10 3 1 16
63.13 4.60 1.4726 0 0 8 2
63.68 1.56 1.4613 7 6 4 16
64.22 1.29 1.4504 6 4 6 16
65.83 1.85 1.4188 10 2 3 16
67.72 8.44 1.3837 7 7 4 8
68.33 1.48 1.3728 8 6 4 16
68.40 1.93 1.3715 8 8 0 4
68.59 1.96 1.3682 8 7 3 16
69.01 2.85 1.3609 11 3 0 8
69.59 1.23 1.3509 11 2 2 16
70.14 11.03 1.3417 9 5 4 16
70.52 1.33 1.3355 7 1 7 16
70.82 1.18 1.3306 10 6 0 8
71.12 2.44 1.3256 5 1 8 16
72.91 4.74 1.2975 4 4 8 8
73.12 1.02 1.2942 10 4 4 16
73.18 6.08 1.2934 11 4 2 16
74.21 6.96 1.2779 9 2 6 16
74.89 2.87 1.2680 11 1 4 16
75.26 5.19 1.2626 6 2 8 16
75.38 1.14 1.2609 8 5 6 16
75.53 2.13 1.2588 12 1 2 16
77.87 1.09 1.2267 12 4 0 8
78.37 3.13 1.2201 12 4 1 16
79.46 1.38 1.2061 4 3 9 16
80.28 1.22 1.1958 10 5 5 16
82.45 1.14 1.1698 12 5 2 16
85.31 1.43 1.1377 10 1 7 16
87.30 1.37 1.1169 9 1 8 16
88.14 1.33 1.1084 14 0 0 4
88.64 2.10 1.1034 11 7 4 16
88.64 2.06 1.1034 13 1 4 16
88.84 4.14 1.1014 4 3 10 16
89.12 3.96 1.0987 11 4 6 16
89.56 1.19 1.0944 9 3 8 16
89.98 3.13 1.0905 5 2 10 16
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XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs
For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.