Stibivanite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R080125 Szymanski J T The Canadian Mineralogist 18 (1980) 333-337 A redetermination of the structure of Sb2VO5, stibivanite, a new mineral CELL PARAMETERS: 17.9900 4.7770 5.4980 90.000 95.210 90.000 SPACE GROUP: C2/c ATOM X Y Z OCCUPANCY ISO(B) Sb 0.16126 0.72028 0.15140 1.000 1.077 V 0.00000 0.37157 0.25000 1.000 1.103 O 0.00000 0.04120 0.25000 1.000 1.898 O 0.07170 0.49560 0.02200 1.000 1.078 O 0.20620 0.41420 0.35120 1.000 1.287 X-RAY WAVELENGTHS: 1.540562 1.544390 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 16 +/- 4 +/- 5 MAX. ABS. INTENSITY / VOLUME**2: 57.74833664 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 9.87 / 9.89 20.43 / 10.21 8.9578 2 0 0 19.21 / 19.26 35.39 / 17.70 4.6157 1 1 0 19.81 / 19.86 11.34 / 5.67 4.4789 4 0 0 23.83 / 23.89 4.97 / 2.49 3.7304 3 1 0 24.92 / 24.98 13.09 / 6.54 3.5705 -1 1 1 25.51 / 25.57 83.57 / 41.78 3.4891 1 1 1 28.15 / 28.22 100.00 / 50.00 3.1676 -3 1 1 29.71 / 29.78 77.68 / 38.84 3.0046 3 1 1 29.90 / 29.98 61.65 / 30.83 2.9859 6 0 0 31.18 / 31.26 2.48 / 1.24 2.8664 5 1 0 32.68 / 32.77 9.57 / 4.79 2.7376 0 0 2 33.31 / 33.40 22.12 / 11.06 2.6872 -2 0 2 34.21 / 34.30 22.13 / 11.07 2.6188 -5 1 1 35.11 / 35.20 20.49 / 10.24 2.5541 2 0 2 36.39 / 36.48 12.20 / 6.10 2.4669 5 1 1 36.86 / 36.96 13.44 / 6.72 2.4364 -4 0 2 37.63 / 37.72 11.53 / 5.76 2.3885 0 2 0 38.99 / 39.10 10.45 / 5.22 2.3079 2 2 0 39.68 / 39.79 1.05 / 0.52 2.2693 -3 1 2 40.10 / 40.20 4.76 / 2.38 2.2468 4 0 2 42.10 / 42.21 6.98 / 3.49 2.1447 -2 2 1 42.70 / 42.81 16.67 / 8.34 2.1159 -6 0 2 42.88 / 42.99 12.41 / 6.20 2.1076 4 2 0 44.01 / 44.13 4.14 / 2.07 2.0558 -5 1 2 44.61 / 44.73 21.81 / 10.91 2.0294 7 1 1 46.81 / 46.93 9.76 / 4.88 1.9393 4 2 1 46.98 / 47.11 1.94 / 0.97 1.9324 6 0 2 48.78 / 48.91 20.80 / 10.40 1.8652 6 2 0 50.19 / 50.33 5.35 / 2.67 1.8161 -8 0 2 50.68 / 50.81 2.52 / 1.26 1.7998 0 2 2 50.93 / 51.06 1.67 / 0.83 1.7916 10 0 0 51.04 / 51.18 22.61 / 11.30 1.7878 -9 1 1 51.12 / 51.26 14.50 / 7.25 1.7852 -2 2 2 52.40 / 52.54 8.52 / 4.26 1.7445 2 2 2 53.51 / 53.66 21.28 / 10.64 1.7110 -1 1 3 53.70 / 53.84 4.21 / 2.10 1.7056 -4 2 2 53.90 / 54.05 10.05 / 5.02 1.6996 9 1 1 54.45 / 54.59 4.67 / 2.34 1.6838 1 1 3 54.71 / 54.86 1.38 / 0.69 1.6764 7 1 2 55.26 / 55.41 11.00 / 5.50 1.6610 8 0 2 56.16 / 56.31 14.32 / 7.16 1.6365 4 2 2 57.77 / 57.92 1.58 / 0.79 1.5947 -8 2 1 57.84 / 58.00 4.99 / 2.49 1.5928 -5 1 3 58.11 / 58.27 1.61 / 0.81 1.5861 1 3 0 58.20 / 58.36 1.11 / 0.55 1.5838 -6 2 2 58.94 / 59.10 3.10 / 1.55 1.5656 -10 0 2 60.09 / 60.25 1.50 / 0.75 1.5386 3 3 0 60.89 / 61.06 8.55 / 4.27 1.5202 1 3 1 60.97 / 61.14 2.56 / 1.28 1.5183 -11 1 1 62.12 / 62.29 6.06 / 3.03 1.4930 12 0 0 62.20 / 62.37 11.60 / 5.80 1.4912 5 1 3 62.24 / 62.42 4.49 / 2.24 1.4903 -3 3 1 62.82 / 63.00 10.37 / 5.18 1.4779 -7 1 3 63.09 / 63.27 2.13 / 1.07 1.4723 3 3 1 63.92 / 64.10 1.64 / 0.82 1.4551 5 3 0 64.09 / 64.27 2.66 / 1.33 1.4517 11 1 1 64.27 / 64.45 2.21 / 1.11 1.4481 -2 2 3 64.39 / 64.57 8.77 / 4.38 1.4457 -8 2 2 64.66 / 64.84 1.69 / 0.85 1.4404 10 0 2 65.02 / 65.20 4.76 / 2.38 1.4332 10 2 0 65.73 / 65.92 7.01 / 3.50 1.4194 -5 3 1 68.49 / 68.68 1.01 / 0.51 1.3688 0 0 4 68.56 / 68.75 3.98 / 1.99 1.3676 1 3 2 68.78 / 68.97 2.44 / 1.22 1.3638 -12 0 2 68.78 / 68.98 2.75 / 1.37 1.3637 8 2 2 68.86 / 69.05 2.17 / 1.09 1.3625 10 2 1 69.46 / 69.66 2.64 / 1.32 1.3520 7 3 0 69.50 / 69.70 1.23 / 0.61 1.3514 4 2 3 69.96 / 70.16 4.17 / 2.09 1.3436 -4 0 4 70.47 / 70.67 4.33 / 2.17 1.3351 2 0 4 72.35 / 72.56 2.50 / 1.25 1.3050 -5 3 2 72.79 / 73.00 4.39 / 2.19 1.2982 7 3 1 74.95 / 75.17 3.25 / 1.62 1.2660 12 2 0 75.22 / 75.44 3.37 / 1.69 1.2621 13 1 1 77.29 / 77.52 3.03 / 1.52 1.2334 10 2 2 77.47 / 77.70 2.19 / 1.10 1.2310 -11 1 3 77.72 / 77.95 1.84 / 0.92 1.2277 -9 3 1 79.58 / 79.82 1.39 / 0.69 1.2036 6 0 4 79.71 / 79.95 1.42 / 0.71 1.2020 -1 3 3 79.71 / 79.95 1.52 / 0.76 1.2019 -14 0 2 80.48 / 80.72 1.50 / 0.75 1.1924 1 3 3 80.69 / 80.93 1.22 / 0.61 1.1898 7 3 2 80.87 / 81.11 2.53 / 1.27 1.1876 0 2 4 81.14 / 81.38 1.60 / 0.80 1.1843 -12 2 2 82.26 / 82.51 2.89 / 1.44 1.1710 -4 2 4 82.62 / 82.87 1.16 / 0.58 1.1668 0 4 1 82.74 / 83.00 2.22 / 1.11 1.1654 2 2 4 82.95 / 83.20 1.07 / 0.53 1.1630 3 3 3 83.22 / 83.48 1.67 / 0.83 1.1599 -2 4 1 83.32 / 83.58 2.41 / 1.21 1.1588 -5 3 3 83.71 / 83.97 4.77 / 2.38 1.1544 -15 1 1 83.75 / 84.01 1.51 / 0.76 1.1539 4 4 0 85.13 / 85.40 2.06 / 1.03 1.1387 -10 0 4 85.51 / 85.77 1.19 / 0.59 1.1347 -6 2 4 85.88 / 86.14 3.78 / 1.89 1.1307 11 1 3 86.03 / 86.30 2.03 / 1.01 1.1291 -11 3 1 86.53 / 86.80 1.25 / 0.62 1.1238 4 4 1 86.57 / 86.84 1.76 / 0.88 1.1234 8 0 4 86.82 / 87.09 2.05 / 1.02 1.1209 14 0 2 86.98 / 87.25 2.40 / 1.20 1.1192 -13 1 3 87.11 / 87.39 1.74 / 0.87 1.1178 5 3 3 87.50 / 87.77 1.04 / 0.52 1.1139 15 1 1 89.51 / 89.80 1.11 / 0.55 1.0940 -6 4 1 89.79 / 90.08 2.76 / 1.38 1.0913 -2 4 2 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.