Schmitterite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from the powder pattern for R060524 Meunier G, Galy J Acta Crystallographica B29 (1973) 1251-1255 Structure cristalline de la schmitterite synthetique UTeO5 Locality: synthetic CELL PARAMETERS: 10.11441 5.404070 7.861362 90.00000 90.00000 90.00000 SPACE GROUP: Pca2_1 ATOM X Y Z OCCUPANCY ISO(B) U 0.01480 0.03020 0.00000 1.000 0.945 Te 0.25000 0.36620 0.24700 1.000 0.452 O 0.21400 0.27000 -0.02600 1.000 0.820 O 0.10300 0.16100 0.28400 1.000 0.300 O 0.39200 0.12000 0.23300 1.000 0.840 O 0.61500 0.24100 0.02700 1.000 0.750 O 0.59000 0.30600 0.53100 1.000 1.000 X-RAY WAVELENGTH: 0.710730 BOUNDS ON TWO THETA: 5.0 55.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 13 +/- 6 +/- 10 MAX. ABS. INTENSITY / VOLUME**2: 908.2632043 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 7.58 29.61 5.4041 0 1 0 8.10 10.63 5.0572 2 0 0 8.59 24.21 4.7664 1 1 0 9.62 3.14 4.2532 2 0 1 10.04 5.04 4.0758 1 1 1 10.41 8.45 3.9307 0 0 2 11.08 100.00 3.6925 2 1 0 12.24 3.12 3.3422 2 1 1 12.86 56.39 3.1788 0 1 2 13.18 77.47 3.1035 2 0 2 13.48 15.37 3.0325 1 1 2 14.30 5.74 2.8604 3 1 0 15.22 1.53 2.6880 3 1 1 15.20 16.25 2.6913 2 1 2 15.14 4.93 2.7020 0 2 0 15.67 4.02 2.6105 1 2 0 16.18 17.33 2.5286 4 0 0 16.51 3.58 2.4775 1 2 1 17.00 1.25 2.4071 4 0 1 17.17 17.49 2.3832 2 2 0 17.59 1.36 2.3267 2 0 3 17.69 1.40 2.3129 3 1 2 17.87 3.63 2.2903 4 1 0 17.82 1.90 2.2963 1 1 3 18.38 10.19 2.2267 0 2 2 18.62 4.07 2.1989 4 1 1 18.82 6.95 2.1746 1 2 2 19.16 1.50 2.1370 2 1 3 19.25 2.50 2.1266 4 0 2 19.42 8.42 2.1085 3 2 0 20.11 3.37 2.0365 3 2 1 20.10 17.93 2.0379 2 2 2 20.70 39.14 1.9789 4 1 2 20.84 16.85 1.9653 0 0 4 21.63 2.49 1.8945 5 1 0 22.06 4.47 1.8580 3 2 2 22.26 1.02 1.8418 5 1 1 22.19 3.79 1.8470 0 1 4 22.20 6.64 1.8463 4 2 0 22.16 2.43 1.8494 1 2 3 22.38 1.72 1.8319 2 0 4 22.56 3.72 1.8169 1 1 4 22.81 2.64 1.7974 4 2 1 22.76 6.10 1.8014 0 3 0 23.12 1.21 1.7735 1 3 0 23.64 25.72 1.7349 2 1 4 23.79 2.17 1.7245 4 1 3 23.71 4.02 1.7300 1 3 1 24.04 1.03 1.7066 5 1 2 24.56 11.52 1.6711 4 2 2 24.90 1.93 1.6483 6 0 1 24.99 1.47 1.6427 3 2 3 25.07 1.75 1.6376 0 3 2 25.35 1.88 1.6198 3 1 4 25.52 7.75 1.6093 6 1 0 25.40 1.04 1.6165 1 3 2 25.89 1.52 1.5861 5 2 1 25.84 2.88 1.5894 0 2 4 26.05 2.80 1.5766 6 1 1 26.16 2.19 1.5701 1 2 4 26.52 9.70 1.5493 6 0 2 26.48 9.33 1.5517 4 0 4 26.38 2.74 1.5573 3 3 1 26.37 16.72 1.5579 2 3 2 27.11 9.02 1.5163 2 2 4 27.23 1.33 1.5093 4 2 3 27.46 4.83 1.4973 5 2 2 27.61 2.46 1.4893 6 1 2 27.56 2.20 1.4915 4 1 4 27.92 2.33 1.4730 3 3 2 28.03 6.98 1.4671 4 3 0 28.00 2.55 1.4687 1 3 3 28.62 4.37 1.4376 3 2 4 28.77 3.34 1.4302 6 2 0 29.25 1.65 1.4071 6 2 1 30.03 1.56 1.3713 6 1 3 30.19 1.69 1.3640 5 1 4 30.32 1.67 1.3586 3 3 3 30.65 3.69 1.3440 6 2 2 30.61 4.45 1.3456 4 2 4 31.08 1.04 1.3260 5 3 1 31.03 4.61 1.3279 0 3 4 31.33 2.67 1.3154 7 1 2 31.22 3.12 1.3201 1 4 1 31.58 3.88 1.3052 2 4 0 32.37 1.10 1.2742 7 2 0 32.40 4.27 1.2733 0 1 6 32.63 2.34 1.2643 8 0 0 32.28 5.16 1.2777 0 4 2 32.53 5.63 1.2684 2 0 6 32.87 1.16 1.2554 6 2 3 33.06 1.06 1.2483 8 0 1 33.15 6.50 1.2451 6 1 4 33.43 1.57 1.2348 2 1 6 33.33 1.78 1.2384 3 4 1 33.96 1.89 1.2162 8 1 1 34.66 1.96 1.1924 1 4 3 35.19 4.28 1.1748 8 1 2 35.07 1.62 1.1789 0 2 6 35.20 4.30 1.1746 6 3 2 35.17 6.13 1.1757 4 3 4 35.14 1.02 1.1765 1 3 5 35.31 1.11 1.1710 1 2 6 35.77 2.88 1.1564 6 2 4 36.04 2.56 1.1481 2 2 6 36.39 5.70 1.1373 4 1 6 36.53 1.41 1.1332 8 2 1 36.29 4.17 1.1403 4 4 2 36.59 1.32 1.1312 3 4 3 37.17 1.23 1.1142 8 1 3 37.69 1.54 1.0994 8 2 2 38.27 1.09 1.0835 7 3 2 38.13 4.01 1.0873 2 4 4 38.80 1.26 1.0691 7 2 4 38.82 2.26 1.0685 4 2 6 39.02 2.32 1.0633 8 0 4 38.96 1.52 1.0648 1 5 1 39.56 1.08 1.0493 8 2 3 39.37 1.66 1.0542 6 4 0 40.15 2.24 1.0345 6 0 6 40.14 1.16 1.0349 8 3 0 40.05 3.71 1.0371 2 3 6 40.80 1.13 1.0186 5 2 6 40.77 1.13 1.0195 1 4 5 40.72 1.25 1.0205 3 5 1 40.72 1.51 1.0207 2 5 2 41.45 1.40 1.0033 9 2 2 42.20 1.12 0.9863 10 1 1 41.84 1.05 0.9943 1 5 3 42.51 1.22 0.9795 10 0 2 42.36 1.15 0.9827 0 0 8 43.91 2.79 0.9496 2 1 8 44.36 1.35 0.9406 0 4 6 44.94 1.94 0.9290 6 4 4 45.07 1.05 0.9264 5 5 2 45.61 1.45 0.9159 4 0 8 45.63 1.42 0.9157 8 3 4 46.01 1.23 0.9085 2 2 8 46.62 1.42 0.8972 8 1 6 46.54 1.59 0.8987 8 4 2 46.62 1.56 0.8971 6 3 6 47.18 1.15 0.8871 10 1 4 47.50 1.53 0.8815 4 4 6 48.73 1.12 0.8605 10 3 2 50.08 1.26 0.8387 6 1 8 51.54 1.21 0.8165 4 3 8 51.54 1.21 0.8165 4 3 8 XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.