Tsumoite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R080089 Shimazaki H, Ozawa T American Mineralogist 63 (1978) 1162-1165 Tsumoite, BiTe, a new mineral from Tsumo mine, Japan _database_code_amcsd 0000691 CELL PARAMETERS: 4.2360 4.2360 23.1000 90.000 90.000 120.000 SPACE GROUP: P-3m1 ATOM X Y Z OCCUPANCY ISO(B) Te 0.33333 0.66667 0.05300 1.000 1.000 Te 0.66667 0.33333 0.21110 1.000 1.700 Te 0.00000 0.00000 0.36310 1.000 1.300 Bi 0.00000 0.00000 0.12520 1.000 0.700 Bi 0.33333 0.66667 0.29220 1.000 0.700 Bi 0.66667 0.33333 0.45930 1.000 2.300 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 3 +/- 3 +/- 21 MAX. ABS. INTENSITY / VOLUME**2: 623.7781709 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 19.21 5.90 4.6200 0 0 5 24.57 4.97 3.6231 0 1 1 26.92 1.65 3.3118 0 1 3 28.83 99.96 3.0965 1 0 4 39.73 37.89 2.2690 0 1 8 42.69 33.23 2.1180 1 1 0 43.01 3.91 2.1030 1 0 9 47.21 3.61 1.9253 1 1 5 47.22 6.65 1.9250 0 0 12 52.33 16.94 1.7482 0 2 4 57.64 2.35 1.5992 0 1 13 59.73 10.16 1.5483 2 0 8 62.21 1.27 1.4923 0 2 9 65.53 13.28 1.4245 1 1 12 69.75 12.69 1.3482 2 1 4 70.04 4.57 1.3435 1 0 16 74.32 1.05 1.2763 2 0 13 76.16 8.87 1.2499 1 2 8 78.17 4.44 1.2228 3 0 0 78.39 1.25 1.2199 2 1 9 84.76 1.89 1.1437 1 1 17 85.61 2.43 1.1345 0 2 16 88.82 1.85 1.1017 0 1 20 89.70 1.27 1.0931 1 2 13 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.