Sibirskite Miura H, Kusachi I Journal of Mineralogical and Petrological Sciences 103 (2008) 156-160 Crystal structure of sibirskite (CaHBO3) by Monte Carlo simulation and Rietveld refinement Locality: Fuka, Okayama, Japan _database_code_amcsd 0013135 CELL PARAMETERS: 8.6430 9.5230 3.5670 90.000 119.230 90.000 SPACE GROUP: P2_1/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 256.206 Density (g/cm3): 2.563 MAX. ABS. INTENSITY / VOLUME**2: 5.120720744 RIR: 0.650 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 14.98 39.61 5.9126 1 1 0 4 18.64 35.59 4.7615 0 2 0 2 22.08 6.18 4.0263 1 2 0 4 23.59 37.62 3.7712 2 0 0 2 25.40 12.14 3.5063 2 1 0 4 26.78 15.55 3.3294 -1 1 1 4 26.79 23.62 3.3274 -2 0 1 2 28.41 19.22 3.1412 -2 1 1 4 30.21 66.48 2.9587 0 1 1 4 30.23 92.84 2.9563 2 2 0 4 30.55 21.65 2.9258 1 3 0 4 32.84 40.73 2.7274 -2 2 1 4 34.42 100.00 2.6054 0 2 1 4 34.46 6.14 2.6025 -3 1 1 4 36.98 8.82 2.4309 3 1 0 4 37.45 1.66 2.4014 1 1 1 4 37.79 1.90 2.3807 0 4 0 2 38.26 17.31 2.3523 -3 2 1 4 40.58 28.08 2.2233 3 2 0 4 42.20 3.66 2.1414 -4 0 1 2 43.31 1.92 2.0893 -4 1 1 4 43.97 23.69 2.0591 -3 3 1 4 45.03 10.15 2.0132 2 4 0 4 45.88 6.83 1.9779 -1 4 1 4 45.98 13.95 1.9737 2 0 1 2 46.05 12.50 1.9709 3 3 0 4 46.50 5.97 1.9530 -4 2 1 4 46.93 22.70 1.9362 -2 4 1 4 48.12 26.16 1.8911 0 4 1 4 48.26 1.95 1.8856 4 0 0 2 49.35 1.33 1.8466 1 5 0 4 50.03 7.40 1.8233 2 2 1 4 51.10 1.61 1.7873 -3 4 1 4 51.43 10.85 1.7768 -2 0 2 2 52.17 3.75 1.7531 4 2 0 4 52.78 12.63 1.7343 -3 1 2 4 53.91 14.29 1.7008 -5 1 1 4 54.68 1.93 1.6787 -1 5 1 4 55.17 3.62 1.6647 -2 2 2 4 55.21 2.23 1.6637 -4 0 2 2 56.66 1.17 1.6246 0 5 1 4 57.92 3.33 1.5921 -4 4 1 4 58.12 4.27 1.5872 0 6 0 2 58.14 7.15 1.5866 3 1 1 4 59.34 2.92 1.5574 -3 5 1 4 59.38 1.64 1.5564 0 0 2 2 60.25 4.55 1.5360 0 1 2 4 60.98 3.58 1.5194 2 4 1 4 61.03 2.33 1.5182 3 5 0 4 61.04 1.04 1.5181 -5 3 1 4 61.36 1.15 1.5109 1 5 1 4 62.08 2.40 1.4952 -5 1 2 4 62.32 1.25 1.4899 5 1 0 4 62.81 3.52 1.4794 0 2 2 4 63.60 4.19 1.4629 2 6 0 4 64.60 1.09 1.4428 -5 2 2 4 65.12 2.29 1.4325 -2 6 1 4 66.08 1.39 1.4140 0 6 1 4 68.55 1.13 1.3690 -3 6 1 4 68.69 2.88 1.3665 -5 3 2 4 68.92 3.04 1.3625 5 3 0 4 70.24 1.15 1.3400 4 5 0 4 72.57 1.63 1.3027 0 4 2 4 81.37 1.39 1.1825 5 5 0 4 84.33 1.14 1.1484 -4 6 2 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.