H2B12(OH)12 Stasko D J, Perzynski K J, Wasil M A, Brodbeck J K, Kirschbaum K, Kim Y W, Lind C Inorganic Chemistry 43 (2004) 3786-3788 An addition to the oxoacid family: H2B12(OH)12 Locality: synthetic _database_code_amcsd 0018656 CELL PARAMETERS: 8.2370 8.2930 8.3553 90.000 90.143 90.000 SPACE GROUP: P2_1/n X-RAY WAVELENGTH: 1.541838 Cell Volume: 570.744 Density (g/cm3): 1.954 MAX. ABS. INTENSITY / VOLUME**2: 1.736331840 RIR: 0.289 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 15.05 100.00 5.8859 0 1 1 4 15.09 44.61 5.8731 -1 0 1 2 15.12 37.34 5.8585 1 0 1 2 15.16 87.85 5.8441 1 1 0 4 21.27 2.32 4.1776 0 0 2 2 23.85 3.19 3.7310 0 1 2 4 26.24 2.95 3.3957 1 1 2 4 26.31 1.12 3.3874 -1 2 1 4 26.33 1.36 3.3845 1 2 1 4 26.39 3.55 3.3772 -2 1 1 4 26.43 1.16 3.3717 2 1 1 4 30.37 50.22 2.9430 0 2 2 4 30.44 8.86 2.9366 -2 0 2 2 30.52 45.86 2.9292 2 0 2 2 30.59 36.26 2.9221 2 2 0 4 32.28 1.54 2.7729 -1 2 2 4 32.32 22.92 2.7698 1 2 2 4 32.34 30.73 2.7681 -2 1 2 4 32.44 35.27 2.7598 -2 2 1 4 32.48 1.94 2.7567 2 2 1 4 33.95 15.57 2.6404 -1 0 3 2 33.95 41.60 2.6402 0 1 3 4 34.01 29.43 2.6364 1 0 3 2 34.16 42.21 2.6244 0 3 1 4 34.22 27.30 2.6207 1 3 0 4 34.35 13.33 2.6104 -3 0 1 2 34.41 51.99 2.6065 3 1 0 4 34.41 14.08 2.6065 3 0 1 2 35.69 28.33 2.5159 -1 1 3 4 35.74 1.69 2.5125 1 1 3 4 35.90 1.23 2.5011 -1 3 1 4 35.92 47.45 2.5000 1 3 1 4 36.07 28.78 2.4899 -3 1 1 4 37.53 26.62 2.3965 -2 2 2 4 37.60 34.78 2.3925 2 2 2 4 38.96 1.27 2.3120 0 2 3 4 39.07 11.14 2.3053 0 3 2 4 39.25 1.18 2.2952 2 3 0 4 39.36 5.75 2.2893 3 2 0 4 40.50 7.16 2.2272 -1 2 3 4 40.54 8.02 2.2251 -2 1 3 4 40.55 6.97 2.2248 1 2 3 4 40.62 5.13 2.2208 -1 3 2 4 40.63 9.84 2.2203 2 1 3 4 40.65 2.89 2.2192 1 3 2 4 40.75 10.52 2.2140 -2 3 1 4 40.76 14.12 2.2137 -3 1 2 4 40.78 14.09 2.2125 2 3 1 4 40.85 1.35 2.2091 -3 2 1 4 40.85 17.88 2.2090 3 1 2 4 40.90 8.52 2.2067 3 2 1 4 43.32 1.54 2.0888 0 0 4 2 43.66 1.42 2.0733 0 4 0 2 43.97 2.37 2.0592 4 0 0 2 44.74 6.93 2.0256 0 1 4 4 44.92 3.14 2.0178 -2 2 3 4 45.09 3.20 2.0105 1 4 0 4 45.38 2.83 1.9986 4 1 0 4 46.12 4.25 1.9681 -1 1 4 4 46.18 1.30 1.9659 1 1 4 4 46.27 7.29 1.9620 0 3 3 4 46.38 2.12 1.9577 -3 0 3 2 46.46 3.26 1.9545 1 4 1 4 46.50 5.46 1.9528 3 0 3 2 46.62 4.01 1.9480 3 3 0 4 46.71 1.72 1.9448 -4 1 1 4 47.63 1.62 1.9093 -1 3 3 4 47.67 3.19 1.9078 1 3 3 4 47.93 5.23 1.8979 -3 3 1 4 48.82 6.01 1.8655 0 2 4 4 48.94 2.46 1.8610 2 0 4 2 49.05 4.53 1.8571 0 4 2 4 49.20 6.07 1.8518 2 4 0 4 49.29 1.33 1.8489 -4 0 2 2 49.39 1.74 1.8452 4 0 2 2 49.42 6.17 1.8443 4 2 0 4 50.14 4.24 1.8194 -2 1 4 4 50.24 2.00 1.8159 2 1 4 4 50.36 5.13 1.8121 -1 4 2 4 50.71 4.52 1.8001 4 2 1 4 51.63 3.79 1.7703 -3 2 3 4 51.64 3.60 1.7701 2 3 3 4 51.74 4.07 1.7667 -3 3 2 4 51.74 2.77 1.7667 3 2 3 4 51.82 2.07 1.7643 3 3 2 4 54.01 1.18 1.6979 2 2 4 4 54.20 1.06 1.6923 2 4 2 4 56.15 1.84 1.6381 0 1 5 4 56.19 1.14 1.6369 1 0 5 2 56.46 2.12 1.6297 1 4 3 4 56.52 1.18 1.6281 3 1 4 4 56.81 1.83 1.6207 -4 3 1 4 57.77 1.61 1.5959 1 5 1 4 58.18 1.12 1.5857 5 1 1 4 59.66 1.03 1.5499 0 2 5 4 59.88 1.61 1.5446 -3 2 4 4 59.96 5.11 1.5429 -2 4 3 4 60.02 2.04 1.5414 3 2 4 4 60.31 2.12 1.5347 4 3 2 4 61.15 2.26 1.5155 -1 5 2 4 64.33 1.44 1.4481 1 4 4 4 64.53 2.64 1.4442 -2 5 2 4 64.57 4.45 1.4433 2 5 2 4 64.76 1.66 1.4396 -4 4 1 4 64.81 5.64 1.4386 -5 2 2 4 65.29 2.85 1.4290 -3 0 5 2 65.46 3.83 1.4259 -3 3 4 4 65.80 2.09 1.4192 4 3 3 4 66.38 3.09 1.4083 -3 1 5 4 66.62 1.76 1.4039 1 5 3 4 66.87 1.55 1.3991 -5 1 3 4 67.23 1.92 1.3925 0 0 6 2 67.56 1.27 1.3865 -2 4 4 4 67.80 1.85 1.3822 0 6 0 2 68.30 6.09 1.3733 0 1 6 4 68.33 3.78 1.3728 6 0 0 2 68.88 3.35 1.3631 1 6 0 4 69.58 3.32 1.3511 -3 2 5 4 69.74 10.36 1.3484 3 2 5 4 69.81 3.97 1.3472 -2 5 3 4 69.87 1.99 1.3462 2 5 3 4 69.92 1.66 1.3454 -1 6 1 4 70.28 7.93 1.3395 5 3 2 4 70.46 1.08 1.3364 6 1 1 4 71.96 1.59 1.3122 0 6 2 4 72.08 1.15 1.3103 2 6 0 4 72.41 1.12 1.3052 -6 0 2 2 72.53 2.44 1.3033 6 2 0 4 72.53 1.71 1.3033 6 0 2 2 72.81 1.97 1.2989 0 5 4 4 73.02 1.12 1.2957 1 6 2 4 73.41 1.83 1.2898 5 4 0 4 73.70 3.20 1.2855 -1 4 5 4 74.30 1.80 1.2766 5 1 4 4 74.32 2.49 1.2762 4 5 1 4 75.15 1.99 1.2642 3 5 3 4 75.25 1.86 1.2627 -5 3 3 4 76.89 1.12 1.2399 2 4 5 4 77.01 2.34 1.2382 2 5 4 4 77.16 2.00 1.2362 -5 2 4 4 77.28 1.55 1.2346 -4 5 2 4 77.39 1.81 1.2331 -5 4 2 4 77.67 1.91 1.2293 1 3 6 4 77.85 1.78 1.2270 3 1 6 4 78.27 1.82 1.2215 -3 6 1 4 78.44 1.48 1.2192 -6 1 3 4 78.62 1.84 1.2168 6 1 3 4 80.09 1.73 1.1982 -4 4 4 4 83.19 1.10 1.1612 1 7 1 4 83.81 1.19 1.1543 -7 1 1 4 87.62 1.02 1.1136 -2 4 6 4 88.53 1.21 1.1045 -6 4 2 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.