Br5 H2 In K2 O Lornaux-Rubbens A, Wignacourt J, Drache M, Wallart F Journal de Chimie Physique et de Physico-Chimie Biologique 88 (1991) 2041-2055 Investigations structurales des composes K3-x(InX6-x(H2O)x,nH2O). I. Etude cristallographique (X=Br); comparaison des distances indium-ligand (X=Cl,Br) _cod_database_code 1004096 _database_code_amcsd 0012756 CELL PARAMETERS: 14.5090 10.3690 7.5900 90.000 90.000 90.000 SPACE GROUP: Pnma X-RAY WAVELENGTH: 1.541838 Cell Volume: 1141.869 Density (g/cm3): 3.539 MAX. ABS. INTENSITY / VOLUME**2: 20.58420790 RIR: 1.894 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.20 1.25 7.2545 2 0 0 2 14.46 77.56 6.1245 0 1 1 4 14.90 79.66 5.9441 2 1 0 4 15.71 5.59 5.6424 1 1 1 8 16.91 91.24 5.2443 2 0 1 4 17.10 27.89 5.1845 0 2 0 2 18.96 2.97 4.6798 2 1 1 8 21.06 7.07 4.2181 2 2 0 4 21.64 3.27 4.1061 1 2 1 8 21.79 21.92 4.0787 3 0 1 4 23.44 4.32 3.7956 3 1 1 8 23.44 3.63 3.7950 0 0 2 2 24.24 1.50 3.6715 1 0 2 4 24.54 5.29 3.6272 4 0 0 2 27.25 36.24 3.2727 4 0 1 4 27.83 51.98 3.2056 3 2 1 8 27.89 9.97 3.1987 2 1 2 8 28.37 17.87 3.1455 0 3 1 4 28.60 7.11 3.1210 4 1 1 8 28.61 20.22 3.1203 2 3 0 4 29.05 1.45 3.0741 1 3 1 8 29.16 29.01 3.0623 0 2 2 4 29.82 88.42 2.9963 1 2 2 8 29.93 89.65 2.9856 3 0 2 4 30.07 82.78 2.9721 4 2 0 4 30.99 1.14 2.8859 2 3 1 8 31.17 2.22 2.8690 3 1 2 8 31.72 4.44 2.8212 2 2 2 8 32.35 1.45 2.7675 4 2 1 8 33.05 3.97 2.7105 5 0 1 4 34.00 2.03 2.6369 3 3 1 8 34.19 3.47 2.6223 5 1 1 8 34.20 55.76 2.6222 4 0 2 4 34.60 100.00 2.5923 0 4 0 2 34.67 4.66 2.5872 3 2 2 8 35.31 1.91 2.5421 4 1 2 8 36.04 21.05 2.4924 1 0 3 4 37.10 2.21 2.4234 1 1 3 8 37.18 2.52 2.4182 6 0 0 2 37.31 5.72 2.4102 2 3 2 8 37.65 15.07 2.3889 2 0 3 4 37.86 4.37 2.3764 4 3 1 8 38.22 1.15 2.3550 6 1 0 4 38.47 8.23 2.3399 4 2 2 8 38.68 1.38 2.3279 2 1 3 8 38.75 21.59 2.3239 2 4 1 8 39.08 19.82 2.3051 5 0 2 4 39.10 18.04 2.3041 6 0 1 4 39.90 1.42 2.2594 3 3 2 8 40.07 13.91 2.2502 5 1 2 8 40.09 2.38 2.2492 6 1 1 8 40.14 1.93 2.2463 1 2 3 8 41.20 7.34 2.1912 3 1 3 8 41.27 8.15 2.1878 3 4 1 8 42.22 1.45 2.1405 0 4 2 4 42.38 1.75 2.1329 5 3 1 8 42.88 2.06 2.1090 4 4 0 4 42.94 1.81 2.1063 5 2 2 8 42.96 4.84 2.1055 6 2 1 8 43.31 1.26 2.0890 4 3 2 8 44.42 7.19 2.0393 6 0 2 4 44.53 7.14 2.0347 4 1 3 8 44.59 16.62 2.0320 4 4 1 8 44.83 1.58 2.0216 1 3 3 8 45.32 4.40 2.0010 6 1 2 8 45.33 3.13 2.0005 0 5 1 4 45.36 9.63 1.9995 7 0 1 4 45.49 3.27 1.9939 2 5 0 4 46.39 47.46 1.9574 3 4 2 8 47.18 2.28 1.9265 4 2 3 8 47.41 9.39 1.9178 5 3 2 8 47.42 1.95 1.9171 6 3 1 8 47.69 5.30 1.9070 5 0 3 4 47.94 1.39 1.8975 0 0 4 2 48.38 15.44 1.8815 1 0 4 4 48.40 5.37 1.8808 3 3 3 8 48.54 1.29 1.8755 5 1 3 8 48.60 2.54 1.8734 5 4 1 8 48.82 2.91 1.8656 7 2 1 8 49.22 8.03 1.8512 1 1 4 8 49.44 34.84 1.8435 4 4 2 8 49.66 7.59 1.8357 2 0 4 4 50.15 1.67 1.8191 7 0 2 4 50.31 10.30 1.8136 8 0 0 2 50.82 14.86 1.7967 1 4 3 8 51.03 4.89 1.7897 5 2 3 8 51.13 1.71 1.7865 8 1 0 4 51.36 4.87 1.7791 4 3 3 8 51.70 1.96 1.7682 6 4 0 4 51.75 4.51 1.7664 3 0 4 4 51.79 1.15 1.7651 2 5 2 8 51.83 4.50 1.7640 8 0 1 4 52.06 10.40 1.7567 2 4 3 8 52.07 3.22 1.7564 6 3 2 8 52.63 7.17 1.7390 8 1 1 8 52.91 8.17 1.7305 2 2 4 8 52.99 1.36 1.7282 0 6 0 2 53.17 14.04 1.7226 5 4 2 8 53.19 13.68 1.7221 6 4 1 8 53.38 2.47 1.7165 7 2 2 8 53.53 2.76 1.7119 8 2 0 4 54.91 5.01 1.6720 3 2 4 8 54.99 8.86 1.6700 8 2 1 8 55.47 3.42 1.6565 6 2 3 8 55.62 6.19 1.6525 1 3 4 8 57.38 1.40 1.6060 8 3 0 4 57.50 6.02 1.6028 6 4 2 8 57.64 2.38 1.5993 4 2 4 8 57.96 5.26 1.5912 3 6 1 8 58.28 8.25 1.5832 7 4 1 8 58.53 2.09 1.5769 9 0 1 4 58.70 3.07 1.5728 0 6 2 4 58.77 5.25 1.5712 8 3 1 8 59.08 9.66 1.5636 1 6 2 8 59.21 1.31 1.5605 8 2 2 8 59.23 9.11 1.5601 4 6 0 4 59.27 1.46 1.5590 9 1 1 8 60.01 3.19 1.5417 5 5 2 8 60.25 4.69 1.5361 5 4 3 8 60.44 3.32 1.5318 7 2 3 8 60.46 1.22 1.5311 0 4 4 4 60.83 14.08 1.5227 1 4 4 8 60.85 1.58 1.5223 3 5 3 8 61.41 2.40 1.5098 1 0 5 4 61.94 7.02 1.4981 2 4 4 8 62.36 1.59 1.4890 7 4 2 8 62.50 9.65 1.4860 8 4 0 4 63.07 2.04 1.4740 8 0 3 4 63.22 1.48 1.4708 2 1 5 8 63.41 1.97 1.4669 4 5 3 8 63.76 4.34 1.4597 3 4 4 8 63.78 1.14 1.4593 8 1 3 8 63.83 4.24 1.4583 8 4 1 8 64.04 1.19 1.4541 6 5 2 8 64.05 1.64 1.4539 0 7 1 4 64.17 1.96 1.4513 2 7 0 4 64.19 2.00 1.4509 10 0 0 2 64.26 1.45 1.4495 1 2 5 8 64.59 1.45 1.4430 4 6 2 8 65.01 1.14 1.4347 9 3 1 8 65.02 4.96 1.4345 6 2 4 8 65.88 1.87 1.4178 8 2 3 8 66.85 5.55 1.3996 7 0 4 4 67.18 2.37 1.3934 1 5 4 8 68.77 1.06 1.3650 2 3 5 8 69.09 6.82 1.3596 9 0 3 4 69.81 2.21 1.3472 9 4 1 8 69.94 7.46 1.3451 5 0 5 4 70.02 2.48 1.3436 8 5 1 8 72.02 1.65 1.3112 10 2 2 8 72.44 2.64 1.3046 1 4 5 8 72.99 8.21 1.2961 0 8 0 2 73.44 1.43 1.2894 11 1 1 8 73.98 2.42 1.2814 8 4 3 8 74.03 1.47 1.2806 5 6 3 8 75.02 2.39 1.2661 10 4 0 4 75.41 4.23 1.2605 11 2 1 8 75.43 1.20 1.2602 1 0 6 4 75.54 1.06 1.2586 10 0 3 4 75.56 2.44 1.2583 2 6 4 8 75.57 2.54 1.2583 2 8 1 8 76.43 1.45 1.2462 2 0 6 4 76.43 2.12 1.2462 5 7 2 8 77.19 1.30 1.2359 3 7 3 8 77.23 1.59 1.2353 3 6 4 8 77.23 1.22 1.2353 3 8 1 8 77.29 2.69 1.2345 8 6 1 8 77.51 6.75 1.2315 7 4 4 8 77.70 1.07 1.2290 6 6 3 8 77.70 1.14 1.2289 0 2 6 4 78.03 1.16 1.2246 1 2 6 8 78.14 1.16 1.2231 10 2 3 8 78.38 2.96 1.2200 9 1 4 8 78.66 1.24 1.2164 11 3 1 8 78.67 2.34 1.2162 7 1 5 8 78.74 1.22 1.2154 3 1 6 8 79.02 1.50 1.2117 2 2 6 8 79.50 1.19 1.2056 4 7 3 8 79.54 2.27 1.2051 4 8 1 8 79.63 8.53 1.2040 9 4 3 8 80.39 2.26 1.1944 4 0 6 4 80.43 3.80 1.1940 12 0 1 4 80.44 9.48 1.1939 5 4 5 8 80.85 7.20 1.1889 3 8 2 8 81.97 1.15 1.1754 7 6 3 8 82.96 1.87 1.1639 1 7 4 8 83.11 1.38 1.1622 11 1 3 8 83.13 5.93 1.1619 4 8 2 8 83.51 2.77 1.1576 9 3 4 8 83.80 2.22 1.1544 7 3 5 8 83.86 1.05 1.1536 3 3 6 8 83.97 1.23 1.1524 5 1 6 8 84.20 2.94 1.1499 1 8 3 8 85.17 1.92 1.1392 2 8 3 8 85.63 1.62 1.1344 8 7 1 8 85.72 1.65 1.1334 1 4 6 8 85.83 1.44 1.1322 10 4 3 8 86.06 2.66 1.1298 5 8 2 8 86.07 1.93 1.1297 6 6 4 8 86.07 2.85 1.1297 6 8 1 8 86.69 1.99 1.1232 2 4 6 8 88.19 1.35 1.1079 11 3 3 8 89.05 1.20 1.0994 5 3 6 8 89.62 1.41 1.0939 6 8 2 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.