Cu4Bi4S9 Bente K, Kupcik V Acta Crystallographica C40 (1984) 1985-1986 Redetermination and refinement of the structure of tetrabismuth tetracopper enneasulphide Cu4Bi4S9 Locality: Synthetic _database_code_amcsd 0018395 CELL PARAMETERS: 31.6800 11.6590 3.9720 90.000 90.000 90.000 SPACE GROUP: Pbnm X-RAY WAVELENGTH: 1.541838 Cell Volume: 1467.087 Density (g/cm3): 6.165 MAX. ABS. INTENSITY / VOLUME**2: 73.06390941 RIR: 3.859 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 5.58 11.44 15.8400 2 0 0 2 9.42 1.14 9.3897 2 1 0 4 13.52 15.89 6.5514 4 1 0 4 15.20 9.05 5.8295 0 2 0 2 15.46 8.82 5.7332 1 2 0 4 15.92 29.74 5.5670 5 1 0 4 16.79 2.38 5.2800 6 0 0 2 18.45 2.41 4.8098 6 1 0 4 18.90 5.93 4.6949 4 2 0 4 21.06 1.30 4.2190 7 1 0 4 22.45 2.77 3.9600 8 0 0 2 22.56 15.06 3.9411 1 0 1 4 23.06 10.28 3.8574 1 3 0 4 23.57 23.94 3.7744 2 3 0 4 23.73 21.00 3.7496 8 1 0 4 23.83 1.15 3.7336 1 1 1 8 23.94 15.40 3.7177 3 0 1 4 24.33 12.09 3.6582 2 1 1 8 24.91 40.05 3.5749 7 2 0 4 25.14 17.15 3.5420 3 1 1 8 25.53 26.47 3.4889 4 3 0 4 26.24 41.11 3.3965 4 1 1 8 26.45 1.86 3.3698 9 1 0 4 26.49 10.00 3.3654 5 0 1 4 26.91 5.99 3.3128 5 3 0 4 27.17 24.62 3.2825 0 2 1 4 27.31 15.56 3.2650 1 2 1 8 27.59 100.00 3.2334 5 1 1 8 27.76 1.16 3.2142 2 2 1 8 28.17 17.40 3.1680 10 0 0 2 28.48 12.91 3.1345 3 2 1 8 28.52 17.05 3.1299 6 3 0 4 29.16 1.62 3.0627 6 1 1 8 29.21 4.96 3.0572 10 1 0 4 29.46 3.22 3.0324 4 2 1 8 29.65 6.43 3.0133 9 2 0 4 29.93 3.93 2.9853 7 0 1 4 30.67 23.82 2.9148 0 4 0 2 30.92 1.90 2.8920 7 1 1 8 31.20 2.91 2.8666 2 4 0 4 31.85 2.79 2.8097 3 4 0 4 32.01 25.75 2.7960 11 1 0 4 32.11 6.86 2.7877 6 2 1 8 32.16 4.92 2.7835 10 2 0 4 32.35 24.26 2.7672 1 3 1 8 32.74 9.99 2.7354 4 4 0 4 33.73 5.36 2.6572 7 2 1 8 33.96 1.13 2.6400 12 0 0 2 34.03 20.34 2.6344 9 0 1 4 34.21 23.53 2.6213 4 3 1 8 34.37 3.78 2.6089 9 3 0 4 34.74 3.66 2.5821 11 2 0 4 34.84 1.04 2.5748 12 1 0 4 35.28 7.00 2.5441 5 3 1 8 35.52 1.63 2.5272 8 2 1 8 36.55 5.58 2.4584 6 3 1 8 37.39 1.98 2.4049 12 2 0 4 38.01 6.26 2.3675 7 3 1 8 38.41 18.08 2.3435 1 4 1 8 38.62 2.18 2.3316 11 0 1 4 38.72 2.44 2.3255 1 5 0 4 38.74 1.92 2.3245 2 4 1 8 38.92 3.80 2.3139 11 3 0 4 39.04 3.68 2.3069 2 5 0 4 39.41 25.74 2.2863 11 1 1 8 39.63 6.51 2.2741 8 3 1 8 39.84 1.79 2.2629 14 0 0 2 40.02 10.86 2.2528 4 4 1 8 40.32 3.01 2.2369 4 5 0 4 41.25 6.16 2.1883 5 5 0 4 41.34 4.34 2.1838 12 3 0 4 41.41 5.99 2.1806 9 3 1 8 41.72 4.85 2.1649 11 2 1 8 41.81 14.29 2.1606 12 1 1 8 42.09 3.36 2.1469 6 4 1 8 42.37 1.53 2.1330 6 5 0 4 42.87 2.98 2.1095 14 2 0 4 43.39 16.63 2.0855 7 4 1 8 43.67 1.54 2.0728 7 5 0 4 43.85 1.24 2.0646 13 3 0 4 44.02 1.42 2.0572 12 2 1 8 44.29 2.95 2.0449 13 1 1 8 45.12 2.25 2.0093 8 5 0 4 45.18 9.61 2.0069 1 5 1 8 45.36 6.71 1.9994 11 3 1 8 45.47 3.52 1.9949 2 5 1 8 45.68 34.98 1.9860 0 0 2 2 45.69 2.72 1.9857 15 2 0 4 45.83 5.33 1.9800 16 0 0 2 45.94 1.76 1.9754 3 5 1 8 46.41 2.93 1.9566 13 2 1 8 46.44 1.20 1.9555 14 3 0 4 46.46 20.65 1.9544 9 4 1 8 46.52 4.07 1.9521 16 1 0 4 46.60 1.72 1.9490 4 5 1 8 46.73 1.09 1.9440 9 5 0 4 47.51 2.32 1.9136 12 3 1 8 47.58 3.24 1.9111 3 6 0 4 47.86 1.35 1.9006 4 1 2 8 48.22 1.38 1.8874 10 4 1 8 48.22 5.94 1.8872 4 6 0 4 48.51 1.17 1.8766 1 2 2 8 48.68 3.39 1.8705 5 1 2 8 48.84 5.63 1.8648 15 0 1 4 49.77 3.51 1.8319 13 3 1 8 50.10 1.91 1.8207 11 4 1 8 50.35 6.23 1.8123 11 5 0 4 51.10 1.11 1.7874 14 4 0 4 51.45 1.09 1.7761 15 2 1 8 51.48 6.62 1.7750 17 2 0 4 51.77 2.17 1.7657 1 3 2 8 51.96 1.03 1.7600 18 0 0 2 52.03 5.41 1.7575 2 3 2 8 52.11 4.76 1.7550 8 1 2 8 52.21 2.53 1.7519 16 1 1 8 52.35 6.21 1.7477 12 5 0 4 52.40 8.31 1.7461 9 5 1 8 52.42 9.59 1.7455 0 6 1 4 52.51 1.14 1.7428 1 6 1 8 52.73 9.31 1.7361 7 2 2 8 53.06 6.34 1.7260 4 3 2 8 53.19 1.23 1.7221 3 6 1 8 53.82 1.68 1.7034 5 3 2 8 53.89 2.07 1.7012 9 6 0 4 54.01 1.03 1.6978 10 5 1 8 54.09 12.20 1.6954 16 2 1 8 54.46 1.37 1.6849 18 2 0 4 54.54 4.60 1.6827 10 0 2 4 54.74 4.59 1.6769 6 3 2 8 55.00 3.23 1.6697 17 1 1 8 55.15 1.47 1.6654 10 1 2 8 55.41 2.38 1.6582 9 2 2 8 55.44 1.40 1.6573 6 6 1 8 55.75 4.01 1.6488 11 5 1 8 56.03 7.09 1.6412 0 4 2 4 56.16 6.58 1.6378 16 4 0 4 56.51 1.12 1.6286 7 6 1 8 56.87 8.44 1.6191 11 1 2 8 56.96 1.64 1.6167 10 2 2 8 57.19 3.72 1.6108 5 7 0 4 57.33 3.71 1.6071 4 4 2 8 57.62 2.48 1.5997 12 5 1 8 58.40 1.53 1.5802 9 3 2 8 58.64 1.24 1.5742 11 2 2 8 58.83 3.51 1.5696 20 1 0 4 59.10 1.16 1.5631 7 7 0 4 60.56 1.26 1.5288 2 7 1 8 60.77 3.33 1.5242 19 1 1 8 61.39 1.05 1.5102 1 5 2 8 61.53 1.80 1.5070 11 3 2 8 61.55 3.28 1.5066 18 4 0 4 61.62 1.61 1.5051 2 5 2 8 62.19 6.58 1.4928 5 7 1 8 62.54 1.65 1.4851 4 5 2 8 63.23 3.28 1.4706 5 5 2 8 63.30 2.44 1.4693 12 3 2 8 63.74 3.41 1.4601 17 4 1 8 63.76 1.15 1.4597 20 1 1 8 63.87 2.11 1.4574 0 8 0 2 63.92 5.20 1.4563 15 5 1 8 63.94 1.53 1.4560 12 6 1 8 64.44 1.56 1.4460 14 2 2 8 64.55 2.35 1.4437 3 8 0 4 65.14 8.75 1.4320 8 7 1 8 65.42 3.92 1.4266 20 2 1 8 66.16 1.33 1.4125 8 5 2 8 66.24 1.72 1.4109 16 5 1 8 66.27 1.15 1.4103 21 0 1 4 66.60 1.51 1.4042 15 2 2 8 66.71 3.19 1.4022 16 0 2 4 66.82 2.13 1.4001 21 1 1 8 67.25 2.45 1.3922 16 1 2 8 67.27 1.85 1.3918 20 4 0 4 68.09 1.94 1.3771 3 6 2 8 68.60 3.64 1.3680 4 6 2 8 69.25 1.96 1.3568 3 8 1 8 69.34 1.04 1.3553 11 7 1 8 69.92 1.17 1.3455 15 6 1 8 70.32 3.84 1.3387 11 5 2 8 71.12 2.02 1.3257 21 3 1 8 71.25 4.07 1.3235 17 2 2 8 71.47 1.04 1.3200 24 0 0 2 71.55 1.93 1.3187 22 2 1 8 71.97 4.18 1.3120 12 5 2 8 72.14 2.80 1.3093 16 6 1 8 72.65 1.41 1.3014 23 0 1 4 72.89 1.82 1.2978 4 1 3 8 73.27 1.37 1.2920 9 6 2 8 73.32 1.39 1.2911 0 2 3 4 73.53 4.86 1.2881 5 1 3 8 75.19 5.00 1.2636 16 4 2 8 75.99 1.46 1.2523 1 3 3 8 76.08 2.78 1.2511 5 7 2 8 76.10 1.16 1.2508 13 8 0 4 76.57 3.36 1.2443 20 5 1 8 76.94 1.33 1.2392 9 0 3 4 77.04 1.60 1.2379 4 3 3 8 77.19 1.33 1.2358 11 8 1 8 77.32 2.17 1.2340 23 3 1 8 77.52 2.67 1.2314 20 1 2 8 77.53 2.33 1.2312 8 9 0 4 77.78 2.57 1.2279 2 9 1 8 78.79 1.03 1.2147 12 8 1 8 79.37 1.51 1.2073 25 0 1 4 79.41 2.71 1.2067 21 5 1 8 79.50 1.17 1.2057 19 6 1 8 79.58 1.66 1.2046 1 4 3 8 79.92 2.63 1.2003 18 4 2 8 80.22 2.45 1.1966 11 1 3 8 80.61 1.09 1.1917 4 4 3 8 80.90 1.15 1.1883 23 4 1 8 81.80 1.54 1.1775 12 1 3 8 82.01 1.88 1.1750 0 8 2 4 82.12 1.06 1.1737 16 8 0 4 82.63 2.10 1.1678 3 8 2 8 82.88 2.22 1.1648 7 4 3 8 84.14 1.26 1.1506 1 5 3 8 85.06 2.72 1.1404 9 4 3 8 85.12 1.76 1.1398 20 4 2 8 86.06 1.04 1.1297 19 7 1 8 87.37 1.00 1.1161 12 9 1 8 87.73 1.96 1.1125 3 10 1 8 88.21 1.26 1.1077 4 10 1 8 89.06 1.05 1.0993 24 0 2 4 89.58 1.48 1.0943 9 5 3 8 89.59 1.70 1.0942 0 6 3 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.