Bismuthinite Kyono A, Kimata M American Mineralogist 89 (2004) 932-940 Structural variations induced by difference of the inert pair effect in the stibnite-bismuthinite solid solution series (Sb,Bi)2S3 Sample: Sb0.387Bi1.613S3 _database_code_amcsd 0003559 CELL PARAMETERS: 11.3360 3.9562 11.1860 90.000 90.000 90.000 SPACE GROUP: Pnma X-RAY WAVELENGTH: 1.541838 Cell Volume: 501.664 Density (g/cm3): 6.359 MAX. ABS. INTENSITY / VOLUME**2: 76.46068256 RIR: 3.915 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 11.11 3.01 7.9622 1 0 1 4 15.63 29.39 5.6680 2 0 0 2 15.85 8.21 5.5930 0 0 2 2 17.54 30.39 5.0560 2 0 1 4 17.68 6.79 5.0157 1 0 2 4 22.33 50.95 3.9811 2 0 2 4 23.86 28.94 3.7298 0 1 1 4 24.87 90.85 3.5799 3 0 1 4 25.14 47.66 3.5430 1 1 1 8 25.14 83.56 3.5420 1 0 3 4 27.49 21.09 3.2441 2 1 0 4 28.51 12.17 3.1311 3 0 2 4 28.65 39.82 3.1157 2 1 1 8 28.66 13.27 3.1151 2 0 3 4 28.74 100.00 3.1062 1 1 2 8 31.89 82.62 2.8062 2 1 2 8 32.99 5.59 2.7151 1 0 4 4 33.01 34.01 2.7134 0 1 3 4 33.77 1.24 2.6545 3 1 1 8 33.77 1.37 2.6541 3 0 3 4 33.97 24.18 2.6389 1 1 3 8 35.51 41.77 2.5280 4 0 2 4 35.81 12.34 2.5079 2 0 4 4 36.60 16.06 2.4552 3 1 2 8 39.10 24.72 2.3039 4 1 0 4 39.95 36.66 2.2565 4 1 1 8 39.96 4.63 2.2563 4 0 3 4 40.11 3.60 2.2479 3 0 4 4 40.29 12.61 2.2386 1 1 4 8 40.95 2.25 2.2040 3 1 3 8 41.13 3.19 2.1949 1 0 5 4 42.43 6.30 2.1302 4 1 2 8 42.69 15.54 2.1181 2 1 4 8 43.05 10.05 2.1011 5 0 2 4 43.49 8.93 2.0810 2 0 5 4 45.57 6.56 1.9905 4 0 4 4 45.88 32.27 1.9781 0 2 0 2 46.33 2.22 1.9599 4 1 3 8 46.46 52.79 1.9544 3 1 4 8 46.64 26.90 1.9474 0 1 5 4 46.90 9.97 1.9374 5 1 1 8 46.90 8.64 1.9372 5 0 3 4 47.21 16.29 1.9251 3 0 5 4 47.37 2.67 1.9193 1 1 5 8 48.16 11.49 1.8893 6 0 0 2 48.76 2.79 1.8676 2 2 0 4 48.85 6.66 1.8643 0 0 6 2 48.89 1.96 1.8629 6 0 1 4 49.09 9.85 1.8557 5 1 2 8 49.48 3.32 1.8421 2 2 1 8 49.55 5.87 1.8396 1 0 6 4 51.02 1.32 1.7900 6 0 2 4 51.59 9.42 1.7715 2 2 2 8 51.61 4.17 1.7710 2 0 6 4 52.08 4.46 1.7560 4 0 5 4 52.60 15.09 1.7398 5 1 3 8 52.88 20.00 1.7314 3 2 1 8 52.89 3.99 1.7310 3 1 5 8 53.02 19.11 1.7270 1 2 3 8 53.77 12.77 1.7049 6 1 0 4 54.44 2.79 1.6854 6 1 1 8 54.44 2.18 1.6853 6 0 3 4 54.90 2.85 1.6723 3 2 2 8 54.99 3.45 1.6699 2 2 3 8 55.05 3.11 1.6681 1 1 6 8 57.26 1.29 1.6089 5 1 4 8 57.66 2.08 1.5988 1 2 4 8 59.32 15.27 1.5579 4 2 2 8 59.33 2.98 1.5575 4 0 6 4 59.52 4.54 1.5531 2 2 4 8 59.63 3.17 1.5505 6 1 3 8 60.08 2.77 1.5400 3 1 6 8 60.16 7.13 1.5380 2 0 7 4 62.44 2.03 1.4874 4 2 3 8 62.53 6.19 1.4855 7 1 1 8 62.53 7.74 1.4854 7 0 3 4 62.55 1.62 1.4850 3 2 4 8 63.29 1.48 1.4694 1 2 5 8 64.27 2.25 1.4493 4 1 6 8 64.35 4.43 1.4477 7 1 2 8 64.56 2.09 1.4435 6 0 5 4 64.72 4.92 1.4403 5 2 2 8 64.74 1.80 1.4400 5 0 6 4 65.06 4.29 1.4337 2 2 5 8 65.07 10.66 1.4335 2 1 7 8 66.51 1.39 1.4058 8 0 1 4 66.66 3.44 1.4031 4 2 4 8 66.75 4.54 1.4014 7 0 4 4 66.92 1.64 1.3982 0 0 8 2 67.49 1.16 1.3877 1 0 8 4 67.70 4.76 1.3840 5 2 3 8 67.95 8.97 1.3796 3 2 5 8 68.70 6.52 1.3663 6 2 0 4 69.25 3.87 1.3567 0 2 6 4 69.28 1.15 1.3562 6 2 1 8 69.29 9.55 1.3560 6 1 5 8 69.82 3.44 1.3471 1 2 6 8 71.03 2.14 1.3270 6 0 6 4 71.18 1.40 1.3246 8 1 1 8 71.50 2.61 1.3194 2 2 6 8 71.90 2.79 1.3132 4 2 5 8 71.91 13.10 1.3131 4 1 7 8 72.13 5.75 1.3095 1 1 8 8 72.68 1.79 1.3010 1 3 1 8 72.90 6.20 1.2976 8 1 2 8 73.87 1.44 1.2829 6 2 3 8 74.34 1.97 1.2760 2 3 1 8 74.38 4.55 1.2754 1 3 2 8 75.58 1.87 1.2581 6 1 6 8 76.02 4.43 1.2518 2 3 2 8 76.04 2.65 1.2516 9 0 1 4 76.51 2.47 1.2451 7 1 5 8 76.64 1.92 1.2433 0 3 3 4 77.19 1.48 1.2359 1 3 3 8 77.21 1.40 1.2355 1 0 9 4 78.10 2.23 1.2237 4 2 6 8 78.74 1.16 1.2153 3 3 2 8 78.83 5.36 1.2142 2 2 7 8 79.63 3.14 1.2040 8 1 4 8 80.30 2.06 1.1956 4 3 0 4 80.48 1.61 1.1933 9 1 1 8 80.75 2.45 1.1901 5 0 8 4 80.85 3.21 1.1889 4 3 1 8 80.94 6.17 1.1878 7 2 3 8 81.07 1.14 1.1862 1 3 4 8 81.11 3.67 1.1858 0 1 9 4 81.53 1.82 1.1807 3 0 9 4 82.60 3.15 1.1681 7 1 6 8 82.67 1.53 1.1672 2 3 4 8 82.78 1.73 1.1660 6 2 5 8 82.93 1.46 1.1642 5 2 6 8 84.33 1.63 1.1484 9 0 4 4 84.56 1.19 1.1459 8 2 1 8 84.78 3.94 1.1435 7 2 4 8 84.94 1.43 1.1418 0 2 8 4 85.13 1.63 1.1397 5 1 8 8 85.34 6.31 1.1374 3 3 4 8 85.47 3.20 1.1361 0 3 5 4 85.47 1.01 1.1360 1 2 8 8 85.65 1.19 1.1341 5 3 1 8 87.29 1.31 1.1170 5 3 2 8 87.88 1.28 1.1110 10 0 2 4 88.69 2.45 1.1029 9 1 4 8 88.78 2.02 1.1020 6 2 6 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.