Nuffieldite Moelo Y, Meerschaut A, Makovicky E The Canadian Mineralogist 35 (1997) 1497-1508 Refinement of the crystal structure of nuffieldite, Pb2Cu1.4(Pb.4Bi.4Sb.2)Bi2S7: Structural relationships and genesis of complex lead sulfosalt structures _database_code_amcsd 0005532 CELL PARAMETERS: 14.4949 21.4195 4.0420 90.000 90.000 90.000 SPACE GROUP: Pbnm X-RAY WAVELENGTH: 1.541838 Cell Volume: 1254.934 Density (g/cm3): 7.045 MAX. ABS. INTENSITY / VOLUME**2: 62.55935863 RIR: 2.891 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.21 11.73 7.2474 2 0 0 2 12.90 1.06 6.8651 2 1 0 4 16.55 1.62 5.3549 0 4 0 2 17.44 2.86 5.0862 2 3 0 4 18.83 2.17 4.7132 3 1 0 4 20.62 7.18 4.3068 2 4 0 4 21.63 6.45 4.1082 1 5 0 4 22.22 62.34 4.0015 3 3 0 4 22.84 1.15 3.8935 1 0 1 4 23.22 2.12 3.8307 1 1 1 8 23.53 12.40 3.7816 0 2 1 4 24.13 55.86 3.6878 2 5 0 4 24.32 60.38 3.6592 1 2 1 8 24.57 47.45 3.6237 4 0 0 2 24.92 43.18 3.5730 4 1 0 4 24.94 68.88 3.5699 0 6 0 2 25.57 34.72 3.4831 2 1 1 8 25.70 1.01 3.4663 1 6 0 4 25.96 6.51 3.4326 4 2 0 4 26.07 10.24 3.4182 1 3 1 8 26.59 27.98 3.3527 2 2 1 8 27.65 1.59 3.2261 0 4 1 4 27.83 13.04 3.2054 3 5 0 4 27.86 3.59 3.2025 2 6 0 4 28.20 100.00 3.1644 2 3 1 8 28.34 15.05 3.1491 1 4 1 8 28.80 5.72 3.1002 3 0 1 4 29.10 1.74 3.0682 3 1 1 8 29.77 11.79 3.0011 4 4 0 4 29.84 5.25 2.9939 1 7 0 4 30.01 49.41 2.9779 3 2 1 8 30.33 28.88 2.9473 2 4 1 8 31.04 44.99 2.8813 1 5 1 8 31.13 2.73 2.8728 5 1 0 4 31.15 2.82 2.8712 3 6 0 4 31.46 34.53 2.8437 3 3 1 8 31.74 8.87 2.8190 2 7 0 4 31.98 15.86 2.7983 5 2 0 4 32.36 31.84 2.7667 4 5 0 4 32.88 59.00 2.7243 2 5 1 8 33.36 3.10 2.6860 5 3 0 4 33.40 20.32 2.6830 3 4 1 8 33.47 2.49 2.6774 0 8 0 2 33.47 2.90 2.6770 4 1 1 8 33.49 15.05 2.6757 0 6 1 4 34.05 7.34 2.6329 1 8 0 4 34.70 1.44 2.5851 3 7 0 4 35.20 1.25 2.5494 5 4 0 4 35.29 29.95 2.5431 4 6 0 4 35.57 18.68 2.5239 4 3 1 8 35.75 3.39 2.5115 3 5 1 8 35.77 3.82 2.5101 2 6 1 8 37.38 15.08 2.4058 1 7 1 8 37.46 2.77 2.4009 5 5 0 4 37.46 3.05 2.4006 6 1 0 4 38.19 5.24 2.3566 6 2 0 4 38.20 7.53 2.3557 5 0 1 4 38.44 10.25 2.3416 5 1 1 8 38.46 2.70 2.3408 3 6 1 8 38.51 7.63 2.3379 4 7 0 4 38.95 4.08 2.3122 2 7 1 8 39.15 35.31 2.3007 5 2 1 8 39.37 2.94 2.2884 6 3 0 4 39.47 7.67 2.2831 4 5 1 8 39.87 1.50 2.2611 2 9 0 4 40.07 1.26 2.2504 5 6 0 4 40.32 1.47 2.2371 5 3 1 8 40.41 22.27 2.2321 0 8 1 4 40.91 14.06 2.2061 1 8 1 8 41.46 15.99 2.1778 3 7 1 8 41.90 10.55 2.1563 5 4 1 8 41.95 2.63 2.1534 4 8 0 4 41.97 2.54 2.1525 4 6 1 8 42.19 1.22 2.1420 0 10 0 2 42.33 2.53 2.1350 3 9 0 4 42.37 11.39 2.1333 2 8 1 8 42.98 1.14 2.1045 5 7 0 4 42.98 3.25 2.1043 6 5 0 4 44.09 4.94 2.0541 2 10 0 4 44.50 19.62 2.0359 6 2 1 8 44.57 7.14 2.0330 7 2 0 4 44.62 9.65 2.0306 1 9 1 8 44.72 2.81 2.0264 3 8 1 8 44.78 5.16 2.0238 4 7 1 8 44.85 52.98 2.0210 0 0 2 2 45.60 2.24 1.9893 4 9 0 4 45.62 9.64 1.9887 7 3 0 4 45.99 10.83 1.9734 2 9 1 8 46.15 15.28 1.9669 5 8 0 4 46.17 5.34 1.9662 5 6 1 8 46.99 7.58 1.9337 6 4 1 8 47.05 10.02 1.9313 7 4 0 4 47.98 5.21 1.8961 6 7 0 4 48.20 16.17 1.8878 3 9 1 8 48.40 30.07 1.8805 2 11 0 4 48.51 1.86 1.8767 1 10 1 8 48.79 16.64 1.8666 5 7 1 8 48.79 2.33 1.8665 6 5 1 8 49.56 6.75 1.8395 5 9 0 4 49.79 2.13 1.8312 2 10 1 8 49.84 1.24 1.8296 2 4 2 8 50.23 17.94 1.8162 7 2 1 8 50.32 1.31 1.8134 1 5 2 8 50.56 2.60 1.8054 8 1 0 4 50.60 12.32 1.8040 3 3 2 8 50.93 6.30 1.7931 6 6 1 8 51.13 1.38 1.7865 8 2 0 4 51.18 1.29 1.7848 4 9 1 8 51.57 13.19 1.7723 2 5 2 8 51.68 1.75 1.7686 5 8 1 8 51.80 10.70 1.7651 4 0 2 4 51.88 1.46 1.7623 3 10 1 8 51.98 10.12 1.7591 4 1 2 8 52.00 16.43 1.7587 0 6 2 4 52.08 2.02 1.7562 8 3 0 4 52.51 14.89 1.7426 7 4 1 8 52.55 1.19 1.7416 1 11 1 8 52.55 1.37 1.7416 4 2 2 8 52.82 1.29 1.7332 2 12 0 4 53.37 1.97 1.7166 6 7 1 8 53.42 2.24 1.7153 4 11 0 4 53.43 1.15 1.7149 7 7 0 4 53.61 3.64 1.7096 3 5 2 8 53.62 1.21 1.7091 2 6 2 8 53.76 8.13 1.7050 2 11 1 8 54.09 3.58 1.6954 6 9 0 4 54.76 3.31 1.6763 4 4 2 8 54.80 1.58 1.6751 1 7 2 8 54.83 3.04 1.6742 5 9 1 8 55.60 1.16 1.6529 5 1 2 8 55.77 8.48 1.6484 8 1 1 8 55.99 2.53 1.6425 2 7 2 8 56.10 3.41 1.6395 6 8 1 8 56.14 5.24 1.6384 5 2 2 8 56.15 1.12 1.6380 7 8 0 4 56.17 3.59 1.6376 7 6 1 8 56.19 3.31 1.6371 1 13 0 4 56.35 1.60 1.6328 0 12 1 4 56.38 11.06 1.6320 4 5 2 8 57.03 1.14 1.6149 5 3 2 8 57.37 2.37 1.6060 9 1 0 4 57.49 2.44 1.6032 1 8 2 8 57.50 2.14 1.6027 6 10 0 4 58.32 11.36 1.5822 4 6 2 8 58.77 1.77 1.5711 9 3 0 4 59.82 1.28 1.5461 5 5 2 8 59.82 1.24 1.5461 6 1 2 8 59.97 4.47 1.5425 8 5 1 8 59.98 3.37 1.5423 9 4 0 4 60.33 2.21 1.5341 6 2 2 8 60.51 1.98 1.5300 0 14 0 2 60.56 3.37 1.5289 4 7 2 8 60.89 2.78 1.5215 1 14 0 4 61.07 6.06 1.5174 1 13 1 8 61.13 1.43 1.5161 6 11 0 4 61.18 1.27 1.5148 6 3 2 8 62.20 8.82 1.4925 9 1 1 8 62.37 3.05 1.4888 7 10 0 4 62.38 1.08 1.4887 4 12 1 8 63.09 1.36 1.4736 4 8 2 8 63.37 1.42 1.4677 3 9 2 8 63.86 1.53 1.4576 6 5 2 8 63.88 3.97 1.4571 7 9 1 8 63.99 7.45 1.4549 3 13 1 8 64.65 2.41 1.4416 8 9 0 4 64.71 2.71 1.4406 2 10 2 8 65.08 4.16 1.4333 7 2 2 8 65.20 3.60 1.4309 0 14 1 4 65.49 2.33 1.4252 9 7 0 4 65.79 1.25 1.4195 6 11 1 8 65.88 1.19 1.4177 4 9 2 8 65.89 5.21 1.4175 7 3 2 8 66.16 1.05 1.4125 9 5 1 8 66.31 8.47 1.4095 5 8 2 8 66.32 1.50 1.4095 4 14 0 4 66.49 7.32 1.4062 4 13 1 8 66.62 1.72 1.4038 2 14 1 8 66.99 4.51 1.3970 7 10 1 8 67.03 6.20 1.3963 7 4 2 8 67.77 2.85 1.3828 6 7 2 8 68.11 18.00 1.3767 2 11 2 8 68.32 1.48 1.3730 10 5 0 4 69.04 4.23 1.3604 5 9 2 8 69.47 4.04 1.3531 5 14 0 4 69.48 3.38 1.3528 6 12 1 8 69.64 3.22 1.3502 5 13 1 8 69.86 1.58 1.3464 8 1 2 8 70.00 7.84 1.3441 9 7 1 8 70.32 1.11 1.3387 0 16 0 2 70.33 1.13 1.3385 7 11 1 8 70.62 2.37 1.3338 9 9 0 4 70.78 2.17 1.3311 1 2 3 8 71.12 1.36 1.3256 8 3 2 8 71.34 1.21 1.3221 2 1 3 8 71.77 3.12 1.3152 11 1 0 4 71.81 1.33 1.3146 2 2 3 8 72.18 1.26 1.3088 8 10 1 8 72.24 1.63 1.3078 4 11 2 8 72.59 5.50 1.3024 2 3 3 8 72.81 2.39 1.2989 6 9 2 8 72.94 1.91 1.2970 3 15 1 8 73.50 2.52 1.2884 3 2 3 8 73.58 1.34 1.2873 9 10 0 4 73.67 1.59 1.2859 2 4 3 8 73.92 8.86 1.2822 7 12 1 8 74.00 1.31 1.2810 5 15 0 4 74.05 2.41 1.2802 1 5 3 8 74.10 1.67 1.2795 11 4 0 4 74.28 1.84 1.2769 3 3 3 8 74.44 5.47 1.2745 10 6 1 8 74.60 2.42 1.2721 1 13 2 8 74.69 1.16 1.2708 0 16 1 4 75.03 2.20 1.2660 1 16 1 8 75.06 3.44 1.2655 2 5 3 8 75.35 1.23 1.2613 3 4 3 8 75.63 1.89 1.2574 9 1 2 8 75.74 1.59 1.2558 6 10 2 8 76.11 1.61 1.2507 11 1 1 8 76.62 1.64 1.2436 4 3 3 8 76.78 2.91 1.2414 2 17 0 4 76.85 1.40 1.2404 9 3 2 8 77.68 1.16 1.2293 6 15 0 4 77.70 2.70 1.2290 3 16 1 8 77.72 1.16 1.2287 1 7 3 8 77.75 1.29 1.2283 7 13 1 8 77.92 2.56 1.2261 9 4 2 8 78.39 2.27 1.2199 11 4 1 8 78.39 1.53 1.2198 0 14 2 4 78.39 1.06 1.2198 5 1 3 8 78.72 2.11 1.2155 1 14 2 8 78.85 3.04 1.2139 5 2 3 8 78.94 1.06 1.2128 6 11 2 8 79.66 2.56 1.2035 0 8 3 4 79.75 1.69 1.2025 11 5 1 8 79.99 1.36 1.1994 1 8 3 8 80.01 1.89 1.1992 4 16 1 8 80.06 2.74 1.1986 7 10 2 8 80.37 1.54 1.1948 3 7 3 8 80.66 1.09 1.1912 5 4 3 8 80.98 1.28 1.1873 2 8 3 8 82.12 2.07 1.1736 8 9 2 8 82.46 2.26 1.1697 6 2 3 8 82.67 2.30 1.1673 3 17 1 8 82.89 2.08 1.1647 9 7 2 8 83.35 1.47 1.1594 11 7 1 8 83.53 1.52 1.1574 2 9 3 8 83.65 1.29 1.1561 4 14 2 8 84.13 1.92 1.1506 12 2 1 8 85.16 2.01 1.1394 3 9 3 8 85.50 1.35 1.1357 10 5 2 8 85.59 2.47 1.1347 5 7 3 8 85.92 3.68 1.1312 12 4 1 8 86.57 3.72 1.1244 5 14 2 8 86.70 2.73 1.1231 7 2 3 8 87.38 1.08 1.1161 0 16 2 4 87.66 2.38 1.1132 9 9 2 8 87.88 2.11 1.1109 3 18 1 8 88.21 1.60 1.1076 9 13 1 8 88.48 2.44 1.1050 7 4 3 8 88.75 3.06 1.1024 11 1 2 8 89.48 1.43 1.0952 2 11 3 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.