Paderaite Topa D, Makovicky E The Canadian Mineralogist 44 (2006) 481-495 The crystal structure of paderaite, Cu7(X0.33Pb1.33Bi11.33)Sum13S22, with X = Cu or Ag: New data and interpretation Locality: Bihor, Romania _database_code_amcsd 0006087 CELL PARAMETERS: 17.5850 3.9386 28.4530 90.000 105.410 90.000 SPACE GROUP: P2_1/m X-RAY WAVELENGTH: 1.541838 Cell Volume: 1899.815 Density (g/cm3): 6.696 MAX. ABS. INTENSITY / VOLUME**2: 63.29146766 RIR: 3.078 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 3.22 1.23 27.4301 0 0 1 2 6.44 8.93 13.7150 0 0 2 2 6.82 2.08 12.9625 1 0 1 2 9.31 1.59 9.4995 1 0 2 2 9.67 1.58 9.1434 0 0 3 2 9.69 2.00 9.1240 -1 0 3 2 11.72 1.78 7.5522 2 0 1 2 13.66 1.42 6.4813 2 0 2 2 14.29 22.01 6.1970 -2 0 4 2 16.16 3.04 5.4860 0 0 5 2 16.75 3.92 5.2914 -2 0 5 2 16.84 2.07 5.2651 3 0 1 2 17.48 3.93 5.0724 -3 0 4 2 18.27 5.54 4.8553 1 0 5 2 18.50 1.92 4.7952 3 0 2 2 18.68 2.43 4.7498 2 0 4 2 19.32 3.12 4.5932 -3 0 5 2 19.46 1.17 4.5620 -2 0 6 2 20.22 7.36 4.3918 -4 0 2 2 20.33 5.56 4.3673 -4 0 1 2 20.96 3.52 4.2382 4 0 0 2 21.43 6.43 4.1457 1 0 6 2 21.51 6.43 4.1319 2 0 5 2 21.88 2.58 4.0621 -1 0 7 2 22.06 14.20 4.0300 4 0 1 2 22.32 12.20 3.9828 -2 0 7 2 22.69 10.22 3.9186 0 0 7 2 22.81 1.62 3.8986 0 1 1 4 23.22 1.31 3.8312 -1 1 1 4 23.50 1.60 3.7856 0 1 2 4 23.56 1.74 3.7761 4 0 2 2 23.61 7.80 3.7685 1 1 1 4 23.95 8.04 3.7155 -3 0 7 2 24.47 4.46 3.6383 1 1 2 4 24.56 70.84 3.6252 -4 0 6 2 24.62 24.08 3.6161 -1 1 3 4 24.77 1.49 3.5938 -2 1 1 4 25.09 2.74 3.5489 -1 0 8 2 25.40 8.11 3.5061 4 0 3 2 25.51 7.89 3.4922 2 1 1 4 25.60 11.51 3.4794 -5 0 1 2 25.72 1.79 3.4641 1 1 3 4 25.74 1.58 3.4609 -2 1 3 4 26.28 21.65 3.3906 5 0 0 2 26.48 16.81 3.3658 2 1 2 4 26.56 1.29 3.3559 -4 0 7 2 26.58 3.90 3.3530 -3 0 8 2 26.82 1.66 3.3240 -2 1 4 4 27.30 30.23 3.2672 -3 1 1 4 27.35 4.00 3.2611 5 0 1 2 27.38 11.09 3.2575 -3 1 2 4 27.50 47.07 3.2437 2 0 7 2 27.52 9.69 3.2406 4 0 4 2 27.56 25.15 3.2367 -1 1 5 4 27.61 24.88 3.2312 3 1 0 4 27.81 8.31 3.2075 2 1 3 4 27.85 2.52 3.2033 -3 1 3 4 27.88 1.55 3.1996 1 0 8 2 27.89 1.65 3.1994 0 1 5 4 28.30 29.64 3.1538 3 1 1 4 28.36 16.88 3.1466 -2 0 9 2 28.75 2.12 3.1049 5 0 2 2 29.30 3.83 3.0478 0 0 9 2 29.35 24.69 3.0436 3 1 2 4 29.46 4.24 3.0318 2 1 4 4 29.48 100.00 3.0299 -1 1 6 4 29.87 2.00 2.9913 4 0 5 2 29.88 1.41 2.9899 -3 1 5 4 29.95 1.60 2.9839 0 1 6 4 30.46 3.29 2.9349 5 0 3 2 30.53 14.82 2.9279 -6 0 3 2 30.61 1.32 2.9202 2 0 8 2 30.86 1.27 2.8977 -6 0 4 2 30.94 20.51 2.8900 -6 0 1 2 31.04 2.05 2.8815 3 0 7 2 31.33 9.00 2.8554 1 1 6 4 31.38 4.35 2.8509 2 1 5 4 31.39 1.19 2.8500 -4 1 4 4 31.64 35.96 2.8277 -1 1 7 4 31.77 1.30 2.8168 4 1 1 4 31.96 2.36 2.8005 -2 1 7 4 32.27 1.12 2.7742 -3 0 10 2 32.34 1.80 2.7681 -4 1 5 4 32.37 18.19 2.7654 3 1 4 4 32.40 4.36 2.7635 4 0 6 2 32.65 3.17 2.7430 0 0 10 2 32.71 25.37 2.7374 6 0 1 2 32.86 2.03 2.7257 4 1 2 4 33.52 3.09 2.6732 2 1 6 4 33.60 1.01 2.6673 -4 1 6 4 33.88 4.45 2.6457 -4 0 10 2 34.00 31.25 2.6365 -1 1 8 4 34.16 4.12 2.6247 -2 1 8 4 34.24 2.19 2.6188 4 1 3 4 34.39 5.28 2.6076 -5 1 1 4 34.69 2.08 2.5861 0 1 8 4 34.73 8.08 2.5832 -5 1 4 4 34.92 7.35 2.5696 5 1 0 4 35.39 4.50 2.5362 -6 0 8 2 35.47 12.29 2.5310 -5 1 5 4 35.75 1.54 2.5118 5 1 1 4 35.89 1.05 2.5025 4 1 4 4 36.02 1.74 2.4936 0 0 11 2 36.41 2.00 2.4678 3 1 6 4 36.50 2.37 2.4617 -5 1 6 4 36.53 2.47 2.4595 -1 1 9 4 36.55 1.85 2.4584 -2 1 9 4 36.86 6.68 2.4383 5 1 2 4 37.03 1.05 2.4276 2 0 10 2 37.36 2.48 2.4072 -3 1 9 4 37.80 1.43 2.3798 -5 1 7 4 37.88 1.45 2.3749 4 0 8 2 38.24 3.51 2.3534 5 1 3 4 38.31 4.14 2.3497 -6 1 3 4 38.33 1.17 2.3484 -6 1 2 4 38.57 5.17 2.3340 -6 1 4 4 39.21 4.07 2.2977 -1 1 10 4 39.23 7.20 2.2966 -6 0 10 2 39.74 1.32 2.2680 -3 1 10 4 39.85 6.80 2.2622 4 1 6 4 39.96 7.10 2.2563 -6 1 6 4 41.05 5.39 2.1987 -6 1 7 4 41.09 3.10 2.1968 -8 0 3 2 41.14 6.41 2.1944 -5 1 9 4 41.20 4.25 2.1912 3 1 8 4 41.25 22.95 2.1884 -2 0 13 2 41.35 1.96 2.1836 -8 0 2 2 41.40 1.45 2.1811 -8 0 5 2 41.44 1.13 2.1788 -6 0 11 2 41.61 4.12 2.1704 1 1 10 4 41.71 4.78 2.1655 5 1 5 4 41.88 2.47 2.1573 -8 0 1 2 42.12 2.38 2.1454 4 1 7 4 42.74 1.86 2.1157 -7 0 10 2 42.82 3.23 2.1118 -7 1 4 4 42.83 1.20 2.1116 -7 1 2 4 43.12 3.02 2.0979 -5 1 10 4 43.22 4.12 2.0934 -7 1 5 4 43.71 1.10 2.0710 8 0 1 2 43.75 6.13 2.0691 5 1 6 4 43.82 13.61 2.0660 3 1 9 4 43.87 1.34 2.0637 -7 1 6 4 43.89 1.84 2.0630 7 1 0 4 43.96 4.45 2.0599 -6 1 9 4 44.55 2.11 2.0338 4 1 8 4 44.61 1.43 2.0314 -2 1 12 4 44.61 3.29 2.0311 -2 0 14 2 44.78 7.58 2.0241 -7 1 7 4 44.92 1.81 2.0178 -1 1 12 4 44.96 9.15 2.0161 -3 1 12 4 45.29 1.01 2.0024 -5 1 11 4 45.73 2.73 1.9840 -6 1 10 4 45.90 2.65 1.9770 0 1 12 4 45.92 13.24 1.9763 -7 1 8 4 45.97 14.18 1.9742 5 1 7 4 46.03 1.05 1.9717 6 1 5 4 46.09 44.47 1.9693 0 2 0 2 46.34 3.31 1.9593 0 0 14 2 46.36 3.41 1.9584 -6 0 13 2 46.64 1.83 1.9476 -9 0 5 2 46.70 1.03 1.9450 2 1 11 4 46.78 4.84 1.9419 6 0 8 2 46.89 1.38 1.9377 7 0 6 2 46.93 1.10 1.9361 4 0 11 2 47.04 4.02 1.9318 -9 0 6 2 47.13 5.51 1.9283 4 1 9 4 47.29 4.64 1.9223 -7 1 9 4 47.31 10.53 1.9212 7 1 3 4 47.39 2.91 1.9185 -8 1 3 4 47.40 1.53 1.9180 -8 1 4 4 47.51 2.05 1.9137 1 1 12 4 47.62 4.56 1.9098 -8 1 2 4 47.62 12.36 1.9095 -5 1 12 4 47.77 2.07 1.9041 -3 1 13 4 48.03 2.87 1.8943 -2 0 15 2 48.20 4.57 1.8881 8 0 4 2 48.35 4.77 1.8824 5 1 8 4 48.51 1.95 1.8768 -2 2 4 4 48.63 2.50 1.8721 -4 1 13 4 48.80 2.06 1.8661 8 1 0 4 48.97 1.30 1.8599 0 1 13 4 49.16 2.44 1.8534 -7 0 13 2 49.20 2.99 1.8518 7 0 7 2 49.74 2.46 1.8330 8 1 1 4 49.84 1.51 1.8295 4 1 10 4 50.00 1.17 1.8242 3 0 13 2 50.12 2.74 1.8199 4 0 12 2 50.52 1.30 1.8065 2 0 14 2 50.61 13.36 1.8036 1 1 13 4 50.64 4.13 1.8025 -7 1 11 4 50.81 1.14 1.7969 -4 2 2 4 50.86 1.02 1.7952 -4 2 1 4 51.05 1.28 1.7890 -1 1 14 4 51.37 1.30 1.7788 1 2 6 4 51.40 1.29 1.7777 2 2 5 4 51.42 3.30 1.7771 -4 1 14 4 51.66 2.84 1.7693 4 2 1 4 51.79 2.43 1.7653 -2 2 7 4 51.84 1.33 1.7638 -6 0 15 2 51.97 1.99 1.7596 0 2 7 4 52.27 3.61 1.7503 -9 1 4 4 52.28 2.42 1.7500 8 1 3 4 52.29 1.88 1.7494 6 0 10 2 52.35 1.24 1.7477 -9 1 3 4 52.60 1.77 1.7400 -3 2 7 4 52.61 1.29 1.7397 -10 0 2 2 52.64 1.76 1.7387 7 1 6 4 52.66 3.71 1.7380 -9 1 2 4 52.78 6.34 1.7344 -9 1 6 4 52.91 15.73 1.7305 -4 2 6 4 53.20 2.68 1.7217 -9 1 1 4 53.24 1.02 1.7204 -10 0 1 2 53.36 1.99 1.7170 4 2 3 4 53.38 2.40 1.7164 -9 1 7 4 53.45 3.11 1.7144 0 0 16 2 53.46 2.66 1.7138 -5 2 1 4 53.55 1.09 1.7112 5 1 10 4 53.80 1.05 1.7039 1 1 14 4 53.84 5.56 1.7029 5 2 0 4 54.19 1.05 1.6925 -9 1 8 4 54.26 1.08 1.6907 -1 1 15 4 54.28 1.16 1.6899 7 0 9 2 54.43 1.09 1.6858 5 2 1 4 54.50 4.58 1.6837 -10 0 9 2 54.51 13.23 1.6834 2 2 7 4 54.53 2.73 1.6829 4 2 4 4 54.70 4.30 1.6779 -8 0 14 2 54.78 3.53 1.6758 7 1 7 4 55.01 4.43 1.6693 -2 2 9 4 55.23 2.46 1.6632 6 0 11 2 55.27 1.15 1.6619 -4 0 17 2 55.50 1.10 1.6557 -5 1 15 4 55.56 1.02 1.6541 0 2 9 4 55.65 1.12 1.6517 -10 0 10 2 56.30 4.44 1.6341 -6 2 3 4 56.45 1.16 1.6301 -9 1 10 4 56.55 6.11 1.6274 -6 2 1 4 56.76 3.93 1.6219 4 0 14 2 56.84 1.14 1.6197 -3 1 16 4 56.89 1.60 1.6184 3 0 15 2 57.46 1.31 1.6037 4 2 6 4 57.62 1.14 1.5998 2 0 16 2 57.66 8.25 1.5986 6 2 1 4 57.88 2.06 1.5932 -9 1 11 4 58.42 1.39 1.5797 -4 2 10 4 58.68 1.22 1.5733 -4 0 18 2 59.42 1.62 1.5555 -6 2 8 4 59.68 1.86 1.5492 -8 0 16 2 60.07 1.25 1.5401 -3 1 17 4 60.78 1.15 1.5239 0 0 18 2 61.12 1.39 1.5163 11 0 1 2 62.09 3.31 1.4950 -6 2 10 4 62.12 2.39 1.4943 7 1 10 4 62.39 1.37 1.4885 -8 0 17 2 63.03 1.06 1.4749 -11 1 3 4 63.44 1.64 1.4664 -8 2 3 4 63.56 2.61 1.4639 -10 1 12 4 63.56 11.26 1.4638 -2 2 13 4 63.63 1.15 1.4624 -8 2 2 4 64.02 1.10 1.4544 -8 2 1 4 64.49 4.92 1.4450 -12 0 2 2 65.20 1.14 1.4308 -10 1 13 4 66.09 1.82 1.4138 -2 2 14 4 66.33 2.53 1.4093 6 1 13 4 66.46 1.54 1.4067 -10 0 16 2 66.84 8.40 1.3997 -3 1 19 4 67.43 1.87 1.3890 0 2 14 4 67.44 1.96 1.3886 -6 2 13 4 67.66 1.07 1.3848 -9 2 5 4 67.66 3.85 1.3847 -7 1 18 4 67.77 2.61 1.3827 6 2 8 4 67.98 2.35 1.3790 -9 2 6 4 67.99 2.17 1.3788 -1 1 19 4 68.40 1.41 1.3715 0 0 20 2 68.62 1.19 1.3676 -12 1 7 4 68.66 1.11 1.3670 11 1 3 4 68.76 1.63 1.3652 -2 2 15 4 68.90 2.75 1.3629 8 2 4 4 69.02 1.14 1.3608 -10 1 15 4 69.08 1.54 1.3597 -12 1 8 4 69.67 1.45 1.3497 -7 2 13 4 69.70 1.84 1.3490 7 2 7 4 70.25 2.88 1.3399 11 1 4 4 70.29 1.78 1.3393 10 1 7 4 70.45 1.82 1.3366 4 2 12 4 71.19 2.26 1.3246 -11 1 14 4 72.02 1.87 1.3113 11 1 5 4 72.05 3.69 1.3107 9 1 10 4 72.13 3.96 1.3095 5 1 16 4 72.23 1.25 1.3079 6 2 10 4 72.54 1.51 1.3031 10 1 8 4 72.85 2.78 1.2983 -8 1 19 4 73.04 1.72 1.2954 -11 1 15 4 73.20 1.91 1.2930 0 2 16 4 73.45 1.49 1.2893 2 1 19 4 74.00 1.46 1.2810 -3 3 1 4 74.03 1.76 1.2805 -3 1 21 4 74.08 3.14 1.2797 -10 2 9 4 74.12 1.32 1.2791 -1 3 5 4 74.15 1.10 1.2788 3 3 0 4 74.26 3.02 1.2772 -8 2 14 4 74.30 2.97 1.2766 -13 1 7 4 74.48 1.38 1.2739 3 3 1 4 74.66 2.16 1.2713 -13 1 8 4 74.70 1.73 1.2707 6 2 11 4 75.01 1.34 1.2663 3 3 2 4 75.08 4.90 1.2653 -1 3 6 4 75.77 1.31 1.2554 10 0 11 2 75.93 1.52 1.2531 -13 1 10 4 76.02 2.92 1.2519 4 2 14 4 76.08 1.52 1.2510 -13 1 1 4 76.13 1.18 1.2504 3 2 15 4 76.21 2.05 1.2492 -1 3 7 4 76.61 1.23 1.2437 3 3 4 4 77.53 2.27 1.2313 -1 3 8 4 78.38 1.16 1.2200 -5 3 5 4 78.56 1.48 1.2176 -8 2 16 4 79.83 1.15 1.2014 11 2 1 4 80.05 3.69 1.1987 3 1 20 4 80.97 1.09 1.1874 -8 2 17 4 81.46 1.19 1.1815 -9 1 21 4 82.86 4.30 1.1650 -12 2 2 4 83.15 2.05 1.1617 -14 0 15 2 83.77 1.61 1.1547 3 3 9 4 84.57 1.32 1.1458 -3 3 12 4 84.67 1.44 1.1447 -10 2 16 4 84.68 2.27 1.1446 -9 1 22 4 85.26 1.76 1.1383 -7 3 8 4 85.29 1.78 1.1379 5 3 7 4 86.27 1.65 1.1275 7 3 3 4 86.47 1.41 1.1255 0 2 20 4 86.50 1.79 1.1251 -5 3 12 4 88.76 2.23 1.1022 1 3 13 4 89.08 1.17 1.0991 11 1 12 4 89.86 1.38 1.0916 -5 1 25 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.