Kobellite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R070669 Miehe G Nature Physical Science 231 (1971) 133-134 Crystal structure of kobellite Locality: Korunka mine, Spissko-Gemerske Rudohorie Mountains, Czechoslovakia _database_code_amcsd 0014683 CELL PARAMETERS: 22.4920 34.0500 4.0230 90.000 90.000 90.000 SPACE GROUP: Pnnm ATOM X Y Z OCCUPANCY ISO(B) Cu 0.13070 0.33540 0.50000 0.444 3.500 Fe 0.13070 0.33540 0.50000 0.556 3.500 Pb 0.27360 0.03520 0.50000 1.000 2.700 Pb 0.15560 0.13220 0.50000 1.000 3.100 Pb 0.06390 0.24660 0.50000 1.000 2.800 Pb 0.26750 0.37200 0.00000 1.000 3.800 Pb 0.45820 0.36210 0.00000 1.000 2.800 Pb 0.11390 0.43820 0.00000 1.000 3.500 Bi 0.05270 0.04510 0.00000 0.333 2.400 Sb 0.05270 0.04510 0.00000 0.667 2.400 Bi 0.43810 0.04400 0.00000 0.833 2.400 Sb 0.43810 0.04400 0.00000 0.167 2.400 Bi 0.32680 0.14040 0.00000 0.556 2.000 Sb 0.32680 0.14040 0.00000 0.444 2.000 Bi 0.48730 0.15020 0.50000 0.667 2.500 Sb 0.48730 0.15020 0.50000 0.333 2.500 Bi 0.23390 0.24120 0.00000 0.556 1.900 Sb 0.23390 0.24120 0.00000 0.444 1.900 Bi 0.39500 0.25510 0.50000 0.500 2.000 Sb 0.39500 0.25510 0.50000 0.500 2.000 Bi 0.36690 0.45470 0.50000 0.500 2.600 Sb 0.36690 0.45470 0.50000 0.500 2.600 S 0.50000 0.00000 0.50000 1.000 1.800 S 0.13280 0.04590 0.50000 1.000 2.100 S 0.37810 0.08540 0.50000 1.000 1.100 S 0.23700 0.09530 0.00000 1.000 1.200 S 0.05400 0.11800 0.00000 1.000 1.200 S 0.13890 0.20240 0.00000 1.000 1.000 S 0.28380 0.18220 0.50000 1.000 1.500 S 0.44930 0.19970 0.00000 1.000 1.500 S 0.48900 0.29410 0.50000 1.000 1.100 S 0.35380 0.29650 0.00000 1.000 1.400 S 0.20770 0.28730 0.50000 1.000 1.700 S 0.08740 0.31580 0.00000 1.000 1.300 S 0.03330 0.40090 0.50000 1.000 2.300 S 0.18710 0.39140 0.50000 1.000 1.100 S 0.36690 0.38140 0.50000 1.000 1.700 S 0.28460 0.44990 0.00000 1.000 1.300 S 0.45750 0.44820 0.00000 1.000 1.000 S 0.15320 0.49540 0.50000 1.000 2.100 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 20 +/- 31 +/- 3 MAX. ABS. INTENSITY / VOLUME**2: 46.74976165 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 5.19 1.82 17.0250 0 2 0 6.51 1.10 13.5747 1 2 0 7.86 2.08 11.2460 2 0 0 8.73 3.03 10.1329 1 3 0 10.39 1.33 8.5125 0 4 0 11.08 2.40 7.9886 2 3 0 13.04 1.19 6.7873 2 4 0 13.59 1.31 6.5178 1 5 0 14.16 2.13 6.2557 3 3 0 15.61 5.85 5.6750 0 6 0 16.11 1.47 5.5026 1 6 0 16.60 2.68 5.3393 4 2 0 18.91 2.38 4.6918 4 4 0 19.62 6.08 4.5249 3 6 0 19.89 3.12 4.4646 2 7 0 20.42 2.34 4.3491 5 2 0 20.48 7.55 4.3359 4 5 0 20.87 15.04 4.2562 0 8 0 21.25 4.61 4.1820 1 8 0 22.25 5.00 3.9952 0 1 1 22.26 4.93 3.9943 4 6 0 22.33 5.24 3.9807 2 8 0 22.35 28.20 3.9772 5 4 0 22.60 2.15 3.9336 1 1 1 23.06 5.78 3.8572 1 2 1 23.46 11.07 3.7919 0 3 1 23.63 12.20 3.7647 2 1 1 23.70 3.28 3.7534 5 5 0 23.74 4.34 3.7487 6 0 0 23.80 1.49 3.7391 1 3 1 23.85 9.35 3.7309 1 9 0 23.88 1.50 3.7262 6 1 0 24.07 9.26 3.6975 2 2 1 24.78 29.79 3.5931 2 3 1 24.80 6.89 3.5906 1 4 1 24.83 6.89 3.5859 2 9 0 25.02 32.84 3.5595 6 3 0 25.26 20.36 3.5258 3 1 1 25.26 100.00 3.5252 5 6 0 25.67 2.81 3.4705 3 2 1 25.72 6.79 3.4638 0 5 1 25.74 12.54 3.4608 2 4 1 25.97 37.96 3.4307 6 4 0 26.03 4.71 3.4234 1 5 1 26.17 76.71 3.4050 0 10 0 26.26 8.60 3.3937 4 8 0 26.34 54.19 3.3837 3 3 1 26.47 4.30 3.3666 1 10 0 27.00 4.44 3.3026 5 7 0 27.15 21.52 3.2840 6 5 0 27.25 43.99 3.2725 3 4 1 27.37 4.75 3.2589 2 10 0 27.38 12.40 3.2568 4 1 1 27.46 1.17 3.2476 1 6 1 27.77 6.48 3.2130 4 2 1 27.89 1.12 3.1989 7 1 0 28.26 10.81 3.1574 7 2 0 28.33 2.36 3.1506 2 6 1 28.39 2.19 3.1438 4 3 1 28.54 25.64 3.1279 6 6 0 28.80 1.33 3.1002 3 10 0 28.80 14.75 3.1001 0 7 1 28.88 1.27 3.0917 5 8 0 28.88 4.43 3.0916 7 3 0 29.08 3.12 3.0711 1 7 1 29.12 9.52 3.0665 1 11 0 29.24 1.14 3.0540 4 4 1 29.71 29.80 3.0065 3 6 1 29.79 3.14 2.9987 5 0 1 29.90 5.09 2.9886 2 7 1 29.91 13.64 2.9872 5 1 1 30.10 17.91 2.9692 6 7 0 30.31 1.31 2.9491 4 5 1 30.77 2.98 2.9059 7 5 0 30.84 17.72 2.8993 1 8 1 30.84 31.71 2.8992 5 3 1 31.22 91.32 2.8649 3 7 1 31.53 11.74 2.8375 0 12 0 31.56 40.78 2.8345 4 6 1 31.62 2.58 2.8296 2 8 1 31.63 6.03 2.8284 5 4 1 31.83 1.05 2.8115 8 0 0 32.54 1.22 2.7513 2 12 0 32.88 8.75 2.7239 3 8 1 32.99 1.02 2.7149 5 10 0 32.99 29.27 2.7148 4 7 1 33.08 43.16 2.7077 6 2 1 33.42 3.28 2.6810 7 7 0 33.48 1.11 2.6768 2 9 1 33.66 1.00 2.6629 6 9 0 33.81 5.52 2.6513 5 6 1 34.35 13.69 2.6104 6 4 1 34.47 2.34 2.6016 1 13 0 34.58 5.50 2.5940 4 8 1 34.68 9.18 2.5868 3 9 1 34.99 3.65 2.5644 7 8 0 35.62 3.55 2.5205 6 10 0 35.76 2.11 2.5106 7 0 1 36.03 3.01 2.4924 9 1 0 36.30 1.34 2.4748 4 9 1 36.85 1.15 2.4388 1 11 1 36.96 1.03 2.4321 0 14 0 37.18 1.84 2.4180 1 14 0 38.30 12.11 2.3501 5 9 1 38.61 9.33 2.3316 3 11 1 38.93 2.45 2.3135 3 14 0 39.07 7.18 2.3054 6 8 1 39.18 13.36 2.2992 8 1 1 39.24 1.54 2.2960 7 6 1 39.46 1.30 2.2837 8 2 1 39.69 8.01 2.2710 2 12 1 40.09 5.44 2.2492 10 0 0 40.10 5.85 2.2486 4 11 1 40.18 1.61 2.2443 10 1 0 40.43 5.90 2.2310 7 7 1 41.33 7.41 2.1846 1 13 1 41.36 1.25 2.1829 8 5 1 41.94 31.03 2.1544 2 13 1 41.95 1.18 2.1538 5 11 1 42.08 10.86 2.1471 6 13 0 42.15 4.14 2.1436 4 12 1 42.24 1.26 2.1395 5 14 0 42.32 7.88 2.1359 6 10 1 42.48 2.82 2.1281 0 16 0 42.50 3.37 2.1269 7 12 0 42.59 33.79 2.1229 9 0 1 42.93 11.99 2.1066 3 13 1 42.93 1.05 2.1065 9 2 1 43.25 4.80 2.0919 7 9 1 43.36 6.19 2.0867 9 3 1 43.39 2.34 2.0852 9 9 0 43.48 2.25 2.0812 8 11 0 43.93 1.42 2.0611 5 12 1 43.96 1.93 2.0598 9 4 1 44.26 4.10 2.0466 2 14 1 44.38 4.02 2.0411 11 1 0 44.40 12.41 2.0403 6 14 0 44.63 9.56 2.0302 7 13 0 44.63 3.54 2.0301 11 2 0 44.72 1.92 2.0266 5 15 0 44.85 1.88 2.0207 7 10 1 45.05 3.81 2.0123 11 3 0 45.07 54.76 2.0115 0 0 2 45.21 9.90 2.0055 3 14 1 45.58 2.11 1.9903 4 16 0 45.62 1.32 1.9886 10 8 0 45.63 1.47 1.9883 9 6 1 45.63 1.72 1.9882 11 4 0 45.90 7.05 1.9770 0 15 1 46.01 7.06 1.9727 5 13 1 46.03 5.15 1.9720 6 12 1 46.12 3.11 1.9681 8 9 1 46.32 2.44 1.9600 10 1 1 46.36 1.41 1.9584 11 5 0 46.57 11.47 1.9503 10 2 1 46.69 7.11 1.9456 9 7 1 46.78 1.43 1.9417 6 15 0 46.85 2.47 1.9392 7 14 0 46.97 4.64 1.9345 10 3 1 47.00 2.77 1.9333 10 9 0 47.25 13.77 1.9237 5 16 0 47.25 1.01 1.9237 11 6 0 47.53 2.03 1.9130 10 4 1 47.65 5.28 1.9085 8 10 1 47.88 3.13 1.8997 9 8 1 48.10 2.55 1.8917 0 18 0 48.17 1.47 1.8890 5 14 1 48.28 1.89 1.8850 11 7 0 48.51 1.49 1.8767 10 10 0 48.65 2.59 1.8715 12 1 0 48.89 1.77 1.8631 12 2 0 49.10 1.98 1.8553 10 6 1 49.23 1.33 1.8507 6 16 0 49.27 6.46 1.8493 12 3 0 49.30 2.51 1.8485 8 11 1 49.84 1.49 1.8298 5 17 0 49.98 1.00 1.8247 4 5 2 50.11 2.68 1.8205 10 7 1 50.12 1.32 1.8202 11 1 1 50.13 4.03 1.8197 6 14 1 50.16 2.38 1.8186 0 8 2 50.35 2.68 1.8124 11 2 1 50.42 5.60 1.8099 5 15 1 50.67 15.82 1.8014 9 10 1 50.87 4.90 1.7950 5 4 2 51.10 1.38 1.7873 1 17 1 51.13 1.44 1.7864 1 19 0 51.21 5.08 1.7840 4 16 1 51.25 2.92 1.7827 10 8 1 51.26 2.72 1.7824 11 4 1 51.62 1.73 1.7706 1 9 2 51.65 2.87 1.7698 2 19 0 51.76 1.16 1.7662 8 15 0 51.87 4.13 1.7626 10 12 0 52.14 1.48 1.7543 2 9 2 52.24 6.67 1.7512 6 3 2 52.31 5.07 1.7490 12 7 0 52.37 20.43 1.7471 5 6 2 52.47 5.49 1.7438 3 17 1 52.48 2.03 1.7438 5 18 0 52.51 4.93 1.7426 10 9 1 52.74 4.76 1.7355 5 16 1 52.75 8.74 1.7352 6 4 2 52.86 17.21 1.7319 0 10 2 52.91 1.69 1.7304 4 8 2 52.92 1.03 1.7302 8 13 1 53.03 1.06 1.7268 1 10 2 53.33 1.05 1.7179 5 7 2 53.41 2.49 1.7154 12 8 0 53.42 5.06 1.7153 6 5 2 53.54 1.12 1.7117 2 10 2 53.65 1.34 1.7083 4 17 1 53.70 2.07 1.7069 1 18 1 53.73 4.23 1.7061 11 11 0 53.85 2.82 1.7025 0 20 0 53.91 4.09 1.7008 10 10 1 54.02 3.98 1.6976 1 20 0 54.06 2.58 1.6965 7 2 2 54.22 6.53 1.6919 6 6 2 54.42 1.20 1.6860 7 3 2 54.51 3.07 1.6833 2 20 0 54.56 2.23 1.6819 1 11 2 54.58 1.03 1.6813 6 16 1 54.65 1.37 1.6795 12 9 0 54.79 1.16 1.6756 11 8 1 55.15 4.75 1.6653 6 7 2 55.38 1.38 1.6589 11 12 0 55.53 2.10 1.6550 13 6 0 56.04 3.26 1.6410 0 12 2 56.19 2.15 1.6370 0 19 1 56.94 1.03 1.6172 8 15 1 57.48 2.74 1.6033 12 11 0 58.30 1.25 1.5827 7 8 2 58.73 1.25 1.5722 6 10 2 59.01 1.02 1.5653 9 1 2 60.76 1.10 1.5243 12 13 0 60.99 1.17 1.5193 11 15 0 61.88 2.20 1.4994 10 0 2 62.29 1.08 1.4906 2 21 1 62.55 1.10 1.4849 10 15 1 63.36 4.77 1.4679 6 13 2 63.65 1.20 1.4618 0 16 2 63.67 1.46 1.4614 7 12 2 63.81 3.04 1.4586 7 19 1 63.81 2.04 1.4586 11 14 1 63.90 1.91 1.4568 9 17 1 64.35 1.01 1.4477 9 9 2 64.41 1.11 1.4465 6 20 1 64.59 1.44 1.4430 14 6 1 65.11 1.91 1.4327 11 1 2 65.12 6.12 1.4324 6 14 2 65.30 4.64 1.4289 7 13 2 65.30 1.66 1.4289 11 2 2 65.44 2.46 1.4263 5 21 1 65.63 1.86 1.4226 11 3 2 65.83 1.01 1.4187 0 24 0 66.03 1.05 1.4148 4 16 2 66.17 4.16 1.4123 9 18 1 66.34 1.59 1.4091 7 20 1 66.62 1.30 1.4038 15 1 1 67.04 1.20 1.3961 7 14 2 67.13 2.90 1.3944 15 3 1 67.16 1.26 1.3939 10 9 2 67.35 7.09 1.3903 5 16 2 67.55 1.15 1.3867 1 23 1 67.57 7.54 1.3863 15 4 1 67.99 3.14 1.3789 2 23 1 68.03 1.40 1.3780 0 18 2 68.48 1.49 1.3702 12 1 2 68.52 1.10 1.3693 8 20 1 68.57 1.10 1.3686 12 17 0 68.84 2.35 1.3639 15 6 1 68.98 3.48 1.3614 12 3 2 69.47 1.71 1.3531 5 24 0 69.66 1.05 1.3499 15 7 1 69.76 1.34 1.3481 11 17 1 70.93 1.66 1.3287 2 19 2 70.96 2.26 1.3281 9 20 1 71.09 1.99 1.3261 16 1 1 71.12 2.40 1.3257 10 12 2 71.25 2.12 1.3236 10 19 1 71.31 1.00 1.3225 2 3 3 71.48 3.09 1.3198 12 7 2 71.62 1.11 1.3176 5 18 2 71.65 1.49 1.3171 15 9 1 72.02 1.95 1.3112 3 3 3 72.41 1.47 1.3052 12 8 2 72.45 1.58 1.3045 3 4 3 72.64 1.72 1.3016 4 24 1 72.67 2.51 1.3011 11 11 2 72.77 1.85 1.2995 0 20 2 72.91 2.46 1.2974 1 20 2 73.34 1.81 1.2909 2 20 2 73.39 1.01 1.2901 0 25 1 73.65 3.29 1.2862 10 20 1 73.68 1.20 1.2857 3 6 3 73.74 1.30 1.2848 8 22 1 74.20 1.36 1.2780 13 6 2 74.21 1.17 1.2779 11 19 1 74.27 1.31 1.2770 5 3 3 74.40 1.00 1.2750 10 22 0 74.48 4.27 1.2740 3 7 3 74.51 1.96 1.2734 13 16 1 74.65 1.07 1.2714 3 25 1 74.66 1.98 1.2713 4 6 3 75.45 1.36 1.2599 4 7 3 75.50 2.06 1.2592 6 2 3 75.51 1.91 1.2591 15 12 1 75.89 1.84 1.2538 12 11 2 76.73 1.02 1.2421 18 3 0 76.88 2.27 1.2401 5 25 1 77.02 2.13 1.2381 15 13 1 78.40 1.46 1.2197 16 11 1 78.64 3.19 1.2166 15 14 1 81.00 2.56 1.1870 2 13 3 81.27 1.90 1.1838 16 13 1 81.45 3.01 1.1816 9 0 3 81.69 1.10 1.1788 3 13 3 83.08 1.41 1.1625 5 27 1 83.29 1.01 1.1602 3 14 3 84.26 1.15 1.1492 10 2 3 86.73 1.45 1.1227 5 24 2 87.35 1.89 1.1163 9 10 3 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.