Kobellite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R110092 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: 34.1510 22.6256 4.0273 90.000 90.393 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: +/- 31 +/- 20 +/- 3 MAX. ABS. INTENSITY / VOLUME**2: 38.36636597 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 5.18 5.87 17.0751 2 0 0 11.03 1.42 8.0242 3 2 0 12.02 1.87 7.3644 1 3 0 12.83 2.09 6.8989 2 3 0 12.99 5.61 6.8147 4 2 0 14.09 2.58 6.2872 3 3 0 15.15 5.55 5.8470 5 2 0 15.57 14.12 5.6917 6 0 0 16.06 4.81 5.5197 6 1 0 18.61 3.58 4.7690 7 1 0 18.82 2.88 4.7154 4 4 0 19.54 72.58 4.5431 6 3 0 19.82 32.20 4.4798 7 2 0 20.39 42.20 4.3564 5 4 0 20.81 4.24 4.2688 8 0 0 21.70 10.67 4.0963 7 3 0 22.16 67.87 4.0121 6 4 0 22.23 7.36 3.9982 4 5 0 22.42 5.86 3.9649 0 1 1 22.56 1.29 3.9415 -1 1 1 22.59 1.29 3.9354 1 1 1 22.99 7.82 3.8679 -2 1 1 23.06 7.76 3.8564 2 1 1 23.58 3.26 3.7735 -1 2 1 23.58 3.97 3.7723 5 5 0 23.59 2.59 3.7709 0 6 0 23.61 3.25 3.7681 1 2 1 23.71 14.29 3.7521 -3 1 1 23.78 11.73 3.7422 9 1 0 23.81 14.14 3.7364 3 1 1 23.95 2.24 3.7150 8 3 0 23.99 5.57 3.7087 -2 2 1 24.06 5.54 3.6986 2 2 1 24.69 1.86 3.6063 -3 2 1 24.69 9.75 3.6053 -4 1 1 24.75 2.72 3.5975 9 2 0 24.78 1.84 3.5924 3 2 1 24.82 9.62 3.5868 4 1 1 24.87 3.98 3.5796 3 6 0 25.07 11.19 3.5525 0 3 1 25.14 31.51 3.5421 6 5 0 25.58 16.41 3.4822 -2 3 1 25.60 2.91 3.4795 -5 0 1 25.63 4.76 3.4754 -4 2 1 25.64 16.30 3.4738 2 3 1 25.76 4.70 3.4588 4 2 1 25.76 2.86 3.4587 5 0 1 25.83 4.03 3.4494 4 6 0 25.91 12.20 3.4391 -5 1 1 26.06 12.01 3.4190 5 1 1 26.09 23.52 3.4150 10 0 0 26.23 32.70 3.3970 -3 3 1 26.33 32.41 3.3853 3 3 1 26.39 6.99 3.3768 10 1 0 26.87 5.33 3.3177 7 5 0 27.01 100.00 3.3012 5 6 0 27.13 1.48 3.2869 -4 3 1 27.25 1.46 3.2728 4 3 1 27.28 2.64 3.2693 10 2 0 27.29 3.20 3.2674 -1 4 1 27.32 3.19 3.2639 1 4 1 27.66 6.14 3.2251 -2 4 1 27.72 6.11 3.2184 2 4 1 28.10 1.57 3.1758 2 7 0 28.18 41.28 3.1664 -6 2 1 28.25 24.51 3.1595 -5 3 1 28.27 23.82 3.1571 -3 4 1 28.32 1.51 3.1511 9 4 0 28.35 23.62 3.1477 3 4 1 28.36 40.57 3.1475 6 2 1 28.39 24.15 3.1439 5 3 1 28.39 31.06 3.1436 6 6 0 28.65 2.44 3.1163 -7 0 1 28.70 1.43 3.1110 10 3 0 28.75 1.31 3.1052 8 5 0 28.84 2.39 3.0953 7 0 1 29.03 18.39 3.0757 11 1 0 29.70 5.47 3.0084 0 5 1 29.80 1.95 2.9981 -1 5 1 29.83 1.95 2.9954 1 5 1 29.84 15.10 2.9939 11 2 0 30.15 4.15 2.9637 -5 4 1 30.29 4.10 2.9508 5 4 1 30.58 1.28 2.9235 10 4 0 30.60 3.74 2.9216 5 7 0 30.67 16.88 2.9149 -8 1 1 30.88 16.55 2.8954 8 1 1 31.15 14.38 2.8708 11 3 0 31.40 10.81 2.8492 -6 4 1 31.43 3.00 2.8458 12 0 0 31.44 1.57 2.8450 -8 2 1 31.55 10.65 2.8355 6 4 1 31.64 6.13 2.8282 0 8 0 31.65 1.54 2.8268 8 2 1 31.69 11.60 2.8236 12 1 0 31.75 1.92 2.8186 1 8 0 31.84 18.08 2.8106 6 7 0 32.08 2.33 2.7902 2 8 0 32.30 47.76 2.7712 -9 0 1 32.44 7.95 2.7599 12 2 0 32.53 46.78 2.7523 9 0 1 32.91 5.94 2.7216 11 4 0 33.25 3.98 2.6945 7 7 0 33.29 1.32 2.6916 -9 2 1 33.37 5.12 2.6847 4 8 0 33.46 12.56 2.6784 -3 6 1 33.51 1.29 2.6743 9 2 1 33.53 12.47 2.6726 3 6 1 33.66 26.94 2.6626 12 3 0 34.18 19.22 2.6234 -4 6 1 34.28 19.05 2.6162 4 6 1 34.48 7.66 2.6012 -9 3 1 34.55 3.83 2.5962 -10 1 1 34.70 7.52 2.5855 9 3 1 34.79 3.75 2.5789 10 1 1 35.05 4.33 2.5600 11 5 0 35.07 1.22 2.5589 13 2 0 35.09 2.93 2.5572 -5 6 1 35.21 2.90 2.5489 5 6 1 35.25 17.23 2.5464 -10 2 1 35.31 1.11 2.5422 12 4 0 35.48 16.88 2.5301 10 2 1 35.62 9.50 2.5207 0 7 1 35.70 1.02 2.5147 -1 7 1 35.73 1.02 2.5131 1 7 1 35.82 3.59 2.5072 1 9 0 35.99 1.78 2.4953 -2 7 1 36.04 1.77 2.4922 2 7 1 36.09 2.20 2.4886 -9 4 1 36.11 2.93 2.4871 2 9 0 36.21 4.27 2.4808 13 3 0 36.30 2.16 2.4749 9 4 1 36.38 6.54 2.4694 -10 3 1 36.45 1.13 2.4650 -8 5 1 36.47 34.22 2.4634 -3 7 1 36.54 34.02 2.4589 3 7 1 36.61 6.41 2.4545 10 3 1 36.63 1.12 2.4531 8 5 1 36.64 2.20 2.4524 -11 1 1 36.73 3.74 2.4468 7 8 0 36.89 2.16 2.4364 11 1 1 37.15 12.02 2.4204 -4 7 1 37.24 11.93 2.4148 4 7 1 37.31 4.49 2.4103 -11 2 1 37.44 1.08 2.4022 -7 6 1 37.53 2.61 2.3968 11 6 0 37.55 4.40 2.3951 11 2 1 37.59 1.07 2.3925 7 6 1 37.76 2.83 2.3825 13 4 0 37.92 2.67 2.3725 -10 4 1 38.14 2.62 2.3593 10 4 1 38.99 5.15 2.3098 -1 8 1 39.02 5.14 2.3086 1 8 1 39.67 3.17 2.2719 13 5 0 39.71 2.87 2.2698 -3 8 1 39.75 1.04 2.2676 9 8 0 39.77 2.85 2.2663 3 8 1 39.84 27.32 2.2626 0 10 0 39.87 4.00 2.2613 -11 4 1 39.93 1.64 2.2576 1 10 0 40.10 3.93 2.2487 11 4 1 40.20 3.59 2.2434 -7 7 1 40.21 1.82 2.2430 2 10 0 40.26 3.43 2.2399 14 4 0 40.28 4.22 2.2390 11 7 0 40.33 2.03 2.2361 -4 8 1 40.34 3.55 2.2356 7 7 1 40.39 1.33 2.2331 -9 6 1 40.41 2.42 2.2319 15 2 0 40.42 2.01 2.2316 4 8 1 40.58 1.31 2.2231 9 6 1 41.43 4.21 2.1795 15 3 0 41.45 2.23 2.1782 10 8 0 41.91 6.74 2.1555 13 6 0 42.06 2.09 2.1480 -10 6 1 42.09 3.36 2.1469 -6 8 1 42.21 3.33 2.1411 6 8 1 42.27 2.05 2.1382 10 6 1 42.31 12.52 2.1359 12 7 0 42.99 5.64 2.1038 -9 7 1 43.02 2.30 2.1025 6 10 0 43.13 2.69 2.0975 -3 9 1 43.17 2.85 2.0957 9 9 0 43.17 5.56 2.0955 9 7 1 43.19 2.68 2.0947 3 9 1 44.11 2.94 2.0532 1 11 0 44.44 1.10 2.0386 13 7 0 44.46 4.36 2.0377 -5 9 1 44.56 4.32 2.0335 5 9 1 44.59 2.45 2.0323 -10 7 1 44.76 3.95 2.0245 10 9 0 44.78 2.41 2.0239 10 7 1 44.95 1.05 2.0166 -14 3 1 45.02 65.67 2.0136 0 0 2 45.20 5.49 2.0061 12 8 0 45.22 1.03 2.0052 14 3 1 45.32 2.63 2.0010 17 1 0 45.42 1.62 1.9969 16 4 0 45.83 3.26 1.9801 -15 1 1 45.84 2.16 1.9794 -9 8 1 46.01 2.13 1.9725 9 8 1 46.11 3.19 1.9686 15 1 1 46.25 1.78 1.9628 -14 4 1 46.38 1.33 1.9578 -15 2 1 46.41 2.26 1.9566 -7 9 1 46.52 1.74 1.9523 14 4 1 46.54 2.24 1.9514 7 9 1 46.60 1.60 1.9490 15 6 0 46.66 1.30 1.9466 15 2 1 47.08 3.34 1.9304 16 5 0 47.29 6.76 1.9221 -15 3 1 47.36 2.32 1.9194 -10 8 1 47.55 2.29 1.9124 10 8 1 47.57 6.63 1.9116 15 3 1 47.60 1.67 1.9105 -8 9 1 47.74 1.65 1.9050 8 9 1 47.75 1.20 1.9049 -13 6 1 47.95 6.16 1.8972 18 0 0 47.98 1.18 1.8960 13 6 1 48.25 1.82 1.8862 10 10 0 48.27 3.43 1.8855 0 12 0 48.29 5.26 1.8847 -16 1 1 48.31 2.54 1.8841 12 9 0 48.55 16.11 1.8753 -15 4 1 48.58 5.15 1.8741 16 1 1 48.81 2.84 1.8657 -6 10 1 48.82 15.79 1.8655 15 4 1 48.92 2.82 1.8619 6 10 1 48.94 1.06 1.8613 15 7 0 49.00 1.09 1.8591 -11 8 1 49.04 1.26 1.8575 16 6 0 49.17 1.73 1.8530 8 11 0 49.20 1.07 1.8521 11 8 1 49.41 4.90 1.8446 -6 3 2 49.51 2.16 1.8409 -7 2 2 49.54 6.75 1.8399 18 3 0 49.62 4.82 1.8372 6 3 2 49.76 2.12 1.8323 7 2 2 49.80 3.16 1.8309 -5 4 2 49.83 2.30 1.8299 -14 6 1 49.87 1.26 1.8285 11 10 0 49.98 3.12 1.8248 5 4 2 50.08 2.26 1.8214 14 6 1 50.23 1.52 1.8163 13 9 0 50.36 3.45 1.8118 -10 9 1 50.44 2.33 1.8094 -3 11 1 50.49 2.32 1.8076 3 11 1 50.54 3.40 1.8059 10 9 1 50.62 6.05 1.8032 -6 4 2 50.81 1.39 1.7969 -17 1 1 50.83 5.96 1.7962 6 4 2 50.91 1.48 1.7937 -16 4 1 50.93 2.46 1.7929 -8 10 1 50.96 1.53 1.7922 -4 11 1 51.03 1.52 1.7899 4 11 1 51.07 2.43 1.7883 8 10 1 51.11 1.36 1.7871 17 1 1 51.19 1.45 1.7845 16 4 1 51.38 1.05 1.7782 -9 1 2 51.48 2.87 1.7751 19 2 0 51.70 1.03 1.7682 9 1 2 52.00 1.95 1.7587 7 12 0 52.01 4.06 1.7584 -15 6 1 52.16 3.30 1.7537 -6 5 2 52.17 1.40 1.7532 -17 3 1 52.19 8.49 1.7526 -9 10 1 52.26 3.99 1.7503 15 6 1 52.29 2.43 1.7497 18 5 0 52.35 8.40 1.7478 9 10 1 52.36 3.26 1.7473 6 5 2 52.46 1.37 1.7441 17 3 1 52.61 2.48 1.7398 -10 0 2 52.95 2.42 1.7294 10 0 2 53.20 11.49 1.7216 -5 6 2 53.37 11.35 1.7165 5 6 2 53.44 5.16 1.7147 11 11 0 53.57 2.50 1.7106 -10 10 1 53.74 2.47 1.7056 10 10 1 53.95 1.61 1.6996 -2 12 1 53.98 1.61 1.6986 2 12 1 53.99 3.96 1.6985 -6 6 2 54.17 1.68 1.6932 -15 7 1 54.19 3.91 1.6927 6 6 2 54.28 2.31 1.6900 -11 1 2 54.42 1.65 1.6860 15 7 1 54.45 1.03 1.6853 -8 11 1 54.58 1.02 1.6814 8 11 1 54.65 2.25 1.6795 11 1 2 54.77 2.00 1.6760 -11 2 2 55.09 3.84 1.6670 12 11 0 55.14 1.95 1.6658 11 2 2 55.15 1.03 1.6654 20 3 0 55.19 4.90 1.6644 6 13 0 55.58 2.13 1.6535 -11 3 2 55.69 3.78 1.6506 10 12 0 55.90 1.90 1.6447 -12 1 2 55.94 2.08 1.6436 11 3 2 56.07 1.88 1.6403 0 8 2 56.10 2.66 1.6395 -6 7 2 56.11 4.99 1.6392 7 13 0 56.19 1.46 1.6369 -6 12 1 56.22 1.86 1.6362 18 7 0 56.29 2.63 1.6343 6 7 2 56.29 1.45 1.6343 6 12 1 56.30 1.85 1.6342 12 1 2 56.38 1.25 1.6318 -12 2 2 56.56 1.18 1.6271 16 9 0 56.76 2.77 1.6220 21 1 0 56.77 1.22 1.6215 12 2 2 57.16 1.46 1.6115 11 12 0 57.18 4.41 1.6110 -12 3 2 57.23 2.46 1.6097 21 2 0 57.57 4.30 1.6011 12 3 2 57.76 2.55 1.5961 1 13 1 57.96 5.75 1.5911 -2 13 1 58.00 5.74 1.5903 2 13 1 58.30 2.40 1.5827 -3 13 1 58.35 2.39 1.5815 3 13 1 58.84 1.64 1.5693 17 9 0 59.00 1.32 1.5656 -18 6 1 59.20 1.45 1.5609 -20 2 1 59.26 1.89 1.5592 -15 9 1 59.29 1.29 1.5587 18 6 1 59.37 1.56 1.5566 -5 13 1 59.45 1.55 1.5547 5 13 1 59.46 5.19 1.5547 6 14 0 59.50 1.86 1.5536 15 9 1 59.51 1.41 1.5533 20 2 1 59.97 1.27 1.5426 -20 3 1 60.28 1.25 1.5353 20 3 1 60.33 1.11 1.5341 7 14 0 61.09 1.80 1.5170 19 8 0 61.48 2.57 1.5081 -21 1 1 61.66 11.28 1.5042 0 10 2 61.81 2.52 1.5010 21 1 1 62.43 1.81 1.4875 -3 14 1 62.48 1.81 1.4865 3 14 1 62.56 1.17 1.4848 12 13 0 62.69 2.24 1.4820 -21 3 1 62.99 1.55 1.4756 -13 6 2 63.01 2.20 1.4753 21 3 1 63.31 2.96 1.4689 -12 7 2 63.39 1.51 1.4673 13 6 2 63.68 2.89 1.4614 12 7 2 63.73 1.20 1.4603 -21 4 1 63.90 1.65 1.4568 23 3 0 64.05 1.18 1.4538 21 4 1 64.05 2.90 1.4538 18 10 0 64.18 1.22 1.4511 -16 10 1 64.42 1.20 1.4462 16 10 1 65.06 2.91 1.4336 -21 5 1 65.37 2.85 1.4275 21 5 1 65.52 1.32 1.4246 -12 8 2 65.76 1.27 1.4201 24 1 0 65.88 1.29 1.4177 12 8 2 66.15 1.95 1.4125 0 15 1 67.12 1.12 1.3946 18 11 0 67.25 1.62 1.3922 -16 11 1 67.48 1.60 1.3879 16 11 1 67.61 1.65 1.3856 -18 0 2 67.66 4.16 1.3847 5 16 0 67.70 1.11 1.3839 -5 15 1 67.78 1.11 1.3826 5 15 1 67.84 1.18 1.3816 23 6 0 67.93 1.62 1.3799 24 4 0 68.13 1.77 1.3763 0 12 2 68.14 1.59 1.3762 18 0 2 68.53 3.70 1.3692 -21 7 1 68.60 1.69 1.3680 -15 12 1 68.82 1.67 1.3641 15 12 1 68.84 3.63 1.3638 21 7 1 68.90 1.88 1.3628 -18 3 2 69.42 1.82 1.3538 18 3 2 71.86 1.18 1.3138 -3 3 3 71.99 1.17 1.3118 3 3 3 72.14 1.66 1.3094 -15 13 1 72.23 1.54 1.3079 -11 11 2 72.35 1.64 1.3061 15 13 1 72.54 1.51 1.3031 11 11 2 72.75 1.43 1.2999 -6 2 3 73.01 1.41 1.2960 6 2 3 73.62 1.24 1.2866 -12 11 2 73.79 1.54 1.2841 -6 13 2 73.90 1.18 1.2825 18 13 0 73.96 1.53 1.2816 6 13 2 73.96 1.21 1.2816 12 11 2 74.02 1.61 1.2807 -16 13 1 74.16 1.21 1.2786 -10 12 2 74.25 1.59 1.2773 16 13 1 74.44 1.19 1.2745 10 12 2 74.56 1.65 1.2727 -7 13 2 74.76 1.63 1.2698 7 13 2 74.87 2.47 1.2683 -9 0 3 75.25 2.42 1.2628 9 0 3 75.87 2.19 1.2540 -15 14 1 76.00 1.10 1.2522 -4 6 3 76.08 2.16 1.2510 15 14 1 76.17 1.09 1.2498 4 6 3 76.20 2.30 1.2494 -26 1 1 76.57 2.26 1.2443 26 1 1 77.38 2.20 1.2333 -3 7 3 77.50 1.87 1.2317 -6 14 2 77.50 2.18 1.2316 3 7 3 77.66 1.86 1.2295 6 14 2 81.45 1.13 1.1816 -18 10 2 81.94 1.11 1.1758 18 10 2 84.94 1.69 1.1417 -5 16 2 85.08 1.68 1.1402 5 16 2 85.45 1.79 1.1362 -15 4 3 86.07 1.75 1.1297 15 4 3 88.35 1.08 1.1063 -9 10 3 88.71 1.07 1.1027 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.