Ferrofettelite Bindi L, Downs R T, Spry P G, Pinch W W, Menchetti S Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from powder data of R100124 Mineralogical Magazine 76 (2012) 551-566 A chemical and structural re-examination of fettelite samples from the type locality, Odenwald, southwest Germany Sample: R100124 Locality: Odenwald, southwest Germany _database_code_amcsd 0018797 CELL PARAMETERS: 26.0000 15.0670 15.5120 90.000 90.290 90.000 SPACE GROUP: C2 ATOM X Y Z OCCUPANCY ISO(B) Fe 0.12290 0.10428 0.50143 0.546 1.382 Hg 0.12290 0.10428 0.50143 0.454 1.382 Fe 0.13030 0.61018 0.50011 0.506 1.366 Hg 0.13030 0.61018 0.50011 0.494 1.366 Ag 0.28021 0.83512 0.91440 1.000 2.045 Ag 0.07835 0.46559 0.08702 1.000 1.950 Ag 0.04773 0.61816 -0.09586 1.000 1.593 Ag -0.02857 0.38326 0.08976 1.000 1.477 Ag -0.03304 -0.11835 0.08981 1.000 1.545 Ag 0.07675 -0.02592 0.08682 1.000 1.630 Ag 0.04689 0.11624 0.90526 1.000 1.447 Ag 0.16703 0.24525 0.91108 1.000 1.503 Ag 0.20499 0.09411 0.09844 1.000 2.006 Ag 0.28137 0.32277 0.91184 1.000 1.769 Ag 0.17836 0.74447 0.91295 1.000 1.498 Ag 0.20062 0.60923 0.09394 1.000 1.639 Ag 0.12902 -0.12902 0.71083 1.000 1.684 Ag 0.11669 0.62581 0.30174 1.000 1.797 Ag 0.01731 0.72843 0.30764 1.000 1.267 Ag 0.01448 0.22697 0.29593 1.000 1.330 Ag 0.13161 0.37402 0.70735 1.000 1.581 Ag 0.23521 0.48299 0.69742 1.000 1.571 Ag 0.11995 0.12830 0.30838 1.000 1.884 Ag 0.00000 0.75526 0.50000 1.000 1.492 Ag 0.13656 0.07341 0.69020 1.000 1.227 Ag 0.18300 0.29319 0.50033 1.000 1.331 Ag 0.13753 0.57402 0.69499 1.000 1.510 Ag 0.11434 0.32675 0.29817 1.000 1.664 Ag 0.17829 0.80086 0.49719 1.000 1.720 Ag 0.23462 -0.01597 0.69520 1.000 1.310 Ag 0.06952 -0.08556 0.50162 1.000 1.529 Ag 0.11663 0.83269 0.29454 1.000 1.657 Ag 0.24802 0.13711 0.50137 1.000 1.328 Ag 0.00000 0.28369 0.50000 1.000 1.508 Ag 0.24856 0.45515 0.50208 1.000 1.305 Ag 0.00000 0.09672 0.50000 1.000 1.895 Ag 0.07230 0.41941 0.50040 1.000 1.620 Ag 0.00000 0.56031 0.50000 1.000 1.237 As 0.08444 0.22513 0.07232 1.000 1.737 As 0.08084 0.72355 0.07285 1.000 1.603 As 0.16626 0.48536 0.92769 1.000 1.453 As 0.16989 -0.01196 0.92668 1.000 1.705 As 0.24901 0.73297 0.28512 1.000 1.342 As 0.00013 0.47190 0.28488 1.000 1.421 As 0.00114 -0.02438 0.71439 1.000 1.121 As 0.25028 0.23298 0.28479 1.000 1.184 S 0.00661 0.74554 0.15107 1.000 1.761 S 0.11788 0.11159 0.15381 1.000 1.966 S 0.24226 0.46568 0.85759 1.000 1.405 S 0.13515 0.60325 0.85525 1.000 1.105 S 0.01035 0.24233 0.13887 1.000 1.326 S 0.12487 -0.11805 0.87426 1.000 1.603 S 0.12064 0.37808 0.86105 1.000 1.563 S 0.12282 0.83964 0.12975 1.000 1.129 S 0.11306 0.61056 0.14685 1.000 1.508 S 0.12580 0.33539 0.13245 1.000 1.737 S 0.24145 -0.02660 0.85481 1.000 1.319 S 0.25443 0.69873 -0.00351 1.000 1.500 S 0.13136 0.09774 0.85122 1.000 1.019 S 0.00000 0.51168 0.00000 1.000 1.026 S 0.00000 0.01297 0.00000 1.000 1.579 S 0.21319 0.84667 0.35884 1.000 1.263 S 0.07400 -0.02650 0.35289 1.000 1.248 S 0.08550 0.73689 0.46472 1.000 1.232 S 0.08326 0.22844 0.44726 1.000 1.358 S 0.16669 -0.02623 0.53039 1.000 1.034 S 0.21299 0.61444 0.35125 1.000 1.161 S 0.07369 0.47227 0.35161 1.000 0.916 S 0.04260 -0.13486 0.65087 1.000 1.421 S -0.03842 0.36196 0.34823 1.000 1.161 S -0.03742 0.58788 0.35383 1.000 1.224 S 0.17414 0.23817 0.64448 1.000 1.145 S 0.21099 0.34744 0.35752 1.000 0.837 S 0.28549 0.61957 0.65009 1.000 1.255 S -0.03374 0.08965 0.36107 1.000 0.869 S 0.16878 0.72989 0.64438 1.000 1.405 S 0.16113 0.47849 0.55879 1.000 0.821 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 23 +/- 13 +/- 14 MAX. ABS. INTENSITY / VOLUME**2: 55.04909844 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 5.70 17.02 15.5118 0 0 1 11.41 14.39 7.7559 0 0 2 14.73 1.32 6.0146 -2 2 1 14.75 3.30 6.0057 -4 0 1 14.76 10.41 6.0037 2 2 1 14.80 1.23 5.9841 4 0 1 17.75 7.67 4.9962 -2 2 2 17.85 3.76 4.9694 4 0 2 21.35 1.88 4.1626 -4 2 2 23.62 1.35 3.7668 0 4 0 23.69 4.36 3.7562 6 2 0 24.36 1.77 3.6544 -6 2 1 24.41 1.77 3.6471 6 2 1 24.61 2.63 3.6179 2 4 0 25.27 1.50 3.5245 -2 4 1 25.29 1.23 3.5223 2 4 1 27.37 16.25 3.2591 4 4 0 27.44 8.05 3.2500 8 0 0 27.99 38.90 3.1878 4 4 1 28.02 22.68 3.1841 -8 0 1 28.78 100.00 3.1024 0 0 5 29.33 1.85 3.0453 -6 2 3 29.34 1.59 3.0445 0 4 3 29.45 1.73 3.0326 6 2 3 29.71 3.32 3.0073 -4 4 2 29.75 20.60 3.0029 -8 0 2 29.76 42.97 3.0019 4 4 2 29.86 1.43 2.9920 8 0 2 29.94 1.40 2.9841 8 2 0 30.48 8.78 2.9329 -8 2 1 30.53 8.36 2.9279 8 2 1 31.47 6.30 2.8428 6 4 0 31.99 1.40 2.7979 -6 4 1 32.03 3.79 2.7946 6 4 1 32.09 4.13 2.7894 -8 2 2 32.19 2.42 2.7808 8 2 2 32.44 31.17 2.7602 -4 4 3 32.46 3.74 2.7579 -8 0 3 32.51 8.02 2.7539 4 4 3 32.62 14.88 2.7453 8 0 3 33.54 7.36 2.6721 -6 4 2 33.61 2.33 2.6663 6 4 2 33.91 1.04 2.6436 2 4 4 34.64 1.10 2.5898 -8 2 3 34.78 2.48 2.5794 8 2 3 35.76 3.83 2.5112 0 6 0 35.95 27.56 2.4981 -4 4 4 36.11 5.23 2.4877 6 4 3 36.15 15.27 2.4847 8 0 4 36.24 2.02 2.4789 0 6 1 36.44 4.34 2.4656 2 6 0 36.52 1.84 2.4607 8 4 0 36.56 1.71 2.4577 10 2 0 36.91 8.18 2.4354 -2 6 1 36.92 1.11 2.4347 2 6 1 36.97 5.05 2.4317 -8 4 1 37.01 2.32 2.4292 -10 2 1 37.01 2.60 2.4288 8 4 1 37.06 7.47 2.4256 10 2 1 37.46 2.72 2.4011 2 2 6 37.52 1.82 2.3972 -6 2 5 37.56 1.25 2.3947 0 4 5 37.65 4.09 2.3891 0 6 2 37.69 1.66 2.3869 6 2 5 37.96 4.43 2.3703 -8 2 4 38.14 2.05 2.3597 8 2 4 38.19 1.56 2.3567 -2 4 5 38.29 2.85 2.3504 -2 6 2 38.33 1.49 2.3480 -8 4 2 39.23 3.15 2.2964 -6 4 4 39.91 5.20 2.2589 0 6 3 40.08 2.71 2.2499 -4 4 5 40.08 3.54 2.2498 -8 0 5 40.18 7.33 2.2442 4 4 5 40.55 1.63 2.2247 2 6 3 40.72 1.71 2.2160 0 0 7 41.56 1.32 2.1727 6 6 0 41.97 3.02 2.1524 -6 6 1 42.14 2.20 2.1443 12 0 1 42.24 1.03 2.1397 10 4 0 42.35 1.48 2.1340 -6 2 6 42.54 1.30 2.1253 6 2 6 43.03 1.21 2.1021 2 4 6 43.08 2.71 2.0997 -2 2 7 43.09 1.30 2.0994 -6 4 5 43.20 1.51 2.0942 4 0 7 43.21 2.57 2.0935 -6 6 2 43.24 1.79 2.0925 6 4 5 43.42 3.58 2.0840 12 0 2 43.48 1.09 2.0816 -2 6 4 43.48 1.48 2.0813 -8 4 4 43.50 2.42 2.0804 -10 2 4 43.51 3.16 2.0798 2 6 4 43.64 1.69 2.0741 8 4 4 43.70 2.63 2.0714 10 2 4 43.84 1.13 2.0650 -12 2 1 43.84 4.09 2.0649 -10 4 2 44.68 3.42 2.0282 -8 0 6 44.69 4.60 2.0279 -4 4 6 44.79 1.02 2.0235 -4 2 7 44.80 5.77 2.0229 4 4 6 44.91 2.69 2.0183 8 0 6 45.14 2.03 2.0086 12 2 2 45.30 2.73 2.0019 -12 0 3 45.32 3.51 2.0012 6 6 3 45.97 2.72 1.9742 10 4 3 46.03 1.58 1.9718 -8 6 1 46.36 4.23 1.9585 -8 2 6 46.53 3.23 1.9519 0 6 5 46.59 3.14 1.9495 8 2 6 46.96 2.11 1.9348 -12 2 3 47.06 1.74 1.9310 -10 2 5 47.10 2.90 1.9293 2 6 5 47.23 2.40 1.9243 8 4 5 47.46 1.12 1.9158 -6 4 6 47.62 1.48 1.9095 6 4 6 48.00 2.22 1.8955 -12 0 4 48.05 3.01 1.8934 6 6 4 48.33 8.55 1.8834 0 8 0 48.47 25.42 1.8781 12 4 0 48.70 1.11 1.8696 0 8 1 49.05 1.68 1.8572 2 2 8 49.24 1.09 1.8504 2 8 1 49.68 7.02 1.8352 -8 0 7 49.69 3.72 1.8347 -4 4 7 49.82 13.36 1.8303 4 4 7 49.93 1.85 1.8266 8 0 7 50.36 1.74 1.8120 2 8 2 51.15 1.31 1.7858 -8 4 6 51.17 2.54 1.7851 -2 6 6 51.23 1.29 1.7831 -8 2 7 51.27 1.06 1.7818 -6 6 5 51.42 1.77 1.7770 10 2 6 51.65 1.40 1.7696 0 8 3 52.15 1.05 1.7539 -2 8 3 52.26 1.18 1.7505 -6 4 7 53.14 1.15 1.7235 0 0 9 53.38 1.28 1.7163 6 8 1 53.69 1.03 1.7071 -10 6 3 54.14 1.10 1.6941 0 8 4 55.03 1.04 1.6689 -8 0 8 55.05 4.31 1.6682 -4 4 8 55.18 2.11 1.6645 4 4 8 55.29 1.48 1.6615 0 6 7 55.29 1.83 1.6614 8 0 8 55.30 1.87 1.6612 6 6 6 55.47 1.00 1.6565 12 0 6 56.47 1.13 1.6295 8 8 0 56.64 1.36 1.6250 16 0 0 56.79 3.60 1.6210 -8 8 1 57.01 2.19 1.6153 16 0 1 57.22 4.28 1.6099 0 8 5 57.23 7.29 1.6098 -12 4 5 57.47 6.61 1.6035 12 4 5 57.63 1.38 1.5994 6 4 8 57.79 1.26 1.5955 -8 8 2 59.43 2.19 1.5553 -8 8 3 59.60 4.46 1.5512 0 0 10 59.74 2.13 1.5480 16 0 3 60.72 3.60 1.5252 -4 4 9 60.98 1.92 1.5195 8 0 9 61.79 2.57 1.5014 -16 0 4 61.81 3.06 1.5009 8 8 4 62.33 1.19 1.4897 2 10 1 62.51 2.19 1.4859 -16 4 1 62.52 2.81 1.4857 14 6 1 64.49 1.03 1.4448 6 6 8 64.53 1.13 1.4441 -8 8 5 64.91 1.02 1.4365 16 0 5 66.21 1.32 1.4116 4 10 3 66.68 1.39 1.4027 -8 0 10 66.86 2.61 1.3992 4 4 10 67.08 1.54 1.3953 -14 6 4 67.35 1.50 1.3904 16 4 4 67.92 1.00 1.3801 -8 8 6 67.98 1.02 1.3789 -16 0 6 68.09 1.73 1.3770 8 8 6 71.82 1.15 1.3144 -8 8 7 72.79 1.44 1.2993 -10 10 1 72.82 1.01 1.2988 10 10 1 73.04 1.66 1.2954 -4 4 11 73.35 2.08 1.2907 14 6 6 76.22 1.01 1.2490 -8 8 8 76.35 1.05 1.2473 -12 8 6 76.71 1.11 1.2424 16 0 8 77.27 1.32 1.2347 10 10 4 79.90 1.35 1.2005 4 4 12 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.