Aravaipaite Diffraction data computed using the structure from the paper listed below, along with the cell parameters refined from single crystal data of R100004 Kampf A R, Yang H, Downs R T, Pinch W W American Mineralogist 96 (2011) 402-407 The crystal structures and Raman spectra of aravaipaite and calcioaravaipaite Locality: Grand Reef mine, Aravaipa mining district, Arizona, USA CELL PARAMETERS: 5.6540 5.6810 12.7030 98.750 93.990 90.750 SPACE GROUP: P-1 ATOM X Y Z OCCUPANCY ISO(B) Pb 0.30470 0.11693 0.36471 1.000 1.194 Pb 0.76753 0.04754 0.11751 1.000 1.895 Pb 0.27468 0.51132 0.11789 1.000 1.386 Al 0.79400 0.61810 0.30820 1.000 0.979 F 0.04860 0.77450 0.27400 1.000 2.092 F 0.73690 0.50940 0.16610 1.000 1.966 F 0.84880 0.71990 0.44550 1.000 2.290 F 0.51920 0.47520 0.33060 1.000 2.029 F 0.61580 0.86760 0.28630 1.000 2.092 F 0.95870 0.36350 0.31700 1.000 3.111 F 0.49960 0.24300 0.99240 1.000 1.484 F 0.00070 0.24750 0.99530 1.000 1.390 F 0.29420 0.12830 0.17100 1.000 3.214 O 0.66210 0.22570 0.51280 1.000 1.579 H 0.59700 0.33800 0.55500 1.000 3.948 H 0.81400 0.25300 0.50900 1.000 3.948 X-RAY WAVELENGTH: 1.541838 BOUNDS ON TWO THETA: 5.0 90.0 LIMITS IMPOSED ON THE INDICES ARE: +/- 5 +/- 5 +/- 11 MAX. ABS. INTENSITY / VOLUME**2: 89.61969876 The INTENSITY cut off value is 1.00 2-THETA INTENSITY D-SPACING H K L 7.06 100.00 12.5222 0 0 1 15.72 4.32 5.6387 1 0 0 15.79 7.37 5.6133 0 1 0 16.77 12.48 5.2868 -1 0 1 17.71 2.68 5.0075 1 0 1 18.29 20.05 4.8519 0 1 1 19.55 1.24 4.5400 0 -1 2 20.42 11.23 4.3495 -1 0 2 21.96 9.08 4.0468 1 0 2 22.07 2.32 4.0268 -1 1 0 22.61 1.38 3.9324 -1 -1 1 22.62 3.45 3.9312 1 1 0 22.84 1.15 3.8932 0 1 2 23.60 5.91 3.7699 -1 1 1 24.55 13.68 3.6265 0 -1 3 24.77 45.03 3.5948 -1 -1 2 24.79 36.07 3.5921 1 1 1 25.59 76.41 3.4804 1 -1 2 25.62 1.58 3.4775 -1 0 3 27.02 83.30 3.3003 -1 1 2 27.49 5.08 3.2444 1 0 3 28.51 55.64 3.1305 0 0 4 28.63 46.11 3.1181 -1 -1 3 28.66 55.56 3.1151 1 1 2 29.92 16.14 2.9864 1 -1 3 30.49 1.10 2.9321 0 -1 4 31.58 38.34 2.8330 0 -2 1 31.67 1.64 2.8252 -1 0 4 31.74 41.28 2.8193 2 0 0 31.76 2.47 2.8171 -1 1 3 31.89 15.79 2.8066 0 2 0 32.03 15.57 2.7942 -2 0 1 34.89 2.14 2.5714 0 1 4 35.28 4.49 2.5440 -2 1 0 35.34 5.46 2.5395 1 -2 1 35.58 2.36 2.5235 -1 -2 1 35.86 8.84 2.5044 0 0 5 36.06 3.40 2.4911 -2 1 1 36.09 2.83 2.4889 1 2 0 36.54 1.78 2.4590 -1 -2 2 36.99 1.21 2.4300 0 -1 5 37.40 1.66 2.4045 -1 1 4 37.68 4.44 2.3876 2 1 1 38.03 3.65 2.3663 1 2 1 38.24 1.61 2.3535 -2 1 2 38.25 3.56 2.3529 -1 0 5 38.89 3.20 2.3157 -1 -2 3 39.49 1.04 2.2818 -1 -1 5 39.55 2.21 2.2788 -2 -1 3 39.71 14.34 2.2700 0 -2 4 39.86 11.99 2.2616 2 0 3 40.46 1.56 2.2297 1 0 5 40.65 2.15 2.2193 2 1 2 41.43 15.11 2.1794 0 2 3 41.49 4.24 2.1764 2 -1 3 41.52 21.25 2.1748 -2 0 4 41.65 2.12 2.1683 -2 1 3 41.68 6.57 2.1668 0 1 5 42.43 1.15 2.1303 -1 -2 4 43.67 3.71 2.0726 -1 2 3 43.90 1.33 2.0623 0 -1 6 44.64 18.82 2.0297 0 -2 5 44.79 19.78 2.0234 2 0 4 45.03 20.02 2.0134 -2 2 0 45.19 10.17 2.0063 2 -2 1 45.22 1.45 2.0051 -1 0 6 45.46 2.80 1.9953 1 2 3 45.57 26.67 1.9906 -2 -2 1 45.87 1.68 1.9784 2 -1 4 45.90 6.09 1.9772 -1 -1 6 45.94 3.12 1.9756 1 1 5 46.07 2.75 1.9703 -2 1 4 46.18 2.13 1.9656 2 2 0 46.66 12.27 1.9466 0 2 4 46.74 9.39 1.9436 -2 0 5 47.54 3.04 1.9127 1 0 6 47.91 10.85 1.8988 1 -1 6 47.94 1.21 1.8977 -2 -1 5 48.05 2.05 1.8935 0 -3 1 48.28 3.47 1.8851 1 -2 5 48.43 1.94 1.8796 3 0 0 48.66 2.26 1.8711 0 3 0 50.29 1.11 1.8145 0 -3 3 50.41 1.59 1.8104 0 3 1 50.41 12.54 1.8103 -1 1 6 51.16 2.28 1.7855 0 -1 7 51.36 1.02 1.7790 1 -3 2 51.53 1.30 1.7734 -2 2 3 51.57 1.19 1.7722 3 -1 1 52.04 1.04 1.7573 -3 -1 2 52.26 1.26 1.7505 -1 -2 6 52.57 10.22 1.7409 -1 3 1 52.59 5.77 1.7402 2 -2 4 52.76 9.96 1.7350 -3 1 2 52.77 9.09 1.7348 -1 -1 7 52.81 9.72 1.7335 1 1 6 52.88 10.12 1.7314 -1 -3 3 53.03 1.70 1.7270 0 -3 4 53.11 9.52 1.7245 3 1 1 53.15 10.43 1.7231 1 -3 3 53.37 10.30 1.7167 3 -1 2 53.37 1.87 1.7166 -2 -1 6 53.69 9.39 1.7071 1 3 1 53.86 12.34 1.7020 -3 -1 3 54.61 9.15 1.6805 -2 -2 5 54.66 7.53 1.6790 2 2 3 54.93 4.25 1.6714 1 -1 7 55.11 3.11 1.6664 -1 3 2 55.14 1.17 1.6655 -3 0 4 55.29 2.42 1.6614 -3 1 3 55.30 1.33 1.6612 2 1 5 55.36 1.56 1.6596 -1 -3 4 55.59 3.43 1.6532 3 1 2 55.70 7.38 1.6502 -2 2 4 56.32 1.10 1.6335 1 2 5 56.94 1.28 1.6173 0 3 3 56.99 3.94 1.6159 2 -2 5 57.59 1.59 1.6005 -1 1 7 58.74 1.44 1.5719 3 -2 1 59.01 5.80 1.5653 0 0 8 59.33 2.07 1.5576 2 2 4 59.77 1.46 1.5473 -2 3 1 59.99 1.96 1.5420 2 3 0 60.95 2.02 1.5201 2 -3 3 62.57 1.54 1.4845 -2 -3 4 63.44 1.40 1.4662 2 -1 7 64.17 1.11 1.4512 0 1 8 65.82 4.57 1.4189 0 -4 1 65.95 1.50 1.4165 0 -4 2 66.11 1.08 1.4134 0 2 7 66.15 1.49 1.4126 -2 0 8 66.17 5.31 1.4122 -4 0 1 66.31 2.71 1.4097 4 0 0 67.15 1.34 1.3940 -1 2 7 67.29 1.52 1.3914 0 0 9 68.08 1.81 1.3773 -1 3 5 68.14 3.32 1.3761 -1 -3 7 68.22 3.11 1.3748 -3 1 6 68.38 2.60 1.3718 3 1 5 68.41 1.02 1.3713 -1 -4 2 69.56 1.27 1.3515 3 -2 5 69.58 3.82 1.3512 1 -3 7 69.78 4.07 1.3477 3 -1 6 70.24 3.80 1.3401 1 3 5 70.34 3.87 1.3384 -3 -1 7 70.82 3.46 1.3305 0 -2 9 70.95 1.73 1.3284 3 -3 2 70.96 3.78 1.3283 2 0 8 71.07 1.33 1.3264 -3 3 1 71.90 1.95 1.3132 0 -4 5 72.05 2.29 1.3108 -3 -3 3 72.07 1.22 1.3104 3 3 0 72.28 1.59 1.3072 4 0 3 72.55 1.17 1.3030 0 -3 8 72.74 1.90 1.3001 3 -3 3 72.94 2.20 1.2970 -3 3 2 73.68 2.12 1.2857 0 2 8 73.72 1.85 1.2852 -2 0 9 73.86 1.78 1.2831 -3 -3 4 73.90 2.92 1.2825 3 3 1 73.93 2.22 1.2821 -1 3 6 74.06 1.69 1.2801 -3 1 7 74.19 1.91 1.2782 3 1 6 74.36 2.83 1.2757 2 -4 1 74.58 2.81 1.2725 0 4 3 74.59 1.51 1.2722 2 -2 8 74.61 3.69 1.2720 -4 2 0 74.86 2.59 1.2683 -4 0 5 75.32 1.76 1.2618 -2 -4 2 75.49 1.21 1.2593 -2 -4 1 75.58 2.65 1.2581 -4 -2 1 76.02 2.01 1.2519 4 0 4 77.40 1.38 1.2329 -1 -4 6 77.55 2.43 1.2310 -2 -2 9 77.64 2.21 1.2298 2 2 7 78.27 1.00 1.2214 1 -4 6 78.69 1.57 1.2160 1 -1 10 79.77 2.59 1.2022 -2 2 8 81.30 2.59 1.1834 2 -4 5 81.51 2.14 1.1809 -4 -2 5 81.57 2.71 1.1802 4 -2 4 81.64 2.22 1.1794 -2 4 3 81.82 1.35 1.1772 2 -2 9 81.86 2.50 1.1767 -4 2 4 81.89 2.42 1.1764 -1 1 10 83.49 2.03 1.1578 -2 -4 6 83.81 2.65 1.1543 4 2 3 84.85 2.06 1.1427 -1 -1 11 84.91 1.97 1.1421 1 1 10 84.99 1.81 1.1412 2 4 3 85.16 1.02 1.1394 -4 -2 6 87.72 1.27 1.1126 1 -1 11 88.23 1.00 1.1074 1 -5 3 88.48 1.33 1.1050 3 -3 7 88.98 1.53 1.1001 -3 3 6 89.40 1.36 1.0960 1 5 0 89.67 1.35 1.0934 -3 -3 8 89.78 1.76 1.0924 3 3 5 89.84 1.62 1.0917 -1 -5 4 89.85 1.77 1.0916 -5 -1 3 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.