Indium-fluor-eckermannite Raudsepp M, Turnock A C, Hawthorne F C American Mineralogist 72 (1987) 959-964 Characterization of cation ordering in synthetic scandium-fluor-eckermannite, indium-fluor-eckermannite, and scandium-fluor-nyboite by Rietveld structure refinement Sample: FInEC-A3 _database_code_amcsd 0001116 CELL PARAMETERS: 9.8527 18.0966 5.2928 90.000 103.521 90.000 SPACE GROUP: C2/m X-RAY WAVELENGTH: 1.541838 Cell Volume: 917.553 Density (g/cm3): 3.229 MAX. ABS. INTENSITY / VOLUME**2: 7.522154363 RIR: 0.759 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.78 15.72 9.0483 0 2 0 2 10.45 71.65 8.4665 1 1 0 4 17.23 12.98 5.1461 0 0 1 2 17.37 12.54 5.1045 1 3 0 4 18.23 21.42 4.8664 -1 1 1 4 19.62 26.70 4.5241 0 4 0 2 19.85 17.66 4.4732 0 2 1 4 20.99 5.85 4.2333 2 2 0 4 21.99 1.74 4.0424 1 1 1 4 22.20 7.24 4.0039 -2 0 1 2 22.96 2.08 3.8733 -1 3 1 4 24.31 14.90 3.6615 -2 2 1 4 26.07 98.10 3.4174 1 3 1 4 26.32 10.51 3.3857 1 5 0 4 27.11 30.00 3.2890 2 4 0 4 28.27 3.32 3.1572 2 0 1 2 28.38 63.26 3.1446 3 1 0 4 29.62 2.52 3.0161 0 6 0 2 29.69 1.06 3.0092 -3 1 1 4 29.98 12.55 2.9810 2 2 1 4 30.38 1.33 2.9423 -1 5 1 4 31.71 33.61 2.8222 3 3 0 4 32.84 100.00 2.7269 1 5 1 4 32.89 41.20 2.7231 -3 3 1 4 34.47 39.91 2.6021 0 6 1 4 34.87 2.90 2.5731 0 0 2 2 35.16 6.22 2.5523 2 6 0 4 35.54 64.23 2.5263 -2 0 2 2 35.98 1.15 2.4959 1 7 0 4 36.30 2.93 2.4749 0 2 2 4 36.77 1.76 2.4445 3 1 1 4 36.94 3.41 2.4332 -2 2 2 4 37.12 3.37 2.4221 -1 3 2 4 37.56 1.27 2.3949 4 0 0 2 38.59 29.09 2.3331 -3 5 1 4 38.88 4.41 2.3163 -4 2 1 4 38.90 2.06 2.3152 4 2 0 4 39.14 21.17 2.3015 -1 7 1 4 39.46 5.35 2.2835 3 3 1 4 39.83 16.86 2.2631 -3 1 2 4 40.92 3.37 2.2057 -2 4 2 4 41.15 6.11 2.1939 1 7 1 4 41.40 37.05 2.1809 2 6 1 4 42.36 12.10 2.1335 -3 3 2 4 43.65 20.07 2.0736 2 0 2 2 43.71 1.80 2.0708 0 8 1 4 44.44 14.55 2.0386 3 5 1 4 44.84 1.87 2.0212 2 2 2 4 45.30 10.66 2.0020 -4 0 2 2 45.35 1.34 1.9998 4 0 1 2 46.03 4.97 1.9716 1 5 2 4 46.09 1.70 1.9695 -2 8 1 4 46.13 9.22 1.9679 1 9 0 4 46.39 1.06 1.9575 0 6 2 4 46.51 5.96 1.9527 4 2 1 4 46.91 1.66 1.9367 -2 6 2 4 47.74 4.30 1.9053 5 1 0 4 48.28 3.58 1.8850 2 4 2 4 48.52 4.44 1.8761 -4 6 1 4 48.54 1.35 1.8755 4 6 0 4 48.74 2.42 1.8682 -1 9 1 4 49.08 3.88 1.8562 -5 3 1 4 49.81 4.12 1.8307 -4 4 2 4 50.43 2.96 1.8097 0 10 0 2 50.44 4.12 1.8093 1 9 1 4 52.62 1.59 1.7394 1 7 2 4 52.72 6.82 1.7364 -5 1 2 4 53.35 2.50 1.7173 -5 5 1 4 54.18 2.29 1.6929 2 10 0 4 54.25 11.07 1.6909 -1 3 3 4 54.44 1.09 1.6854 0 2 3 4 54.45 10.34 1.6852 -2 8 2 4 54.66 3.20 1.6790 -3 9 1 4 54.74 1.63 1.6769 -3 1 3 4 54.78 1.59 1.6758 -5 3 2 4 55.06 1.13 1.6680 -4 6 2 4 55.10 28.54 1.6667 4 6 1 4 55.90 1.43 1.6449 -4 8 1 4 55.91 12.02 1.6445 4 8 0 4 56.78 11.41 1.6214 1 11 0 4 57.16 1.34 1.6115 5 3 1 4 57.18 1.82 1.6109 -6 2 1 4 57.74 5.64 1.5966 6 0 0 2 58.25 22.30 1.5839 -1 5 3 4 58.46 5.96 1.5786 4 0 2 2 58.72 1.25 1.5723 6 2 0 4 58.76 1.77 1.5714 -5 5 2 4 58.82 3.79 1.5700 2 10 1 4 59.05 1.83 1.5643 -1 11 1 4 59.36 1.29 1.5568 -4 2 3 4 59.44 1.16 1.5551 4 2 2 4 60.58 1.64 1.5285 2 8 2 4 60.60 4.93 1.5281 1 9 2 4 60.69 9.98 1.5259 -6 0 2 2 61.04 5.09 1.5180 5 5 1 4 61.23 19.63 1.5137 -2 6 3 4 61.49 10.83 1.5080 0 12 0 2 62.27 2.70 1.4911 0 6 3 4 62.29 2.46 1.4905 4 4 2 4 62.48 4.15 1.4865 2 2 3 4 62.71 1.20 1.4816 1 5 3 4 62.77 1.21 1.4802 0 10 2 4 63.21 1.19 1.4712 -2 10 2 4 63.62 5.24 1.4625 3 11 0 4 63.96 3.34 1.4557 -1 7 3 4 64.44 2.76 1.4458 -6 4 2 4 64.53 2.89 1.4441 -4 10 1 4 64.54 1.24 1.4438 4 10 0 4 64.80 30.08 1.4388 -6 6 1 4 65.88 3.15 1.4178 -5 3 3 4 66.83 1.71 1.3999 -4 6 3 4 66.99 1.05 1.3969 -1 11 2 4 67.65 12.30 1.3849 5 1 2 4 68.49 1.25 1.3700 -7 3 1 4 68.80 3.02 1.3646 7 1 0 4 68.86 1.15 1.3634 2 10 2 4 69.44 4.85 1.3536 5 3 2 4 69.48 4.82 1.3529 -5 5 3 4 69.76 5.08 1.3481 2 6 3 4 69.77 6.45 1.3479 1 11 2 4 70.09 1.16 1.3425 -4 10 2 4 70.57 2.20 1.3346 7 3 0 4 70.59 3.54 1.3343 -3 11 2 4 71.16 1.69 1.3250 -1 9 3 4 71.49 1.16 1.3197 1 13 1 4 71.61 3.19 1.3177 -5 9 2 4 71.92 5.87 1.3129 -1 1 4 4 72.02 6.72 1.3112 -7 5 1 4 72.67 4.67 1.3011 0 12 2 4 73.08 14.21 1.2949 -2 12 2 4 73.10 1.00 1.2946 4 8 2 4 73.11 1.61 1.2944 6 6 1 4 73.31 1.36 1.2914 3 5 3 4 73.63 4.97 1.2865 0 0 4 2 73.66 2.83 1.2861 -1 3 4 4 74.33 1.27 1.2761 4 12 0 4 75.10 1.24 1.2650 -6 8 2 4 75.23 5.19 1.2631 -4 0 4 2 75.89 1.18 1.2537 0 14 1 4 76.52 1.43 1.2449 0 10 3 4 77.36 1.07 1.2336 6 0 2 2 77.49 1.57 1.2318 -1 13 2 4 77.62 2.30 1.2301 -2 14 1 4 78.64 1.13 1.2166 -4 4 4 4 80.15 2.41 1.1975 8 0 0 2 80.20 7.39 1.1969 -5 11 2 4 81.33 1.00 1.1831 7 5 1 4 81.96 3.77 1.1755 2 0 4 2 82.73 1.13 1.1665 -6 10 2 4 83.44 1.15 1.1584 1 15 1 4 84.84 1.13 1.1428 5 9 2 4 85.91 3.47 1.1313 7 9 0 4 85.96 1.35 1.1308 5 3 3 4 86.40 2.56 1.1262 5 13 0 4 87.16 1.28 1.1183 0 8 4 4 88.49 2.12 1.1049 3 1 4 4 88.51 1.61 1.1047 0 16 1 4 88.69 1.55 1.1029 3 13 2 4 88.84 1.27 1.1015 -7 7 3 4 89.29 2.12 1.0971 5 5 3 4 89.98 2.59 1.0904 4 12 2 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.