Berthierite Bente K, Edenharter A Zeitschrift fur Kristallographie 185 (1989) 31-33 Rontgenographische strukturanalyse von MnSb2S4 und strukturverfeinerung von berthierit, FeSb2S4 _database_code_amcsd 0010987 CELL PARAMETERS: 11.4230 14.1740 3.7650 90.000 90.000 90.000 SPACE GROUP: Pnam X-RAY WAVELENGTH: 1.541838 Cell Volume: 609.590 Density (g/cm3): 4.659 MAX. ABS. INTENSITY / VOLUME**2: 25.96460342 RIR: 1.815 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.49 33.31 7.0870 0 2 0 2 14.71 4.47 6.0221 1 2 0 4 15.51 3.08 5.7115 2 0 0 2 16.74 6.58 5.2976 2 1 0 4 20.34 45.20 4.3660 1 3 0 4 24.20 98.16 3.6773 3 1 0 4 24.45 55.77 3.6405 2 3 0 4 25.13 22.00 3.5435 0 4 0 2 25.69 28.64 3.4671 1 1 1 8 26.33 43.84 3.3844 1 4 0 4 26.57 1.65 3.3542 3 2 0 4 27.95 100.00 3.1924 1 2 1 8 29.10 36.39 3.0689 2 1 1 8 29.67 54.26 3.0111 2 4 0 4 30.14 9.86 2.9647 3 3 0 4 31.12 89.61 2.8735 2 2 1 8 33.84 1.33 2.6488 4 2 0 4 34.08 91.68 2.6307 3 1 1 8 34.26 90.40 2.6171 2 3 1 8 34.58 2.61 2.5940 3 4 0 4 35.35 30.07 2.5392 2 5 0 4 35.67 18.87 2.5170 1 4 1 8 35.86 10.70 2.5045 3 2 1 8 36.77 1.85 2.4440 4 3 0 4 38.09 2.52 2.3623 0 6 0 2 38.28 7.00 2.3515 2 4 1 8 38.66 4.31 2.3293 3 3 1 8 38.93 6.71 2.3134 1 6 0 4 39.61 6.85 2.2753 4 0 1 4 39.64 11.10 2.2738 3 5 0 4 39.80 4.51 2.2646 0 5 1 4 39.97 1.56 2.2555 5 1 0 4 40.14 23.30 2.2465 4 1 1 8 40.57 1.15 2.2235 4 4 0 4 40.61 16.42 2.2214 1 5 1 8 41.36 5.32 2.1830 2 6 0 4 41.53 27.80 2.1744 5 2 0 4 41.69 16.19 2.1664 4 2 1 8 42.31 1.65 2.1361 3 4 1 8 42.96 4.78 2.1052 2 5 1 8 44.03 3.28 2.0568 5 3 0 4 44.18 30.50 2.0500 4 3 1 8 45.06 17.27 2.0119 4 5 0 4 45.17 14.77 2.0074 3 6 0 4 45.49 5.58 1.9938 1 7 0 4 46.05 3.61 1.9710 1 6 1 8 46.67 4.53 1.9464 3 5 1 8 47.34 25.37 1.9201 5 4 0 4 47.49 3.03 1.9146 4 4 1 8 47.65 2.29 1.9085 2 7 0 4 47.77 2.51 1.9038 6 0 0 2 48.19 13.72 1.8885 2 6 1 8 48.34 8.94 1.8829 5 2 1 8 48.35 44.49 1.8825 0 0 2 2 50.14 1.75 1.8194 0 2 2 4 50.57 28.05 1.8050 5 3 1 8 51.23 34.45 1.7833 0 7 1 4 51.50 2.59 1.7744 4 5 1 8 51.60 21.29 1.7713 3 6 1 8 51.89 22.33 1.7620 1 7 1 8 52.97 5.42 1.7287 1 3 2 8 53.58 6.04 1.7105 5 4 1 8 53.86 3.92 1.7023 2 7 1 8 53.97 16.19 1.6990 6 0 1 4 54.20 2.24 1.6922 2 8 0 4 54.78 17.31 1.6757 3 1 2 8 54.91 10.14 1.6722 2 3 2 8 55.25 4.26 1.6625 0 4 2 4 55.89 8.55 1.6451 1 4 2 8 56.12 1.29 1.6388 4 6 1 8 56.79 5.92 1.6211 7 1 0 4 57.28 3.51 1.6084 5 5 1 8 57.36 1.75 1.6064 3 8 0 4 57.66 4.94 1.5987 6 3 1 8 57.76 12.45 1.5962 2 4 2 8 58.00 10.21 1.5902 7 2 0 4 58.04 2.34 1.5892 3 3 2 8 58.39 1.57 1.5805 6 5 0 4 59.23 8.43 1.5601 1 9 0 4 59.93 6.70 1.5435 2 8 1 8 60.43 6.00 1.5320 6 4 1 8 61.30 9.26 1.5122 2 5 2 8 61.60 8.93 1.5055 4 8 0 4 62.36 4.32 1.4890 7 1 1 8 63.50 3.33 1.4649 7 2 1 8 63.74 2.53 1.4601 1 6 2 8 63.97 2.51 1.4553 3 9 0 4 64.23 4.36 1.4500 3 5 2 8 65.47 2.11 1.4256 2 6 2 8 65.59 11.65 1.4232 5 2 2 8 65.73 1.60 1.4207 8 1 0 4 66.47 1.55 1.4066 1 10 0 4 66.52 4.94 1.4058 5 7 1 8 66.82 1.95 1.4001 5 8 0 4 66.84 1.80 1.3997 8 2 0 4 67.44 1.37 1.3887 5 3 2 8 67.53 4.05 1.3870 6 7 0 4 67.96 2.49 1.3793 6 6 1 8 67.97 4.26 1.3792 7 4 1 8 68.17 2.17 1.3757 2 10 0 4 68.23 7.86 1.3746 4 5 2 8 68.31 6.89 1.3732 3 6 2 8 68.56 2.66 1.3688 1 7 2 8 68.67 4.03 1.3668 8 3 0 4 69.99 12.51 1.3442 5 4 2 8 70.08 1.72 1.3427 7 6 0 4 70.23 1.12 1.3402 2 7 2 8 70.33 1.22 1.3386 6 0 2 4 70.95 1.43 1.3284 3 10 0 4 71.22 5.22 1.3239 7 5 1 8 72.96 2.08 1.2967 5 9 0 4 73.26 1.11 1.2921 2 10 1 8 73.75 2.27 1.2848 8 3 1 8 74.71 1.00 1.2706 7 7 0 4 74.78 2.13 1.2696 4 10 0 4 75.12 2.04 1.2646 7 6 1 8 75.55 1.33 1.2585 2 8 2 8 75.96 6.36 1.2527 3 10 1 8 76.20 1.23 1.2494 8 4 1 8 77.73 3.71 1.2286 1 2 3 8 77.74 3.84 1.2284 7 1 2 8 77.93 5.65 1.2260 5 9 1 8 78.23 1.16 1.2220 3 8 2 8 78.29 1.42 1.2212 2 1 3 8 78.45 6.55 1.2191 0 11 1 4 78.78 6.81 1.2148 7 2 2 8 78.98 1.38 1.2122 1 11 1 8 79.12 1.07 1.2104 6 5 2 8 79.33 2.76 1.2078 8 5 1 8 79.33 3.72 1.2078 2 2 3 8 79.85 5.74 1.2012 1 9 2 8 80.07 6.00 1.1984 9 1 1 8 80.94 4.83 1.1877 3 1 3 8 81.05 4.90 1.1865 2 3 3 8 81.10 1.41 1.1858 9 2 1 8 81.86 1.14 1.1767 1 4 3 8 81.94 6.55 1.1758 4 8 2 8 83.21 1.02 1.1611 3 11 1 8 83.59 1.06 1.1567 2 12 0 4 84.07 1.89 1.1514 3 9 2 8 84.63 1.78 1.1452 4 1 3 8 84.93 1.25 1.1418 1 5 3 8 85.23 1.13 1.1386 10 1 0 4 85.65 1.30 1.1341 4 2 3 8 85.66 1.29 1.1340 8 1 2 8 86.25 1.41 1.1277 10 2 0 4 86.34 1.33 1.1268 1 10 2 8 86.66 1.62 1.1234 5 8 2 8 86.68 1.49 1.1233 8 2 2 8 87.18 1.93 1.1181 9 6 0 4 87.32 3.36 1.1167 6 7 2 8 87.34 2.88 1.1164 4 3 3 8 87.52 1.95 1.1146 8 7 1 8 87.91 1.85 1.1107 2 10 2 8 88.26 3.67 1.1072 9 5 1 8 88.38 3.44 1.1060 8 3 2 8 89.70 1.53 1.0931 7 6 2 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.