Pautovite Mitchell R H, Ross K C, Potter E G Journal of Solid State Chemistry 177 (2004) 1867-1872 Crystal structures of CsFe2S3 and RbFe2S3: Synthetic analogs of rasvumite KFe2S3 Locality: synthetic _database_code_amcsd 0014048 CELL PARAMETERS: 9.3268 11.3693 5.4592 90.000 90.000 90.000 SPACE GROUP: Cmcm X-RAY WAVELENGTH: 1.541838 Cell Volume: 578.889 Density (g/cm3): 3.372 MAX. ABS. INTENSITY / VOLUME**2: 35.15295990 RIR: 3.395 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.27 35.46 7.2109 1 1 0 4 15.59 36.76 5.6846 0 2 0 2 20.40 17.82 4.3525 1 1 1 8 22.58 5.75 3.9375 0 2 1 4 24.69 21.27 3.6054 2 2 0 4 25.37 54.58 3.5110 1 3 0 4 29.69 100.00 3.0085 2 2 1 8 29.79 20.95 2.9988 3 1 0 4 30.27 4.28 2.9530 1 3 1 8 32.81 2.50 2.7296 0 0 2 2 34.11 12.07 2.6284 3 1 1 8 35.15 20.83 2.5528 1 1 2 8 35.61 7.99 2.5211 0 4 1 4 36.52 22.52 2.4606 0 2 2 4 37.04 2.31 2.4270 2 4 0 4 37.41 3.56 2.4036 3 3 0 4 38.20 7.20 2.3557 2 0 2 4 38.61 1.79 2.3317 4 0 0 2 40.68 3.96 2.2178 2 4 1 8 41.88 11.27 2.1573 4 2 0 4 44.23 2.83 2.0478 1 5 1 8 44.90 12.98 2.0186 3 1 2 8 45.19 2.95 2.0063 4 2 1 8 46.11 28.00 1.9688 0 4 2 4 48.01 6.06 1.8949 0 6 0 2 49.52 1.14 1.8407 5 1 0 4 49.67 15.09 1.8353 3 5 0 4 50.60 18.43 1.8039 3 3 2 8 50.64 15.21 1.8027 4 4 0 4 51.55 21.09 1.7729 4 0 2 4 51.82 1.43 1.7644 1 1 3 8 52.10 1.27 1.7555 2 6 0 4 52.61 2.60 1.7397 3 5 1 8 53.35 9.59 1.7172 1 5 2 8 53.53 3.74 1.7118 4 4 1 8 54.19 2.22 1.6925 4 2 2 8 54.86 1.76 1.6736 5 3 0 4 54.94 2.71 1.6712 2 6 1 8 56.66 10.56 1.6245 2 2 3 8 57.61 1.35 1.6001 5 3 1 8 59.41 1.89 1.5557 3 1 3 8 59.46 2.79 1.5545 6 0 0 2 60.27 4.11 1.5355 1 7 1 8 60.40 1.29 1.5326 0 4 3 4 62.95 5.52 1.4765 2 6 2 8 64.44 4.88 1.4459 6 2 1 8 64.76 2.37 1.4396 3 7 0 4 65.41 2.30 1.4268 5 3 2 8 65.70 1.37 1.4212 0 8 0 2 67.26 1.35 1.3920 3 7 1 8 67.90 2.27 1.3804 1 7 2 8 68.78 4.45 1.3648 0 0 4 2 69.09 1.04 1.3594 2 8 0 4 71.26 1.60 1.3233 7 1 0 4 71.83 3.58 1.3142 6 2 2 8 73.09 4.44 1.2946 4 6 2 8 73.66 1.28 1.2861 7 1 1 8 74.02 1.14 1.2807 4 4 3 8 74.31 1.15 1.2764 2 2 4 8 74.52 1.40 1.2733 3 7 2 8 74.61 3.36 1.2721 1 3 4 8 75.66 1.93 1.2570 7 3 0 4 76.03 2.24 1.2518 1 9 0 4 76.72 2.01 1.2422 3 1 4 8 78.38 2.29 1.2200 6 4 2 8 79.80 2.19 1.2018 6 6 0 4 79.82 1.46 1.2016 1 7 3 8 80.33 2.26 1.1952 5 7 1 8 80.69 1.30 1.1908 7 1 2 8 83.55 1.87 1.1572 6 2 3 8 83.89 1.95 1.1534 4 2 4 8 88.09 1.16 1.1089 4 8 2 8 88.23 1.47 1.1074 0 6 4 4 89.48 3.57 1.0952 3 5 4 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.