Boussingaultite Margulis T N, Templeton D H Zeitschrift fur Kristallographie 117 (1962) 344-357 Crystal structure and hydrogen bonding of magnesium ammonium sulfate hexahydrate _database_code_amcsd 0010599 CELL PARAMETERS: 9.3240 12.5970 6.2110 90.000 107.140 90.000 SPACE GROUP: P2_1/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 697.110 Density (g/cm3): 1.718 MAX. ABS. INTENSITY / VOLUME**2: 3.145903609 RIR: 0.596 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 12.17 4.20 7.2742 1 1 0 4 14.06 8.81 6.2985 0 2 0 2 14.93 10.08 5.9352 0 0 1 2 16.51 88.72 5.3691 0 1 1 4 17.24 40.84 5.1432 1 2 0 4 19.93 14.79 4.4549 2 0 0 2 20.56 9.31 4.3195 0 2 1 4 20.84 47.54 4.2622 -1 2 1 4 21.11 82.69 4.2077 -2 0 1 2 21.15 54.52 4.2000 2 1 0 4 21.48 46.40 4.1369 1 1 1 4 22.28 9.50 3.9909 -2 1 1 4 23.42 100.00 3.7983 1 3 0 4 24.47 1.16 3.6371 2 2 0 4 24.76 18.66 3.5959 1 2 1 4 25.99 18.40 3.4279 0 3 1 4 26.22 13.87 3.3990 -1 3 1 4 28.34 38.09 3.1493 0 4 0 2 28.37 26.53 3.1455 2 0 1 2 29.23 2.92 3.0556 2 3 0 4 29.26 26.22 3.0518 2 1 1 4 29.47 3.78 3.0310 1 3 1 4 29.65 47.82 3.0129 -1 1 2 4 30.07 5.60 2.9722 -2 3 1 4 30.11 3.51 2.9676 0 0 2 2 30.26 14.66 2.9537 -3 1 1 4 30.89 16.56 2.8945 -2 0 2 2 30.93 3.91 2.8907 3 1 0 4 30.96 3.74 2.8885 0 1 2 4 31.72 1.86 2.8210 -2 1 2 4 31.80 16.28 2.8141 2 2 1 4 32.16 38.22 2.7835 -1 2 2 4 32.18 2.90 2.7819 0 4 1 4 32.36 2.76 2.7664 -1 4 1 4 32.72 17.49 2.7366 -3 2 1 4 33.35 1.50 2.6863 3 2 0 4 33.38 1.53 2.6845 0 2 2 4 34.89 1.95 2.5716 2 4 0 4 35.10 8.90 2.5569 1 4 1 4 35.61 2.42 2.5213 -2 4 1 4 35.66 13.14 2.5175 2 3 1 4 35.99 1.21 2.4955 -1 3 2 4 36.50 30.40 2.4616 -3 3 1 4 37.10 3.18 2.4234 0 3 2 4 37.75 2.24 2.3832 -2 3 2 4 38.83 1.71 2.3191 0 5 1 4 40.38 1.38 2.2338 3 2 1 4 40.50 2.64 2.2275 4 0 0 2 40.53 14.79 2.2255 2 4 1 4 40.83 2.60 2.2103 -1 4 2 4 41.15 2.02 2.1934 4 1 0 4 41.16 1.35 2.1930 2 5 0 4 41.29 1.40 2.1866 -3 4 1 4 41.43 2.55 2.1793 -4 2 1 4 41.79 4.53 2.1615 -2 5 1 4 41.81 9.66 2.1607 3 4 0 4 41.83 10.81 2.1598 0 4 2 4 41.87 1.08 2.1575 2 1 2 4 42.41 4.82 2.1311 -2 4 2 4 43.07 13.20 2.1000 4 2 0 4 43.59 1.88 2.0765 3 3 1 4 44.58 2.08 2.0325 -4 3 1 4 44.89 4.85 2.0190 -2 1 3 4 45.45 1.35 1.9955 -4 2 2 4 45.85 1.81 1.9793 0 6 1 4 45.87 4.91 1.9784 0 0 3 2 45.98 1.46 1.9737 -1 6 1 4 46.13 1.05 1.9677 4 3 0 4 46.16 3.48 1.9664 2 5 1 4 46.43 2.39 1.9559 -1 5 2 4 46.79 1.56 1.9417 2 3 2 4 46.84 4.53 1.9394 -3 5 1 4 47.31 5.20 1.9212 3 5 0 4 47.33 3.67 1.9206 0 5 2 4 47.68 9.07 1.9074 -3 1 3 4 47.87 1.05 1.9004 -2 5 2 4 48.06 2.15 1.8932 1 6 1 4 48.46 3.59 1.8786 -2 6 1 4 48.71 2.00 1.8693 -4 4 1 4 49.18 2.19 1.8526 -1 3 3 4 49.41 1.63 1.8447 -5 1 1 4 49.57 7.76 1.8389 -2 3 3 4 49.93 1.67 1.8266 4 2 1 4 50.16 4.67 1.8186 4 4 0 4 50.65 2.22 1.8024 1 1 3 4 50.78 3.06 1.7979 2 4 2 4 51.03 5.13 1.7897 0 3 3 4 51.50 2.20 1.7745 -3 5 2 4 51.62 1.50 1.7705 3 2 2 4 51.82 6.19 1.7644 5 1 0 4 52.29 1.43 1.7495 1 2 3 4 52.63 3.67 1.7389 -1 6 2 4 52.68 2.28 1.7375 4 3 1 4 52.81 5.09 1.7336 3 5 1 4 53.41 4.39 1.7154 -2 4 3 4 53.67 1.48 1.7077 -4 5 1 4 53.95 2.00 1.6995 -2 6 2 4 54.14 1.62 1.6940 -4 2 3 4 54.96 1.62 1.6707 1 3 3 4 55.03 1.34 1.6688 4 5 0 4 55.18 1.60 1.6645 1 7 1 4 55.54 1.64 1.6546 -2 7 1 4 55.61 1.00 1.6528 2 5 2 4 56.06 2.54 1.6404 5 3 0 4 56.24 1.74 1.6358 -5 3 2 4 56.37 1.26 1.6322 4 4 1 4 56.75 2.40 1.6222 -4 3 3 4 57.03 1.07 1.6148 -4 5 2 4 59.33 2.67 1.5575 -4 6 1 4 59.37 1.40 1.5567 -1 7 2 4 59.40 1.67 1.5560 0 5 3 4 59.59 1.15 1.5515 -2 0 4 2 60.08 1.19 1.5399 -2 1 4 4 60.27 2.08 1.5355 -4 4 3 4 60.28 1.54 1.5353 5 2 1 4 60.89 1.08 1.5213 4 5 1 4 62.50 1.73 1.4861 -4 6 2 4 62.84 3.41 1.4789 1 7 2 4 62.98 3.10 1.4760 -3 2 4 4 64.16 1.34 1.4516 -5 5 2 4 64.47 1.37 1.4454 6 2 0 4 64.49 2.07 1.4450 -1 3 4 4 64.87 3.42 1.4374 3 7 1 4 65.32 1.41 1.4286 -6 3 2 4 67.60 2.21 1.3859 3 6 2 4 68.16 2.44 1.3757 1 6 3 4 69.03 1.74 1.3605 -1 9 1 4 69.65 1.17 1.3499 6 0 1 2 69.92 1.79 1.3453 -5 1 4 4 70.11 1.59 1.3423 6 1 1 4 71.40 1.53 1.3211 -2 5 4 4 71.47 1.28 1.3200 -7 1 1 4 72.52 1.77 1.3034 -4 8 1 4 74.20 1.35 1.2780 1 4 4 4 75.00 1.32 1.2664 7 1 0 4 84.65 1.30 1.1450 5 2 3 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.