I2 Harris P, Mack E, Blake F Journal of the American Chemical Society 50 (1928) 1583-1600 The Atomic Arrangement in the Crystal of Orthorhombic Iodine _cod_database_code 1010091 _database_code_amcsd 0017025 CELL PARAMETERS: 7.2550 4.7950 9.7800 90.000 90.000 90.000 SPACE GROUP: Cmca X-RAY WAVELENGTH: 1.541838 Cell Volume: 340.224 Density (g/cm3): 4.954 MAX. ABS. INTENSITY / VOLUME**2: 161.4716507 RIR: 10.612 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 18.14 1.26 4.8900 0 0 2 2 24.04 47.45 3.7025 1 1 1 8 24.54 59.16 3.6275 2 0 0 2 28.84 100.00 3.0962 1 1 2 8 35.52 10.41 2.5271 1 1 3 8 36.76 18.61 2.4450 0 0 4 2 37.51 1.74 2.3975 0 2 0 2 38.67 13.57 2.3286 0 2 1 4 42.89 9.23 2.1085 3 1 1 8 43.37 1.22 2.0862 1 1 4 8 44.70 20.48 2.0275 2 0 4 4 45.34 1.95 2.0001 2 2 0 4 45.94 25.32 1.9753 3 1 2 8 46.33 15.48 1.9596 2 2 1 8 47.05 10.62 1.9314 0 2 3 4 50.31 7.29 1.8138 4 0 0 2 50.71 3.45 1.8002 3 1 3 8 52.05 6.67 1.7572 1 1 5 8 53.53 1.09 1.7118 0 2 4 4 53.77 13.71 1.7048 2 2 3 8 59.73 1.50 1.5481 2 2 4 8 60.02 8.02 1.5414 1 3 1 8 61.15 1.77 1.5156 0 2 5 4 61.42 8.89 1.5095 1 1 6 8 62.46 1.33 1.4870 1 3 2 8 63.91 6.24 1.4567 4 0 4 4 64.25 3.27 1.4496 3 1 5 8 65.20 4.94 1.4309 4 2 1 8 66.40 3.63 1.4078 1 3 3 8 66.91 2.61 1.3984 2 2 5 8 68.20 1.98 1.3750 5 1 1 8 70.49 6.04 1.3360 5 1 2 8 71.33 5.25 1.3222 4 2 3 8 71.39 4.44 1.3212 3 3 1 8 72.68 5.02 1.3009 3 1 6 8 77.31 2.19 1.2342 3 3 3 8 78.19 1.41 1.2225 0 0 8 2 78.38 4.42 1.2200 1 3 5 8 79.22 1.60 1.2092 6 0 0 2 79.38 2.36 1.2071 0 2 7 4 80.05 1.01 1.1988 0 4 0 2 83.04 1.30 1.1630 4 2 5 8 83.43 2.32 1.1585 2 0 8 4 84.61 3.92 1.1454 2 2 7 8 85.27 1.69 1.1382 2 4 0 4 85.81 1.30 1.1324 5 1 5 8 88.81 3.11 1.1018 3 3 5 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.