Urea Guth H, Heger G, Klein S, Treutmann W, Scheringer C Zeitschrift fur Kristallographie 153 (1980) 237-254 Strukturverfeinerung von harnstoff mit neutronenbeugungsdaten bei 60, 123, 293 K und X-N- und X-X (1s2)-synthesen bei etwa 100 K Sample: T = 123 K _database_code_amcsd 0010833 CELL PARAMETERS: 5.5780 5.5780 4.6950 90.000 90.000 90.000 SPACE GROUP: P-42_1m X-RAY WAVELENGTH: 1.541838 Cell Volume: 146.081 Density (g/cm3): 1.365 MAX. ABS. INTENSITY / VOLUME**2: 9.544236851 RIR: 2.276 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 22.54 100.00 3.9442 1 1 0 4 24.79 21.82 3.5920 1 0 1 8 29.58 27.45 3.0200 1 1 1 4 32.09 6.61 2.7890 2 0 0 4 36.00 13.90 2.4946 2 1 0 8 37.51 11.43 2.3978 2 0 1 8 38.34 1.54 2.3475 0 0 2 2 40.97 4.27 2.2029 2 1 1 8 41.75 5.71 2.1637 1 0 2 8 44.94 1.75 2.0172 1 1 2 4 46.02 5.27 1.9721 2 2 0 4 50.17 5.92 1.8182 2 2 1 4 52.97 2.50 1.7287 3 0 1 8 53.61 1.48 1.7096 2 1 2 8 55.66 6.61 1.6512 3 1 1 8 61.54 1.35 1.5068 1 0 3 8 70.44 1.39 1.3368 4 0 1 8 71.11 1.71 1.3257 2 1 3 8 71.80 1.75 1.3147 3 3 0 4 76.35 1.16 1.2473 4 2 0 8 82.38 1.29 1.1707 3 1 3 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.