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Urea |
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Guth H, Heger G, Klein S, Treutmann W, Scheringer C |
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Zeitschrift fur Kristallographie 153 (1980) 237-254 |
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Strukturverfeinerung von harnstoff mit neutronenbeugungsdaten bei |
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60, 123, 293 K und X-N- und X-X (1s2)-synthesen bei etwa 100 K |
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Sample: T = 123 K |
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_database_code_amcsd 0010833 |
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5.578 5.578 4.695 90 90 90 P-42_1m |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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C 0 .5 .3290 .0174 .0174 .0116 .0008 0 0 |
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O 0 .5 .5970 .0220 .0220 .0119 .0020 0 0 |
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N .1445 .6445 .1791 .0333 .0333 .0149 -.0161 .0002 .0002 |
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H1 .2561 .7561 .2855 .0484 .0484 .0308 -.0231 -.0027 -.0027 |
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H2 .1429 .6429 -.0370 .0485 .0485 .0184 -.0159 .0025 .0025 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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