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Uricite |
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Ringertz H |
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Acta Crystallographica 20 (1966) 397-403 |
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The molecular and crystal structure of uric acid |
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Locality: synthetic |
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_database_code_amcsd 0009301 |
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14.464 7.403 6.208 90 65.10 90 P2_1/a |
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atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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C1 .39588 .42200 .87757 .00318 .0091 .0188 -.00039 -.0045 -.0002 |
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C2 .36545 .26650 .58328 .00240 .0074 .0181 -.00026 -.0037 .0006 |
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C3 .46484 .21754 .46398 .00234 .0102 .0180 .00002 -.0034 -.0007 |
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C4 .53826 .26650 .54745 .00225 .0095 .0190 -.00047 -.0032 .0021 |
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C5 .38108 .11110 .26193 .00183 .0100 .0161 -.00017 -.0027 .0005 |
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H1 .546 .401 .820 |
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H2 .268 .428 .837 |
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H3 .550 .061 .146 |
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H4 .257 .213 .492 |
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N1 .49430 .36422 .75924 .00297 .0109 .0162 -.00069 -.0046 -.0008 |
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N2 .32883 .36683 .78474 .00209 .0114 .0191 .00028 -.0036 -.0019 |
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N3 .47474 .12343 .26222 .00185 .0118 .0169 -.00002 -.0029 -.0021 |
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N4 .31415 .20174 .45958 .00185 .0110 .0165 .00065 -.0029 -.0010 |
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O1 .36783 .51657 .05543 .00406 .0170 .0225 .00029 -.0054 -.0048 |
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O2 .63000 .23031 .45254 .00174 .0176 .0253 -.00058 -.0036 -.0002 |
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O3 .35938 .03350 .11202 .00271 .0147 .0186 .00005 -.0033 -.0040 |
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