Mercurial > repos > marcel > caddsuite_linux_x86_64
comparison CADDSuite-1.5/data/fragments/U.db @ 15:ac342506cd4e draft
CADDSuite version 1.5
| author | Marcel Schumann <schumann.marcel@gmail.com> |
|---|---|
| date | Tue, 24 Jul 2012 11:08:49 -0400 |
| parents | |
| children |
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| 14:55c32b55c2c2 | 15:ac342506cd4e |
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| 1 <node>U | |
| 2 <node>Names | |
| 3 <node>Uracil</node> | |
| 4 <node>U</node> | |
| 5 </node> | |
| 6 <node>Atoms | |
| 7 <node>P<value>P 38.566 27.407 37.821</value></node> | |
| 8 <node>O1P<value>O 38.595 26.254 36.889</value></node> | |
| 9 <node>O2P<value>O 39.157 27.302 39.179</value></node> | |
| 10 <node>O5*<value>O 37.072 27.912 37.957</value></node> | |
| 11 <node>C5*<value>C 36.632 28.815 38.965</value></node> | |
| 12 <node>1H5*<value>H 37.233 29.724 38.959</value></node> | |
| 13 <node>2H5*<value>H 36.702 28.339 39.943</value></node> | |
| 14 <node>C4*<value>C 35.191 29.171 38.689</value></node> | |
| 15 <node>H4*<value>H 34.765 29.830 39.445</value></node> | |
| 16 <node>O4*<value>O 35.114 29.926 37.469</value></node> | |
| 17 <node>C3*<value>C 34.331 27.906 38.457</value></node> | |
| 18 <node>H3*<value>H 34.825 26.944 38.594</value></node> | |
| 19 <node>O3*<value>O 33.163 27.975 39.270</value></node> | |
| 20 <node>C2*<value>C 33.920 28.064 36.992</value></node> | |
| 21 <node>1H2*<value>H 34.360 27.260 36.402</value></node> | |
| 22 <node>2H2*<value>H 32.834 28.020 36.912</value></node> | |
| 23 <node>C1*<value>C 33.860 29.573 36.906</value></node> | |
| 24 <node>H1*<value>H 33.070 30.098 37.443</value></node> | |
| 25 <node>N1<value>N 33.730 30.096 35.526</value></node> | |
| 26 <node>C6<value>C 34.405 29.543 34.472</value></node> | |
| 27 <node>H6<value>H 35.056 28.699 34.642</value></node> | |
| 28 <node>C5<value>C 34.237 29.984 33.219</value></node> | |
| 29 <node>H5<value>H 35.018 29.323 32.073</value></node> | |
| 30 <node>C4<value>C 33.326 31.071 32.932</value></node> | |
| 31 <node>O4<value>O 33.094 31.529 31.816</value></node> | |
| 32 <node>N3<value>N 32.681 31.586 34.053</value></node> | |
| 33 <node>H3<value>H 31.993 32.416 33.893</value></node> | |
| 34 <node>C2<value>C 32.839 31.151 35.352</value></node> | |
| 35 <node>O2<value>O 32.225 31.690 36.276</value></node> | |
| 36 </node> | |
| 37 <node>Bonds | |
| 38 <node>1<value>P O1P s</value></node> | |
| 39 <node>2<value>P O2P d</value></node> | |
| 40 <node>3<value>P O5* s</value></node> | |
| 41 <node>4<value>O5* C5* s</value></node> | |
| 42 <node>5<value>C5* C4* s</value></node> | |
| 43 <node>6<value>C4* O4* s</value></node> | |
| 44 <node>7<value>C4* C3* s</value></node> | |
| 45 <node>8<value>C3* O3* s</value></node> | |
| 46 <node>9<value>C3* C2* s</value></node> | |
| 47 <node>10<value>C2* C1* s</value></node> | |
| 48 <node>11<value>C1* O4* s</value></node> | |
| 49 <node>12<value>C1* N1 s</value></node> | |
| 50 <node>13<value>N1 C6 s</value></node> | |
| 51 <node>14<value>C6 C5 d</value></node> | |
| 52 <node>15<value>C5 H5 s</value></node> | |
| 53 <node>16<value>C5 C4 s</value></node> | |
| 54 <node>17<value>C4 O4 d</value></node> | |
| 55 <node>18<value>C4 N3 s</value></node> | |
| 56 <node>19<value>N3 C2 s</value></node> | |
| 57 <node>20<value>C2 O2 d</value></node> | |
| 58 <node>21<value>C2 N1 s</value></node> | |
| 59 <node>22<value>C5* 1H5* s</value></node> | |
| 60 <node>23<value>C5* 2H5* s</value></node> | |
| 61 <node>24<value>C4* H4* s</value></node> | |
| 62 <node>25<value>C1* H1* s</value></node> | |
| 63 <node>26<value>C3* H3* s</value></node> | |
| 64 <node>27<value>C2* 1H2* s</value></node> | |
| 65 <node>28<value>C2* 2H2* s</value></node> | |
| 66 <node>29<value>C6 H6 s</value></node> | |
| 67 <node>30<value>N3 H3 s</value></node> | |
| 68 </node> | |
| 69 <node>Connections | |
| 70 <node>5-term<value>P 3-term s 1.62 0.5</value></node> | |
| 71 <node>3-term<value>O3* 5-term s 1.62 0.5</value></node> | |
| 72 </node> | |
| 73 <node>Properties | |
| 74 <node>NUCLEOTIDE</node> | |
| 75 </node> | |
| 76 <node>Variants | |
| 77 <node>U-M | |
| 78 <node>Properties | |
| 79 <node>5_PRIME</node> | |
| 80 <node>3_PRIME</node> | |
| 81 </node> | |
| 82 </node> | |
| 83 <node>Default | |
| 84 <node>Properties | |
| 85 </node> | |
| 86 </node> | |
| 87 <node>U-3 | |
| 88 <node>Properties | |
| 89 <node>3_PRIME</node> | |
| 90 </node> | |
| 91 </node> | |
| 92 <node>U-5 | |
| 93 <node>Properties | |
| 94 <node>5_PRIME</node> | |
| 95 </node> | |
| 96 </node> | |
| 97 </node> | |
| 98 </node> | |
| 99 |