Mercurial > repos > marcel > caddsuite_mac10_6

annotate CADDSuite/data/fragments/U.db @ 0:8ce0411aaeb3

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Uploaded CADDSuite version 0.94
author marcel
date Sun, 26 Jun 2011 14:01:09 -0400
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8ce0411aaeb3 Uploaded CADDSuite version 0.94
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1 <node>U
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2 <node>Names
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3 <node>Uracil</node>
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4 <node>U</node>
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5 </node>
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6 <node>Atoms
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7 <node>P<value>P 38.566 27.407 37.821</value></node>
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8 <node>O1P<value>O 38.595 26.254 36.889</value></node>
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9 <node>O2P<value>O 39.157 27.302 39.179</value></node>
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10 <node>O5*<value>O 37.072 27.912 37.957</value></node>
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11 <node>C5*<value>C 36.632 28.815 38.965</value></node>
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12 <node>1H5*<value>H 37.233 29.724 38.959</value></node>
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13 <node>2H5*<value>H 36.702 28.339 39.943</value></node>
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14 <node>C4*<value>C 35.191 29.171 38.689</value></node>
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15 <node>H4*<value>H 34.765 29.830 39.445</value></node>
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16 <node>O4*<value>O 35.114 29.926 37.469</value></node>
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17 <node>C3*<value>C 34.331 27.906 38.457</value></node>
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18 <node>H3*<value>H 34.825 26.944 38.594</value></node>
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19 <node>O3*<value>O 33.163 27.975 39.270</value></node>
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20 <node>C2*<value>C 33.920 28.064 36.992</value></node>
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21 <node>1H2*<value>H 34.360 27.260 36.402</value></node>
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22 <node>2H2*<value>H 32.834 28.020 36.912</value></node>
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23 <node>C1*<value>C 33.860 29.573 36.906</value></node>
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24 <node>H1*<value>H 33.070 30.098 37.443</value></node>
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25 <node>N1<value>N 33.730 30.096 35.526</value></node>
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26 <node>C6<value>C 34.405 29.543 34.472</value></node>
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27 <node>H6<value>H 35.056 28.699 34.642</value></node>
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28 <node>C5<value>C 34.237 29.984 33.219</value></node>
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29 <node>H5<value>H 35.018 29.323 32.073</value></node>
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30 <node>C4<value>C 33.326 31.071 32.932</value></node>
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31 <node>O4<value>O 33.094 31.529 31.816</value></node>
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32 <node>N3<value>N 32.681 31.586 34.053</value></node>
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33 <node>H3<value>H 31.993 32.416 33.893</value></node>
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34 <node>C2<value>C 32.839 31.151 35.352</value></node>
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35 <node>O2<value>O 32.225 31.690 36.276</value></node>
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36 </node>
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37 <node>Bonds
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38 <node>1<value>P O1P s</value></node>
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39 <node>2<value>P O2P d</value></node>
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40 <node>3<value>P O5* s</value></node>
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41 <node>4<value>O5* C5* s</value></node>
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42 <node>5<value>C5* C4* s</value></node>
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43 <node>6<value>C4* O4* s</value></node>
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44 <node>7<value>C4* C3* s</value></node>
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45 <node>8<value>C3* O3* s</value></node>
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46 <node>9<value>C3* C2* s</value></node>
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47 <node>10<value>C2* C1* s</value></node>
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48 <node>11<value>C1* O4* s</value></node>
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49 <node>12<value>C1* N1 s</value></node>
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50 <node>13<value>N1 C6 s</value></node>
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51 <node>14<value>C6 C5 d</value></node>
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52 <node>15<value>C5 H5 s</value></node>
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53 <node>16<value>C5 C4 s</value></node>
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54 <node>17<value>C4 O4 d</value></node>
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55 <node>18<value>C4 N3 s</value></node>
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56 <node>19<value>N3 C2 s</value></node>
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57 <node>20<value>C2 O2 d</value></node>
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58 <node>21<value>C2 N1 s</value></node>
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59 <node>22<value>C5* 1H5* s</value></node>
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60 <node>23<value>C5* 2H5* s</value></node>
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61 <node>24<value>C4* H4* s</value></node>
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62 <node>25<value>C1* H1* s</value></node>
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63 <node>26<value>C3* H3* s</value></node>
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64 <node>27<value>C2* 1H2* s</value></node>
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65 <node>28<value>C2* 2H2* s</value></node>
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66 <node>29<value>C6 H6 s</value></node>
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67 <node>30<value>N3 H3 s</value></node>
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68 </node>
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69 <node>Connections
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70 <node>5-term<value>P 3-term s 1.62 0.5</value></node>
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71 <node>3-term<value>O3* 5-term s 1.62 0.5</value></node>
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72 </node>
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73 <node>Properties
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74 <node>NUCLEOTIDE</node>
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75 </node>
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76 <node>Variants
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77 <node>U-M
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78 <node>Properties
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79 <node>5_PRIME</node>
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80 <node>3_PRIME</node>
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81 </node>
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82 </node>
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83 <node>Default
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84 <node>Properties
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85 </node>
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86 </node>
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87 <node>U-3
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88 <node>Properties
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89 <node>3_PRIME</node>
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90 </node>
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91 </node>
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92 <node>U-5
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93 <node>Properties
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94 <node>5_PRIME</node>
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95 </node>
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96 </node>
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97 </node>
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98 </node>
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