Mercurial > repos > marcel > caddsuite_mac10_6

comparison CADDSuite-1.0.1/data/fragments/HOH.db @ 5:e30a41af9d2b

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author marcel
date Tue, 15 Nov 2011 10:53:16 -0500
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4:af446ca2d5c6 5:e30a41af9d2b
1 <node>HOH
2 <node>Names
3 <node>Water</node>
4 </node>
5 <node>Atoms
6 <node>O <value>O 15.118 9.944 8.582</value></node>
7 <node>1H<value>H 15.211 9.386 7.809</value></node>
8 <node>2H<value>H 14.173 9.992 8.730</value></node>
9 </node>
10 <node>Bonds
11 <node>1<value>1H O s</value></node>
12 <node>2<value>2H O s</value></node>
13 </node>
14 <node>Connections
15 </node>
16 <node>Properties
17 </node>
18 <node>Variants
19 <node>Default</node>
20 </node>
21 </node>