annotate CADDSuite/data/fragments/Benzene-Skeleton.db @ 0:8ce0411aaeb3

Uploaded CADDSuite version 0.94
author marcel
date Sun, 26 Jun 2011 14:01:09 -0400
parents
children
Ignore whitespace changes - Everywhere: Within whitespace: At end of lines:
rev   line source
0
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
1 <node>Benzene-Skeleton
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
2 <node>Names
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
3 <node>Benzene-Skeleton</node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
4 </node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
5 <node>Atoms
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
6 <node>C1<value>C 0.066248 -1.287634 0.144514</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
7 <node>C2<value>C 0.057081 -0.613884 1.337852</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
8 <node>C3<value>C 0.045766 0.796088 1.307799</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
9 <node>C4<value>C 0.054862 1.462219 0.071058</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
10 <node>C5<value>C 0.073086 0.728404 -1.129738</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
11 <node>C6<value>C 0.091744 -0.671622 -1.107443</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
12 </node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
13 <node>Bonds
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
14 <node>1<value>C1 C2 s</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
15 <node>2<value>C2 C3 d</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
16 <node>3<value>C3 C4 s</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
17 <node>4<value>C4 C5 d</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
18 <node>5<value>C5 C6 s</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
19 <node>6<value>C6 C1 d</value></node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
20 </node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
21 <node>Properties
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
22 </node>
8ce0411aaeb3 Uploaded CADDSuite version 0.94
marcel
parents:
diff changeset
23 </node>