Mercurial > repos > marcel > caddsuite_mac10_6

diff CADDSuite-1.6/data/fragments/HOH.db @ 8:dbb480e39d95 draft

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author marcel
date Sat, 15 Dec 2012 13:15:46 -0500
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--- /dev/null	Thu Jan 01 00:00:00 1970 +0000
+++ b/CADDSuite-1.6/data/fragments/HOH.db	Sat Dec 15 13:15:46 2012 -0500
@@ -0,0 +1,21 @@
+<node>HOH
+	<node>Names
+ 		<node>Water</node>
+	</node>
+	<node>Atoms
+		<node>O <value>O  15.118 9.944 8.582</value></node>
+		<node>1H<value>H  15.211 9.386 7.809</value></node>
+		<node>2H<value>H  14.173 9.992 8.730</value></node>
+	</node>
+	<node>Bonds
+		<node>1<value>1H O s</value></node>
+		<node>2<value>2H O s</value></node>
+	</node>
+	<node>Connections
+	</node>
+	<node>Properties
+	</node>
+	<node>Variants
+		<node>Default</node>
+	</node>
+</node>