<!--

       Copyright 2011 Peter Murray-Rust et. al.

       Licensed under the Apache License, Version 2.0 (the "License");
       you may not use this file except in compliance with the License.
       You may obtain a copy of the License at

           http://www.apache.org/licenses/LICENSE-2.0

       Unless required by applicable law or agreed to in writing, software
       distributed under the License is distributed on an "AS IS" BASIS,
       WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
       See the License for the specific language governing permissions and
       limitations under the License.

-->


<molecule id="m1" xmlns="http://www.xml-cml.org/schema">
  <atomArray>
    <atom id="a1" elementType="O">
      <label value="O"/>
    </atom>
    <atom id="a22" elementType="H"/>
    <atom id="a13" elementType="N" hydrogenCount="0">
      <label value="1"/>
      <label value="N"/>
    </atom>
    <atom id="a14" elementType="N" hydrogenCount="0">
      <label value="2"/>
      <label value="N'"/>
    </atom>
    <atom id="a15" elementType="N" hydrogenCount="0">
      <label value="3"/>
      <label value="N''"/>
    </atom>
    <atom id="a16" elementType="C" hydrogenCount="0">
      <label value="3a"/>
    </atom>
    <atom id="a17" elementType="C">
      <label value="4"/>
    </atom>
    <atom id="a18" elementType="C">
      <label value="5"/>
    </atom>
    <atom id="a19" elementType="C">
      <label value="6"/>
    </atom>
    <atom id="a20" elementType="C">
      <label value="7"/>
    </atom>
    <atom id="a21" elementType="C" hydrogenCount="0">
      <label value="7a"/>
    </atom>
    <atom id="a23" elementType="H"/>
    <atom id="a24" elementType="H"/>
    <atom id="a25" elementType="H"/>
    <atom id="a26" elementType="H"/>
  </atomArray>
  <bondArray>
    <bond atomRefs2="a1 a22" order="1"/>
    <bond atomRefs2="a15 a14" order="2"/>
    <bond atomRefs2="a14 a13" order="1"/>
    <bond atomRefs2="a13 a21" order="1"/>
    <bond atomRefs2="a21 a16" order="2"/>
    <bond atomRefs2="a15 a16" order="1"/>
    <bond atomRefs2="a17 a18" order="2"/>
    <bond atomRefs2="a18 a19" order="1"/>
    <bond atomRefs2="a19 a20" order="2"/>
    <bond atomRefs2="a20 a21" order="1"/>
    <bond atomRefs2="a17 a16" order="1"/>
    <bond atomRefs2="a17 a23" order="1"/>
    <bond atomRefs2="a18 a24" order="1"/>
    <bond atomRefs2="a19 a25" order="1"/>
    <bond atomRefs2="a20 a26" order="1"/>
    <bond atomRefs2="a1 a13" order="1"/>
  </bondArray>
</molecule>
