<?xml version="1.0"?>
<mzML xmlns="http://psi.hupo.org/ms/mzml" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://psi.hupo.org/ms/mzml http://psidev.info/files/ms/mzML/xsd/mzML1.1.0.xsd" id="CUJMXIQZWPZMNQ-XYYGWQPLSA-N" version="0.1">
  <cvList count="2">
    <cv id="MS" fullName="Proteomics Standards Initiative Mass Spectrometry Ontology" version="2.26.0" URI="http://psidev.cvs.sourceforge.net/*checkout*/psidev/psi/psi-ms/mzML/controlledVocabulary/psi-ms.obo"/>
    <cv id="UO" fullName="Unit Ontology" version="14:07:2009" URI="http://obo.cvs.sourceforge.net/*checkout*/obo/obo/ontology/phenotype/unit.obo"/>
  </cvList>
  <fileDescription>
    <fileContent>
      <cvParam cvRef="MS" accession="MS:1000127" name="centroid spectrum" value=""/>
    </fileContent>
    <sourceFileList count="1">
      <sourceFile id="_CHEM021880-low.txt" name="CHEM021880-low.txt" location="http://hmdbhttp://moldb.wishartlab.com/system/documents/files/000/083/324/original/CHEM021880-low.txt?1464952594">
        <cvParam cvRef="MS" accession="MS:1001369" name="text file" value=""/>
      </sourceFile>
    </sourceFileList>
    <contact>
      <cvParam cvRef="MS" accession="MS:1000586" name="contact name" value="David Wishart"/>
      <cvParam cvRef="MS" accession="MS:1000590" name="contact organization" value="University of Alberta"/>
      <cvParam cvRef="MS" accession="MS:1000587" name="contact address" value="University of Alberta, Edmonton, Alberta, Canada, T6G 2E8"/>
      <cvParam cvRef="MS" accession="MS:1000588" name="contact URL" value="http://wishartlab.com"/>
      <cvParam cvRef="MS" accession="MS:1000589" name="contact email" value="david.wishart@ualberta.ca"/>
    </contact>
  </fileDescription>
  <softwareList count="1">
    <software id="SpecDB" version="0.1">
      <cvParam cvRef="MS" accession="MS:1000799" name="custom unreleased software tool" value="SpecDB Spectra management database"/>
    </software>
  </softwareList>
  <instrumentConfigurationList count="1">
    <instrumentConfiguration id="instrument">
      <cvParam cvRef="MS" accession="MS:1000031" name="instrument model" value=""/>
    </instrumentConfiguration>
  </instrumentConfigurationList>
  <dataProcessingList count="1">
    <dataProcessing id="SpecDB_processing">
      <processingMethod order="1" softwareRef="SpecDB">
        <cvParam cvRef="MS" accession="MS:1000544" name="Conversion to mzML" value=""/>
      </processingMethod>
    </dataProcessing>
  </dataProcessingList>
  <run id="run_1" defaultInstrumentConfigurationRef="instrument" defaultSourceFileRef="_CHEM021880-low.txt">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_CHEM021880-low.txt" index="0" defaultArrayLength="31">
        <cvParam cvRef="MS" accession="MS:1000580" name="MSn spectrum" value=""/>
        <cvParam cvRef="MS" accession="MS:1000127" name="centroid spectrum" value=""/>
        <binaryDataArrayList count="2">
          <binaryDataArray encodedLength="338" dataProcessingRef="SpecDB_processing">
            <cvParam cvRef="MS" accession="MS:1000523" name="64-bit float" value=""/>
            <cvParam cvRef="MS" accession="MS:1000576" name="no compression" value=""/>
            <cvParam cvRef="MS" accession="MS:1000514" name="m/z array" value="" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
            <binary>QK4msgOJTEB5Ty9CgsVRQJVvSx4uw1dADx2O8C7FWED1u7A120NcQBHfiVkv
RlxAZVOu8C7FXkAR34lZL0ZfQIjK0MIvx19AttN7z21iYUBxSR8E7qJhQEu5
sY9E42lA2UqeoW7kaUAGL1XExKNrQJXAQdbupGtAwqT4+ERkbUDFTh1QG+Rt
QFTgCWJF5W1AVOAJYkVlb0Bjpw6oDXJwQPE4+7k3M3FAQrfy7TiScUDP80zU
dxNyQLrWg+63M3JA0Ejf/2JTckCuAzEaozNzQNBI3/9i03NA0Ejf/2LTc0Cw
WMNFjvN0QLBYw0WO83RAj2ini7kTdkA=
</binary>
          </binaryDataArray>
          <binaryDataArray encodedLength="338" dataProcessingRef="SpecDB_processing">
            <cvParam cvRef="MS" accession="MS:1000523" name="64-bit float" value=""/>
            <cvParam cvRef="MS" accession="MS:1000576" name="no compression" value=""/>
            <cvParam cvRef="MS" accession="MS:1000515" name="intensity array" value="" unitCvRef="MS" unitAccession="MS:1000131" unitName="number of counts"/>
            <binary>cFZZnx/b7D9L9y42kV/zP++DxQO3tuQ/zo1l0aYg8j+FsjfLQU3lPzH2VguJ
F+M/byhti+Hb4T97aNzpAAjmPyyKm3bY3Pc/o2Ob1I/+6z8EjtO7MHXuPwVX
cGzz/+U/X6sHQ1L44j/gzdtXbFP0PyxZj6dXDeE/a3PYhzm88D/cLKBI3v7n
P8iCtXZKK+Y/fdLE1AGs4T+ieT84XxDpP7THTQXDpvE/seU2VUej4T9E8HEG
fMcKQDSuLbRiPOM/gnUraoH8+D/b/vBOmSYNQKXBTF/4WC5AT6PxjeYlFUCn
sHNPLiYnQHUGBEIE0jVAm8RBvlu1MkA=
</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
