<?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="ODQWQRRAPPTVAG-UHFFFAOYSA-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="_msms-444692-mz-values.txt-20190109-20465-16zhq29" name="msms-444692-mz-values.txt-20190109-20465-16zhq29" location="http://hmdbhttp://moldb.wishartlab.com/system/documents/files/001/931/404/original/msms-444692-mz-values.txt-20190109-20465-16zhq29?1547066059">
        <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="_msms-444692-mz-values.txt-20190109-20465-16zhq29">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-444692-mz-values.txt-20190109-20465-16zhq29" index="0" defaultArrayLength="88">
        <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="956" 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>pSxDHOuCSUAU0ETY8IRKQLu4jQbwhktAdZMYBFYGTEAcfGEyVQhNQApoImx4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</binary>
          </binaryDataArray>
          <binaryDataArray encodedLength="956" 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>bamDvB5Mxj+NuAA0SpfpP5bMsbyrHs4/UgyQaAJF0z+UiPAvgmo1QPOOU3Qk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</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
