<?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="JRWZLRBJNMZMFE-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-447218-mz-values.txt-20190109-20465-1pyix58" name="msms-447218-mz-values.txt-20190109-20465-1pyix58" location="http://hmdbhttp://moldb.wishartlab.com/system/documents/files/001/933/930/original/msms-447218-mz-values.txt-20190109-20465-1pyix58?1547066099">
        <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-447218-mz-values.txt-20190109-20465-1pyix58">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-447218-mz-values.txt-20190109-20465-1pyix58" index="0" defaultArrayLength="62">
        <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="676" 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>zczMzMwMVkBmZmZmZkZWQGZmZmZmxlZAMzMzMzPzVkBmZmZmZoZXQM3MzMzM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</binary>
          </binaryDataArray>
          <binaryDataArray encodedLength="676" 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>b2dfeZCevj9PIOwUqwaRPzxPPGcLCCJAO6kvSzs1hz8Fa5xNRwCXPzLKMy+H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</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
