<?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="InChIKey=KNAHARQHSZJURB-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-450793-mz-values.txt-20190109-20465-1fbz3hv" name="msms-450793-mz-values.txt-20190109-20465-1fbz3hv" location="http://t3db.cahttp://moldb.wishartlab.com/system/documents/files/001/937/505/original/msms-450793-mz-values.txt-20190109-20465-1fbz3hv?1547066165">
        <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-450793-mz-values.txt-20190109-20465-1fbz3hv">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-450793-mz-values.txt-20190109-20465-1fbz3hv" index="0" defaultArrayLength="68">
        <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="741" 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>k+S5vg8JR0D2e2KdKiFIQIR+pl63tFFAVW03wTeNUkDh8e1dgzxTQIif/x68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</binary>
          </binaryDataArray>
          <binaryDataArray encodedLength="741" 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>SIyeW+jK8T+pEmVvKefwP1RyTuyhPfY/hbUxdsLL9T9TPC6qRQT0P1M8LqpF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</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
