<?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=PPTYJKAXVCCBDU-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-441136-mz-values.txt-20190109-20465-cidk5j" name="msms-441136-mz-values.txt-20190109-20465-cidk5j" location="http://t3db.cahttp://moldb.wishartlab.com/system/documents/files/001/927/848/original/msms-441136-mz-values.txt-20190109-20465-cidk5j?1547066002">
        <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-441136-mz-values.txt-20190109-20465-cidk5j">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-441136-mz-values.txt-20190109-20465-cidk5j" index="0" defaultArrayLength="98">
        <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="1066" 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>s+pztRUDXUBI4XoUrkNdQM4ZUdobhF1A+FPjpZvEXUCpE9BE2AReQIqw4emV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</binary>
          </binaryDataArray>
          <binaryDataArray encodedLength="1066" 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>sRh1rb1P7T9aoN0hxUD8P+LNGryvmhpAMErQX+gxE0BY5q26DlXlP8u/lleu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</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
