<?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=FQKUGOMFVDPBIZ-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-452328-mz-values.txt-20190109-20465-18yph6e" name="msms-452328-mz-values.txt-20190109-20465-18yph6e" location="http://t3db.cahttp://moldb.wishartlab.com/system/documents/files/001/939/040/original/msms-452328-mz-values.txt-20190109-20465-18yph6e?1547066231">
        <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-452328-mz-values.txt-20190109-20465-18yph6e">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-452328-mz-values.txt-20190109-20465-18yph6e" index="0" defaultArrayLength="65">
        <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="708" 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>24r9ZfeESkA2qz5XW4FOQApoImx4QlNA8tJNYhDAU0APC7WmecNTQKAaL90k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</binary>
          </binaryDataArray>
          <binaryDataArray encodedLength="708" 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>gjl6/N4m7T/hCb3+JD7fP/p/1ZEjXQpAlugsswhF4T9JZvUOt8PzP3FXryKj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</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
