<?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="NDDAHWYSQHTHNT-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-436842-mz-values.txt-20190109-20465-rddybo" name="msms-436842-mz-values.txt-20190109-20465-rddybo" location="http://contaminantdb.cahttp://moldb.wishartlab.com/system/documents/files/001/923/554/original/msms-436842-mz-values.txt-20190109-20465-rddybo?1547065937">
        <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-436842-mz-values.txt-20190109-20465-rddybo">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-436842-mz-values.txt-20190109-20465-rddybo" index="0" defaultArrayLength="56">
        <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="610" 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>cayL22iASkCxv+yePPxOQNDVVuwv+09AlkOLbOd/UECb5h2n6ABRQOoENBE2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</binary>
          </binaryDataArray>
          <binaryDataArray encodedLength="610" 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>FmwjnuxmyD+uDRXj/E3ZP982UyEeCQNAMZkqGJXUxT8sSDMWTWfgP6qB5nPu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</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
