<?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="ZSTKHSQDNIGFLM-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-6331-mz-values.txt-20190109-20465-nd2xh9" name="msms-6331-mz-values.txt-20190109-20465-nd2xh9" location="http://hmdbhttp://moldb.wishartlab.com/system/documents/files/001/645/812/original/msms-6331-mz-values.txt-20190109-20465-nd2xh9?1547061527">
        <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-6331-mz-values.txt-20190109-20465-nd2xh9">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-6331-mz-values.txt-20190109-20465-nd2xh9" index="0" defaultArrayLength="61">
        <cvParam cvRef="MS" accession="MS:1000580" name="MSn spectrum" value=""/>
        <cvParam cvRef="MS" accession="MS:1000127" name="centroid spectrum" value=""/>
        <cvParam cvRef="MS" accession="MS:1000130" name="positive scan" value=""/>
        <binaryDataArrayList count="2">
          <binaryDataArray encodedLength="663" 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>ZmZmZmbmRkAAAAAAAABMQM3MzMzMDE1AmpmZmZmZTkDNzMzMzExRQM3MzMzM
zFFAAAAAAAAAUkDNzMzMzMxTQDMzMzMzU1RAmpmZmZnZVECamZmZmXlVQM3M
zMzMrFVAmpmZmZm5VkCamZmZmblXQDMzMzMzk1hAMzMzMzPzWECamZmZmblZ
QAAAAAAAAFpAzczMzMxMWkAAAAAAAMBaQGZmZmZmRltAzczMzMzsW0AzMzMz
MxNcQDMzMzMz01xAZmZmZmYGXUDNzMzMzExdQGZmZmZmhl1AmpmZmZm5XUAA
AAAAAABeQJqZmZmZOV5AzczMzMysXkAzMzMzM9NfQJqZmZmZCWBAmpmZmZkZ
YEAAAAAAAEBgQDMzMzMzY2BAMzMzMzODYEBmZmZmZqZgQJqZmZmZuWBAmpmZ
mZnpYEDNzMzMzIxhQJqZmZmZyWFAMzMzMzPjYUAAAAAAAABiQGZmZmZmJmJA
ZmZmZmZGYkAAAAAAAGBiQGZmZmZmhmJAzczMzMyMY0CamZmZmaljQJqZmZmZ
uWNAMzMzMzPjY0DNzMzMzAxkQJqZmZmZSWRAZmZmZmaGZEBmZmZmZrZlQGZm
ZmZmxmVAzczMzMzsZUAAAAAAACBnQAAAAAAAYGlAzczMzMxsa0A=
</binary>
          </binaryDataArray>
          <binaryDataArray encodedLength="663" 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>+pW6o4BmUD/6lbqjgGZQPwAAAAAAAPA/+pW6o4BmUD/6lbqjgGZQP/qVuqOA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</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
