<?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="MNTJKNWRCITJMY-JCBJYGFASA-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="_MMDBc0010294_TMS_1_1_peaks.tsv" name="MMDBc0010294_TMS_1_1_peaks.tsv" location="http://www.mimedb.cahttp://moldb.wishartlab.com/system/documents/files/005/592/714/original/MMDBc0010294_TMS_1_1_peaks.tsv?1660002899">
        <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="_MMDBc0010294_TMS_1_1_peaks.tsv">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_MMDBc0010294_TMS_1_1_peaks.tsv" index="0" defaultArrayLength="31">
        <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="338" 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>XC6wAfCERED1FqzE/kJSQOAx2ct4RFRAjXiZ/viEVEAIjNxwq0JWQAPTxJZ5
RltAC6R6IRMjYUC46jpUk+NiQGQx+4YTpGRAvb577BOlaUBqBTwflGVrQAEZ
lS8DI29Ag/bq40HyckAvCJvwYQJzQNoZS/2B0nNAhSv7CaLic0AwPasWwrJ0
QDA9qxbCcnVA3YNrSUIzd0CIlRtWYkN3QDOny2KCE3hA3rh7b6IjeECL/zui
IiR5QM7nN6ets3pAefnns83DekCMNEzIgtR6QCQLmMDtk3tAzxxIzQ2ke0A3
RvzUoqR7QHou+NktdHxAkYaunzmEfEA=
</binary>
          </binaryDataArray>
          <binaryDataArray encodedLength="338" 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>qCdRSt835D/0ZwDuAJf7P0oMkfrDW+o/FvAYAYHV7z981/F2vAXoPxoKelQl
XuQ/WEYtyKu35z9UyxLw9t/oP6RKu/KMjug/9df6zXzC7T/1WoxeZnD0Pzy8
KyePAuQ/7D2NYlZT8z+tRhTp7sHsP61Tyks8mO8/yAr1KQRA5z9fngMIdar3
P9t1qMvGQOs/aBj7Kc585T8lvjbCcmHqP+CHiD3i7+4/PVjTsHCm9j9NgTJo
zWDsP9RiyB8AGOk/7tgcqNKl6T9ipmRu+8z0PwMgd9yzGPQ/pqNlot2Y7j9Y
O68VUtXsP9Zf0r/0bxJAukcic+aQ+j8=
</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
