<?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="JBTHDAVBDKKSRW-FMQUCBEESA-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-112454-mz-values.txt-20190109-20465-mzvqtm" name="msms-112454-mz-values.txt-20190109-20465-mzvqtm" location="http://contaminantdb.cahttp://moldb.wishartlab.com/system/documents/files/001/751/249/original/msms-112454-mz-values.txt-20190109-20465-mzvqtm?1547063201">
        <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-112454-mz-values.txt-20190109-20465-mzvqtm">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-112454-mz-values.txt-20190109-20465-mzvqtm" index="0" defaultArrayLength="31">
        <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:1000129" name="negative scan" 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>mmJpOwGDQ0Bj2pKwyoNFQOS7lLpkAElAlqzMjGUCSkAicEXeyYFKQBBXUhe+
/0pApqnQBoFCUEBLVmbGMgFTQGwLjS8zglNA/6Hsb4HDU0CmqdAGgUJWQDFt
SVjlwVZA/6Hsb4HDVkDFA6mYMwNXQIplZcHlQldAxJz7BoFCWUAV1WwvM4JZ
QOcTHtmBRFpAHCm23d+BWkBV5Gsq5sNaQKhYkMHlQl1AA6z6ATSEXUAV1Wwv
M4JfQGV4otoWIWBAjhTb7u9AYEDmZ9lJc6JgQGV4otoWoWFASop+I3CBY0BY
1uw3SSFlQKWHodXJYm1A0sPQ6mQxcEA=
</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>+riHm4tT2T+T278B0DneP3EjUDl53Mc/JXRKEe/J4z9i2+wQAljgP22t8q7B
LQZAif2NUfFr6z9UBlFgwULjP2TNi71eLPo/1tZN/i6x9D/L4qe11RrqP86X
FKiQ9uo/a3Zn4NXowj8H3w+S2QbbPwDaDLjy3+8/hhDevhEc+j+XOoEWNlbo
P/5Y/Rv4nyFA4T0Zed/MzD/p6r0iR9TKP5YUijqUDSxAuPInZMb3MEBNldVX
w6TiP4F2NIO509w/8xn/J0dt9z94c8DHw6k4QKJ1aYdsTeQ/E8KbHNsAL0Dm
QvSK+NXsPywNkDF9a88/Tkvppj+11j8=
</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
