<?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="PHHDVGGCTAPBHF-AATRIKPKSA-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-122521-mz-values.txt-20190109-20465-86i2w7" name="msms-122521-mz-values.txt-20190109-20465-86i2w7" location="http://www.contaminantdb.cahttp://moldb.wishartlab.com/system/documents/files/001/761/283/original/msms-122521-mz-values.txt-20190109-20465-86i2w7?1547063361">
        <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-122521-mz-values.txt-20190109-20465-86i2w7">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-122521-mz-values.txt-20190109-20465-86i2w7" 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>/0PZ3wKHS0D/oexvgcNQQCBXE9mBRFFAIFcT2YFEV0CVb0seLsNXQLYkcocu
RFhAy/BEtS1CWkB3fCAeLsNaQO5nZ4cuRFtAZVOu8C7FW0DSRI5j2kFeQCSY
amZt4WBA+13Ymu0hYUC203vPbeJiQChCj71DYWRAie/ErBejZUAoQo+9Q+Fl
QP4H/fHDIWZAuX2gJkRiZkD+B/3xw6FnQHFJHwTuomdAuX2gJkTiZ0BID404
buNnQHXzQ1vEImhASA+NOG5jaUADhTBt7qNpQEgPjThu42pAA4Uwbe4ja0AD
hTBt7qNsQEu5sY9E42xAwqT4+ETkbkA=
</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>zmj/kVZl5D8Uuh2qwXX6P/Tq0nWX9CdA7Boz5Vix4j+wyR+uyuEEQIjFqmwY
+PU/f1PZKbZX7T8xLMGR4DftP8HYFQ/85wlAxEEAeF1+JUAvd6qf3vz1P3SU
DMtiRP0/DOLOSC42BEBwhfnwAZECQFSzlwXEuPM/B611lXaq6D+PRq+WHB/n
P1V7AYs2JBVAXPU3oxEc/T8w1090HsvnP/pHMOxoIOI/N0dNn4wW7j9jS8Ep
2x/jPyR7T6hRl/A/I9UmN1I65T+h1QHE6FfyPzOcCm8Ro/o/q6DKsiVo9z/i
Ssm0LkwBQMXxmlwuyBpABtRAmIDJPUA=
</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
