<?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="DMQQXDPCRUGSQB-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-168834-mz-values.txt-20190109-20465-1xfnuae" name="msms-168834-mz-values.txt-20190109-20465-1xfnuae" location="http://contaminantdb.cahttp://moldb.wishartlab.com/system/documents/files/001/807/482/original/msms-168834-mz-values.txt-20190109-20465-1xfnuae?1547064085">
        <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-168834-mz-values.txt-20190109-20465-1xfnuae">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-168834-mz-values.txt-20190109-20465-1xfnuae" 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>sC6XIrN/RkDxmOT0s4FHQPGY5PSzgU1ApIkcx7SDTkB38SMjjABSQJemSoyM
gVVA8J5m9YwCVkD1MLQ6OYFcQBFUjV6Ng1xAEVSNXo2DX0DEH+rjRgJgQH7C
fvRyQGBAmuVXGMdCYEA5OCIp84BgQA/+j11zwWBAD/6PXXNBYkA5OCIp84Bj
QA/+j11zwWNAy3MzkvOBZUCG6dbGc8JlQGr7sg/NImlAavuyD82iakAmcVZE
TeNqQPw2xHjNI2tAKRt7myNjbkBxT/y9eaJuQLkn/t48EXBAluJP+XwxcEB0
naETvVFwQJg34iRo8XFAeEfGapMRc0A=
</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>jMbO2vzmsz9fzfN7MYiWPzDHT0R2jr8/oOuFPvT2oj9WUSyNWWOiPzTEqJgA
5MU/ZJNoAGnDyD8sB9SF2gLBP5sGVmh4YKk/M0ut+EASmT8hRWvtB0GxP9Ig
h/RbPMA/f51naTg3oj+k4EryMzAOQCFgNoN0v7c/M/X4zZ3RqD9xeS6/UwmW
P2L7kEmbCdE/IwZT75ZU2T8k2qBDWEW0P0b0M0FJC78/BlQLb47vvz9ZdLhE
mGABQJUk12bGx/4/dH5GfaT17z/1pi/2qEDBP+tyVLK/k88/IyMei5hy9z9N
bpAgx8wsQBQ+d1w2DfQ/mWmYLZvYUUA=
</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
