<?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="KGHDZWXKKZDUJI-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-131736-mz-values.txt-20190109-20465-1hkv7g3" name="msms-131736-mz-values.txt-20190109-20465-1hkv7g3" location="http://contaminantdb.cahttp://moldb.wishartlab.com/system/documents/files/001/770/468/original/msms-131736-mz-values.txt-20190109-20465-1hkv7g3?1547063505">
        <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-131736-mz-values.txt-20190109-20465-1hkv7g3">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_msms-131736-mz-values.txt-20190109-20465-1hkv7g3" 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>CSezi7MAMUB5Ty9CgsVRQHlPL0KCxVRAmQRWq4JGWEAPHY7wLsVYQPP8cRSD
x1hAEd+JWS9GWUAR34lZL0ZcQIjK0MIvx1xAiMrQwi/HX0BID404buNhQAOF
MG3uI2JAUI/I0uJ2eEA8cv/sIpd4QDxy/+wiV3lAGS1RB2M3ekA9x5EYDld6
QPfnoiGjV3pAG4LjMk53ekAbguMyTjd7QPk8NU2OV3tA+Tw1TY4XfEDkH2xn
zvd8QPqRx3h5F31A2EwZk7k3fUCJI7SKo1h/QKHqocc5uH9AjM3Y4XnYf0C0
GUxoZzyAQMZm7PA8TIBApCE+C33MgEA=
</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>4U0YhGJBxT+c9nwkmCfQP02MDELeqsE/HumXfkUD9T+/Gobgz9jdP4iOjPE7
L8M/duc0w7k62j9AhR1qxmfiPyaga1qHAQ5AFIPrAd9DxT+RCGG7Yb7SPztx
PfIVic8/uDWCQRQbzj+09KjFzmYDQJmoZFSnsL0/Pd3Um6zM9D8FUoQKBQLd
PzOzSHNhrbY/w27b3Hgl2j/zGIwqbzrjP92fmrG5GQ5AkeeU7hC5wD9QbQE8
gauyP6QsdMNF/tI/+XwtnOYc0j/SaDiGfEsLQKT9XYjmlL0/8rxE01rT2z+M
I2KMQLcyQA+kjCkxV8s/f5Sme/yATUA=
</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
