<?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="XSJKEOCUSUUVLE-ZESVVUHVSA-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="_MMDBc0046593_TMS_1_3_peaks.tsv" name="MMDBc0046593_TMS_1_3_peaks.tsv" location="http://www.mimedb.cahttp://moldb.wishartlab.com/system/documents/files/005/596/557/original/MMDBc0046593_TMS_1_3_peaks.tsv?1660002963">
        <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="_MMDBc0046593_TMS_1_3_peaks.tsv">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_MMDBc0046593_TMS_1_3_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>nvsfHpEEP0CnAnKyooNOQJyJK1/+wVFA9RasxP5CUkD8XvniQSBlQKmluRXC
4GZAb9l8txQnbEBoYar07qBsQGhhqvTuIG5Awe4qWu+hbkClWlVAa+dvQGF3
Fa33EHBAIgCTr9+0cEBnHZ/aynRyQNLqP8ZXYoBAp/OXzGdqgEBUOlj/5yqC
QP9LCAwIm4JARGkUN/P6g0BZDpmXaMyHQNcQwd1u1IdALxfxnXjUh0BQvdr2
YtyHQHDlkeR+3IdABSBJpIg8iEBxdJXujkSIQFJAf0aeLIlAKEnXTK6UiUD9
US9TvpyJQPROBdyTrIlA/wQXK5q0iUA=
</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>zjXHF79R8D+9pigTjk8AQLichRzfF+M/6ZvtN/7zCEChH0gJuhj5P4+DqIE6
U/M/vtlvuFIB9j+B/ZJ3R6vtP3a8l+xwLOg/8YWpa/2V6z/ZY+xExbjmP3cG
VBu/2OI/tpix/lVr8T8fzBElZs30PzgQZBaA8+M/QLBussne9D8zJPr/8Ifo
P9korIqwDeY/vks0h24O5j+iopGf8r/8P6RTxiRELu4/9V9mJrhL9T+wufKz
e0TkP9F0Q4qyXOY/lsSoVwk38j/4dxRwUYrjP8P+w4KoV+c/KDYrSiWO6D/H
zqSc0srjP2dQ3A18Jv8/YEJqsv0W8T8=
</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
