<?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="YCXQGKDLXRHABX-SUWUUCHZSA-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="_MMDBc0007797_TMS_4_1_peaks.tsv" name="MMDBc0007797_TMS_4_1_peaks.tsv" location="http://www.mimedb.cahttp://moldb.wishartlab.com/system/documents/files/005/592/533/original/MMDBc0007797_TMS_4_1_peaks.tsv?1660002896">
        <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="_MMDBc0007797_TMS_4_1_peaks.tsv">
    <spectrumList count="1" defaultDataProcessingRef="SpecDB_processing">
      <spectrum id="file=_MMDBc0007797_TMS_4_1_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>9RasxP5CUkChXWz3foNSQE6kLCr/w1JACIzccKtCVkDSn0fWq8NZQE6vOayV
AmVApNKZxdUiZUCnPLoRloNoQP5fGivWo2hAW95mO3Aja0AIJSdu8GNrQOPI
XkrYQnRAkA8ffVgDdkA7Ic+JeBN2QJFEL6O4c3hAH7qgvmXEfkAflEH/HuqA
QPpAlxWv4oNAhgDg2LPqg0DPSe8bv0qEQKVSRyLPUoRAXCBB8dNahEBHYc23
xNKEQB1qJb7U2oRAQOFHkNUyhkAW6p+W5TqGQOuLKf3pQoZA6/L3nPWihkAF
8/wO+qqGQCiD/p34soZAvCNjtfm6hkA=
</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>R80fH2l2C0D0hNOxK87iP/SosMVyO+E/fBjn2W/Q6T/3sEqyXSzsP5jV/HfL
tfE/KmWpH9oq5z8I8A7XB8XxP/r6DHZre+Y/3xm2dOg/6T+7RqABwr37P7zT
uljTV+w/UtIrtF+G9T/WeftDmCLiP3oYOY+z9vA/4IxUtgwj6j/cFaU8ZvTj
Pz1g6T8VDvI/1chekrIc5D+L2Ht/8OrkP7rUFSdP5fg/s8b1N/VN7D/fJ+pr
pgLoPxnYUhvvquQ/B8Tv17l56T8275i3c3TxP7/u9tXjCuY/okXhc1paIkAH
8WXIz5cXQKamDgZfOwlAIbAwTL938j8=
</binary>
          </binaryDataArray>
        </binaryDataArrayList>
      </spectrum>
    </spectrumList>
  </run>
</mzML>
