<?xml version="1.0" encoding="UTF-8"?>
<!--
Created 2022-07-04T19:35:31
-->
<CmcaProject>
  <multipletSet class="de.bruker.nmr.an.cmca1d.CmcaMultipletSet1D" serialization="custom">
    <unserializable-parents/>
    <list>
      <default>
        <size>4</size>
      </default>
      <int>4</int>
      <CmcaMultiplet1D serialization="custom">
        <unserializable-parents/>
        <list>
          <default>
            <size>1</size>
          </default>
          <int>1</int>
          <Peak1D>
            <positions>
              <double>2.239477375944343</double>
            </positions>
            <indices>
              <double>44904.0</double>
            </indices>
            <intensity>5.95478765568E11</intensity>
            <annotation></annotation>
            <type>UNKNOWN</type>
            <headerIndex>-1</headerIndex>
            <volume>NaN</volume>
            <volumeError>NaN</volumeError>
            <quality>NaN</quality>
            <peakID>78</peakID>
          </Peak1D>
        </list>
        <PeakGroup>
          <default>
            <isF1Folded>false</isF1Folded>
            <isImpurity>false</isImpurity>
            <manuallyCreated>false</manuallyCreated>
            <meanF1LineWidth>0.0</meanF1LineWidth>
            <meanF1LineWidthError>0.0</meanF1LineWidthError>
            <volume>NaN</volume>
            <atomIndex>
              <int>-1</int>
            </atomIndex>
            <corType>UNDEFINED</corType>
            <delta>
              <double>5.0E-4</double>
            </delta>
            <multipletArea>
              <PhysicalRange>
                <start>2.2428131865851153</start>
                <end>2.235933077138524</end>
                <ref>599.899958191723</ref>
                <unit>ppm</unit>
              </PhysicalRange>
            </multipletArea>
            <name>9_s_Q1</name>
            <state>UNDEFINED</state>
          </default>
        </PeakGroup>
        <MultipletPeakGroup1D>
          <default>
            <isUnknownMultipletType>false</isUnknownMultipletType>
            <shift>2.239477375944343</shift>
            <couplingHertzJ>
              <double>0.0</double>
            </couplingHertzJ>
            <couplingJ>
              <double>0.0</double>
            </couplingJ>
            <linkedAtoms>
              <int>8</int>
            </linkedAtoms>
            <multiplicities>
              <int>1</int>
            </multiplicities>
          </default>
        </MultipletPeakGroup1D>
        <CmcaMultiplet1D>
          <default>
            <createdByAutomation>true</createdByAutomation>
            <annotation></annotation>
            <visibilityDisplay>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
            </visibilityDisplay>
            <visibilityHint>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
            </visibilityHint>
          </default>
        </CmcaMultiplet1D>
      </CmcaMultiplet1D>
      <CmcaMultiplet1D serialization="custom">
        <unserializable-parents/>
        <list>
          <default>
            <size>1</size>
          </default>
          <int>1</int>
          <Peak1D>
            <positions>
              <double>6.933796900170268</double>
            </positions>
            <indices>
              <double>22388.0</double>
            </indices>
            <intensity>1.10512945152E11</intensity>
            <annotation></annotation>
            <type>UNKNOWN</type>
            <headerIndex>-1</headerIndex>
            <volume>NaN</volume>
            <volumeError>NaN</volumeError>
            <quality>NaN</quality>
            <peakID>1</peakID>
          </Peak1D>
        </list>
        <PeakGroup>
          <default>
            <isF1Folded>false</isF1Folded>
            <isImpurity>false</isImpurity>
            <manuallyCreated>false</manuallyCreated>
            <meanF1LineWidth>0.0</meanF1LineWidth>
            <meanF1LineWidthError>0.0</meanF1LineWidthError>
            <volume>NaN</volume>
            <atomIndex>
              <int>-1</int>
            </atomIndex>
            <corType>UNDEFINED</corType>
            <delta>
              <double>5.0E-4</double>
            </delta>
            <multipletArea>
              <PhysicalRange>
                <start>6.938592127966378</start>
                <end>6.929001672374159</end>
                <ref>599.899958191723</ref>
                <unit>ppm</unit>
              </PhysicalRange>
            </multipletArea>
            <name>8_s_Q2</name>
            <state>UNDEFINED</state>
          </default>
        </PeakGroup>
        <MultipletPeakGroup1D>
          <default>
            <isUnknownMultipletType>false</isUnknownMultipletType>
            <shift>6.933796900170268</shift>
            <couplingHertzJ>
              <double>0.0</double>
            </couplingHertzJ>
            <couplingJ>
              <double>0.0</double>
            </couplingJ>
            <linkedAtoms>
              <int>7</int>
            </linkedAtoms>
            <multiplicities>
              <int>1</int>
            </multiplicities>
          </default>
        </MultipletPeakGroup1D>
        <CmcaMultiplet1D>
          <default>
            <createdByAutomation>true</createdByAutomation>
            <annotation></annotation>
            <visibilityDisplay>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
            </visibilityDisplay>
            <visibilityHint>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
            </visibilityHint>
          </default>
        </CmcaMultiplet1D>
      </CmcaMultiplet1D>
      <CmcaMultiplet1D serialization="custom">
        <unserializable-parents/>
        <list>
          <default>
            <size>1</size>
          </default>
          <int>1</int>
          <Peak1D>
            <positions>
              <double>4.769692082013669</double>
            </positions>
            <indices>
              <double>32767.988800112384</double>
            </indices>
            <intensity>-8.5921792E7</intensity>
            <annotation></annotation>
            <type>UNKNOWN</type>
            <headerIndex>-1</headerIndex>
            <volume>NaN</volume>
            <volumeError>NaN</volumeError>
            <quality>NaN</quality>
            <peakID>2</peakID>
          </Peak1D>
        </list>
        <PeakGroup>
          <default>
            <isF1Folded>false</isF1Folded>
            <isImpurity>false</isImpurity>
            <manuallyCreated>false</manuallyCreated>
            <meanF1LineWidth>0.0</meanF1LineWidth>
            <meanF1LineWidthError>0.0</meanF1LineWidthError>
            <volume>NaN</volume>
            <atomIndex>
              <int>-1</int>
            </atomIndex>
            <corType>UNDEFINED</corType>
            <delta>
              <double>5.0E-4</double>
            </delta>
            <multipletArea>
              <PhysicalRange>
                <start>4.770106723299747</start>
                <end>4.762184173027915</end>
                <ref>599.899958191723</ref>
                <unit>ppm</unit>
              </PhysicalRange>
            </multipletArea>
            <name>SUP</name>
            <state>UNDEFINED</state>
          </default>
        </PeakGroup>
        <MultipletPeakGroup1D>
          <default>
            <isUnknownMultipletType>false</isUnknownMultipletType>
            <shift>4.769692082013669</shift>
            <couplingHertzJ>
              <double>0.0</double>
            </couplingHertzJ>
            <couplingJ>
              <double>0.0</double>
            </couplingJ>
            <linkedAtoms>
              <int>2</int>
            </linkedAtoms>
            <multiplicities>
              <int>1</int>
            </multiplicities>
          </default>
        </MultipletPeakGroup1D>
        <CmcaMultiplet1D>
          <default>
            <createdByAutomation>true</createdByAutomation>
            <annotation></annotation>
            <visibilityDisplay>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
            </visibilityDisplay>
            <visibilityHint>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
            </visibilityHint>
          </default>
        </CmcaMultiplet1D>
      </CmcaMultiplet1D>
      <CmcaMultiplet1D serialization="custom">
        <unserializable-parents/>
        <list>
          <default>
            <size>1</size>
          </default>
          <int>1</int>
          <Peak1D>
            <positions>
              <double>-1.0249300373210701E-4</double>
            </positions>
            <indices>
              <double>55646.0</double>
            </indices>
            <intensity>2.990278656E9</intensity>
            <annotation></annotation>
            <type>UNKNOWN</type>
            <headerIndex>-1</headerIndex>
            <volume>NaN</volume>
            <volumeError>NaN</volumeError>
            <quality>NaN</quality>
            <peakID>3</peakID>
          </Peak1D>
        </list>
        <PeakGroup>
          <default>
            <isF1Folded>false</isF1Folded>
            <isImpurity>false</isImpurity>
            <manuallyCreated>false</manuallyCreated>
            <meanF1LineWidth>0.0</meanF1LineWidth>
            <meanF1LineWidthError>0.0</meanF1LineWidthError>
            <volume>NaN</volume>
            <atomIndex>
              <int>-1</int>
            </atomIndex>
            <corType>UNDEFINED</corType>
            <delta>
              <double>5.0E-4</double>
            </delta>
            <multipletArea>
              <PhysicalRange>
                <start>0.002399364976845675</start>
                <end>-0.0023958628192630727</end>
                <ref>599.899958191723</ref>
                <unit>ppm</unit>
              </PhysicalRange>
            </multipletArea>
            <name>TMS</name>
            <state>UNDEFINED</state>
          </default>
        </PeakGroup>
        <MultipletPeakGroup1D>
          <default>
            <isUnknownMultipletType>false</isUnknownMultipletType>
            <shift>-1.0249300373210701E-4</shift>
            <couplingHertzJ>
              <double>0.0</double>
            </couplingHertzJ>
            <couplingJ>
              <double>0.0</double>
            </couplingJ>
            <linkedAtoms/>
            <multiplicities>
              <int>1</int>
            </multiplicities>
          </default>
        </MultipletPeakGroup1D>
        <CmcaMultiplet1D>
          <default>
            <createdByAutomation>true</createdByAutomation>
            <annotation></annotation>
            <visibilityDisplay>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
            </visibilityDisplay>
            <visibilityHint>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
              <boolean>true</boolean>
            </visibilityHint>
          </default>
        </CmcaMultiplet1D>
      </CmcaMultiplet1D>
    </list>
    <MultipletSet1D>
      <default>
        <integralNormFactor>1.0</integralNormFactor>
        <c__multiplet>de.bruker.nmr.an.multiplet1d.Multiplet</c__multiplet>
        <c__multipletSet>de.bruker.nmr.an.multiplet1d.MultipletSet</c__multipletSet>
        <delta>
          <double>5.0E-4</double>
        </delta>
        <peakList>
          <properties/>
          <dataType>PEAK_LIST</dataType>
          <dataName>name not defined</dataName>
          <selected>false</selected>
          <dataVisible>true</dataVisible>
          <peakList>
            <Peak1D>
              <positions>
                <double>2.239477375944343</double>
              </positions>
              <indices>
                <double>44904.0</double>
              </indices>
              <intensity>5.95478765568E11</intensity>
              <annotation></annotation>
              <type>UNKNOWN</type>
              <headerIndex>-1</headerIndex>
              <volume>NaN</volume>
              <volumeError>NaN</volumeError>
              <quality>NaN</quality>
              <peakID>0</peakID>
            </Peak1D>
            <Peak1D>
              <positions>
                <double>6.933796900170268</double>
              </positions>
              <indices>
                <double>22388.0</double>
              </indices>
              <intensity>1.10512945152E11</intensity>
              <annotation></annotation>
              <type>UNKNOWN</type>
              <headerIndex>-1</headerIndex>
              <volume>NaN</volume>
              <volumeError>NaN</volumeError>
              <quality>NaN</quality>
              <peakID>1</peakID>
            </Peak1D>
            <Peak1D>
              <positions>
                <double>4.769692082013669</double>
              </positions>
              <indices>
                <double>32767.988800112384</double>
              </indices>
              <intensity>-8.5921792E7</intensity>
              <annotation></annotation>
              <type>UNKNOWN</type>
              <headerIndex>-1</headerIndex>
              <volume>NaN</volume>
              <volumeError>NaN</volumeError>
              <quality>NaN</quality>
              <peakID>2</peakID>
            </Peak1D>
            <Peak1D>
              <positions>
                <double>-1.0249300373210701E-4</double>
              </positions>
              <indices>
                <double>55646.0</double>
              </indices>
              <intensity>2.990278656E9</intensity>
              <annotation></annotation>
              <type>UNKNOWN</type>
              <headerIndex>-1</headerIndex>
              <volume>NaN</volume>
              <volumeError>NaN</volumeError>
              <quality>NaN</quality>
              <peakID>3</peakID>
            </Peak1D>
          </peakList>
          <headerList/>
          <units>
            <string>ppm</string>
          </units>
          <peakListFileIOFactoryType>XML</peakListFileIOFactoryType>
          <multipleAddition>false</multipleAddition>
          <modificationDate>2022-01-11 12:38:43.243 UTC</modificationDate>
          <peakListProperties/>
          <peakOrdinal>4</peakOrdinal>
        </peakList>
      </default>
    </MultipletSet1D>
  </multipletSet>
  <projectVersionNumber>1.2</projectVersionNumber>
  <projectState>AutoConsistent</projectState>
  <projectStateAutomation>AutoConsistent</projectStateAutomation>
  <resultSummary>Automatic evaluation: Spectrum and structure are in agreement.Automatic evaluation: Spectrum and structure are in agreement.</resultSummary>
  <resultDetails>All major signals in the spectrum could be assigned. Some exchangeable protons have not been assigned. Satellites and main signal of impurity DMSO not assigned. Impurity DMSO not assigned.All major signals in the spectrum could be assigned. Some exchangeable protons have not been assigned. Satellites and main signal of impurity DMSO not assigned. Impurity DMSO not assigned. Impurity DSS not assigned.</resultDetails>
  <resultOrigin>Automatic analysis generated by Bruker CMC (b:17).</resultOrigin>
  <resultSummaryCreatedByAutomation>true</resultSummaryCreatedByAutomation>
  <resultDetailsCreatedByAutomation>true</resultDetailsCreatedByAutomation>
  <manuallyEdited>false</manuallyEdited>
  <molViewOffsetX>0.05</molViewOffsetX>
  <molViewOffsetY>0.1</molViewOffsetY>
  <molViewScale>1.5</molViewScale>
  <projectDataSets/>
  <modifiedSinceReport>true</modifiedSinceReport>
  <predictedShifts>
    <PredictedShift>
      <atomId>1</atomId>
      <atomSymbol>O</atomSymbol>
      <shift1H>
        <double>3.8118607997894287</double>
      </shift1H>
      <shiftQualityProton>MEDIUM</shiftQualityProton>
    </PredictedShift>
    <PredictedShift>
      <atomId>2</atomId>
      <atomSymbol>C</atomSymbol>
      <shift13C>
        <double>75.69999694824219</double>
      </shift13C>
      <shift1H>
        <double>4.925000190734863</double>
      </shift1H>
      <shiftQuality>LOW</shiftQuality>
      <shiftQualityProton>MEDIUM</shiftQualityProton>
    </PredictedShift>
    <PredictedShift>
      <atomId>3</atomId>
      <atomSymbol>C</atomSymbol>
      <shift13C>
        <double>153.625</double>
      </shift13C>
      <shiftQuality>LOW</shiftQuality>
    </PredictedShift>
    <PredictedShift>
      <atomId>4</atomId>
      <atomSymbol>N</atomSymbol>
      <shift1H>
        <double>11.0842866897583</double>
      </shift1H>
      <shiftQualityProton>LOW</shiftQualityProton>
    </PredictedShift>
    <PredictedShift>
      <atomId>5</atomId>
      <atomSymbol>N</atomSymbol>
      <shift1H>
        <double>10.5</double>
      </shift1H>
      <shiftQualityProton>LOW</shiftQualityProton>
    </PredictedShift>
    <PredictedShift>
      <atomId>6</atomId>
      <atomSymbol>C</atomSymbol>
      <shift13C>
        <double>133.5126953125</double>
      </shift13C>
      <shiftQuality>LOW</shiftQuality>
    </PredictedShift>
    <PredictedShift>
      <atomId>7</atomId>
      <atomSymbol>C</atomSymbol>
      <shift13C>
        <double>127.5</double>
      </shift13C>
      <shift1H>
        <double>7.460000038146973</double>
      </shift1H>
      <shiftQuality>LOW</shiftQuality>
      <shiftQualityProton>LOW</shiftQualityProton>
    </PredictedShift>
    <PredictedShift>
      <atomId>8</atomId>
      <atomSymbol>C</atomSymbol>
      <shift13C>
        <double>16.525909423828125</double>
      </shift13C>
      <shift1H>
        <double>2.7688047885894775</double>
      </shift1H>
      <shiftQuality>LOW</shiftQuality>
      <shiftQualityProton>MEDIUM</shiftQualityProton>
    </PredictedShift>
  </predictedShifts>
  <cmcaDataFrameworkVersion>0.9</cmcaDataFrameworkVersion>
  <integralRange class="PeakClusterRange">
    <properties/>
    <dataType>UNKNOWN</dataType>
    <dataName>name not defined</dataName>
    <selected>false</selected>
    <dataVisible>true</dataVisible>
    <region/>
    <fileType>A</fileType>
    <peakClusters>
      <PeakCluster>
        <properties/>
        <dataType>INTEGRAL</dataType>
        <dataName>name not defined</dataName>
        <selected>false</selected>
        <dataVisible>true</dataVisible>
        <dimension>1</dimension>
        <data>
          <double>2.84092416E8</double>
          <double>5.81818368E8</double>
          <double>8.89741312E8</double>
          <double>1.19656448E9</double>
          <double>1.499086848E9</double>
          <double>1.808787456E9</double>
          <double>2.136940544E9</double>
          <double>2.475634688E9</double>
          <double>2.802292736E9</double>
          <double>3.106125824E9</double>
          <double>3.40286464E9</double>
          <double>3.717251072E9</double>
          <double>4.056389632E9</double>
          <double>4.40834048E9</double>
          <double>4.762857472E9</double>
          <double>5.122428928E9</double>
          <double>5.492303872E9</double>
          <double>5.870659584E9</double>
          <double>6.253910016E9</double>
          <double>6.644299776E9</double>
          <double>7.045511168E9</double>
          <double>7.454578688E9</double>
          <double>7.864604672E9</double>
          <double>8.274843648E9</double>
          <double>8.693714944E9</double>
          <double>9.130496E9</double>
          <double>9.584646144E9</double>
          <double>1.004343296E10</double>
          <double>1.0491047936E10</double>
          <double>1.0921494528E10</double>
          <double>1.1341504512E10</double>
          <double>1.1760207872E10</double>
          <double>1.2180348928E10</double>
          <double>1.2603203584E10</double>
          <double>1.3035954176E10</double>
          <double>1.348518912E10</double>
          <double>1.3945933824E10</double>
          <double>1.4407294976E10</double>
          <double>1.4868365312E10</double>
          <double>1.5338160128E10</double>
          <double>1.582027776E10</double>
          <double>1.6310990848E10</double>
          <double>1.6815507456E10</double>
          <double>1.7351319552E10</double>
          <double>1.792674816E10</double>
          <double>1.8527117312E10</double>
          <double>1.9131785216E10</double>
          <double>1.9736129536E10</double>
          <double>2.0347437056E10</double>
          <double>2.0968173568E10</double>
          <double>2.159521792E10</double>
          <double>2.2229028864E10</double>
          <double>2.2870878208E10</double>
          <double>2.3514996736E10</double>
          <double>2.4155609088E10</double>
          <double>2.4799588352E10</double>
          <double>2.5461078016E10</double>
          <double>2.6144288768E10</double>
          <double>2.6840563712E10</double>
          <double>2.75408384E10</double>
          <double>2.8242481152E10</double>
          <double>2.8946751488E10</double>
          <double>2.9660155904E10</double>
          <double>3.0396971008E10</double>
          <double>3.116926976E10</double>
          <double>3.1972880384E10</double>
          <double>3.2791324672E10</double>
          <double>3.3614082048E10</double>
          <double>3.4444169216E10</double>
          <double>3.5290089472E10</double>
          <double>3.616018432E10</double>
          <double>3.7063878656E10</double>
          <double>3.8007435264E10</double>
          <double>3.8986364928E10</double>
          <double>3.9990063104E10</double>
          <double>4.1014351872E10</double>
          <double>4.2061561856E10</double>
          <double>4.313004032E10</double>
          <double>4.4214802432E10</double>
          <double>4.5318715392E10</double>
          <double>4.6450495488E10</double>
          <double>4.7608733696E10</double>
          <double>4.8779687936E10</double>
          <double>4.9955786752E10</double>
          <double>5.1146487808E10</double>
          <double>5.2366168064E10</double>
          <double>5.3620770816E10</double>
          <double>5.4911184896E10</double>
          <double>5.6239194112E10</double>
          <double>5.760211968E10</double>
          <double>5.898979328E10</double>
          <double>6.039611392E10</double>
          <double>6.182913024E10</double>
          <double>6.3302520832E10</double>
          <double>6.4821116928E10</double>
          <double>6.6381377536E10</double>
          <double>6.7981934592E10</double>
          <double>6.962500608E10</double>
          <double>7.1307624448E10</double>
          <double>7.30189312E10</double>
          <double>7.4750871552E10</double>
          <double>7.6510926848E10</double>
          <double>7.8321352704E10</double>
          <double>8.02019328E10</double>
          <double>8.2151837696E10</double>
          <double>8.415192064E10</double>
          <double>8.618786816E10</double>
          <double>8.8266991616E10</double>
          <double>9.0407890944E10</double>
          <double>9.261938688E10</double>
          <double>9.4898018304E10</double>
          <double>9.7242355712E10</double>
          <double>9.9659321344E10</double>
          <double>1.02158225408E11</double>
          <double>1.04749928448E11</double>
          <double>1.07452274688E11</double>
          <double>1.10284754944E11</double>
          <double>1.13254309888E11</double>
          <double>1.16355127296E11</double>
          <double>1.19584745472E11</double>
          <double>1.2295113728E11</double>
          <double>1.2646115328E11</double>
          <double>1.30112354304E11</double>
          <double>1.33902843904E11</double>
          <double>1.37842399232E11</double>
          <double>1.41946865664E11</double>
          <double>1.46224371712E11</double>
          <double>1.50672621568E11</double>
          <double>1.55290755072E11</double>
          <double>1.6009263104E11</double>
          <double>1.65106720768E11</double>
          <double>1.703617024E11</double>
          <double>1.75877474304E11</double>
          <double>1.81679577088E11</double>
          <double>1.878193152E11</double>
          <double>1.94365267968E11</double>
          <double>2.01377759232E11</double>
          <double>2.08916729856E11</double>
          <double>2.17079339008E11</double>
          <double>2.2599460864E11</double>
          <double>2.35757586432E11</double>
          <double>2.46396299264E11</double>
          <double>2.57929975808E11</double>
          <double>2.70429997056E11</double>
          <double>2.83990779904E11</double>
          <double>2.98680803328E11</double>
          <double>3.1458311168E11</double>
          <double>3.3186030592E11</double>
          <double>3.50703732736E11</double>
          <double>3.71213545472E11</double>
          <double>3.93387358208E11</double>
          <double>4.17227421696E11</double>
          <double>4.42810028032E11</double>
          <double>4.70303281152E11</double>
          <double>5.00090738688E11</double>
          <double>5.32999827456E11</double>
          <double>5.70428798976E11</double>
          <double>6.14356912128E11</double>
          <double>6.67515684864E11</double>
          <double>7.33798486016E11</double>
          <double>8.18527848448E11</double>
          <double>9.2827239424E11</double>
          <double>1.070449819648E12</double>
          <double>1.253039509504E12</double>
          <double>1.484148729856E12</double>
          <double>1.770918344704E12</double>
          <double>2.117889619968E12</double>
          <double>2.5256260608E12</double>
          <double>2.99018000384E12</double>
          <double>3.503388432384E12</double>
          <double>4.053911175168E12</double>
          <double>4.629147369472E12</double>
          <double>5.217780740096E12</double>
          <double>5.811878656E12</double>
          <double>6.407357421568E12</double>
          <double>7.002585532416E12</double>
          <double>7.595956588544E12</double>
          <double>8.183559766016E12</double>
          <double>8.757813430272E12</double>
          <double>9.307594381312E12</double>
          <double>9.819942897664E12</double>
          <double>1.0282742843392E13</double>
          <double>1.0687287564288E13</double>
          <double>1.1029798076416E13</double>
          <double>1.1311570122752E13</double>
          <double>1.1537970098176E13</double>
          <double>1.1716781826048E13</double>
          <double>1.1856510334976E13</double>
          <double>1.1965151758336E13</double>
          <double>1.2049606332416E13</double>
          <double>1.211556726784E13</double>
          <double>1.216762507264E13</double>
          <double>1.2209433696256E13</double>
          <double>1.2243869743104E13</double>
          <double>1.2273138468864E13</double>
          <double>1.2298831906816E13</double>
          <double>1.2321999474688E13</double>
          <double>1.2343264321536E13</double>
          <double>1.236295739392E13</double>
          <double>1.238123926528E13</double>
          <double>1.2398203953152E13</double>
          <double>1.2413944446976E13</double>
          <double>1.2428557494272E13</double>
          <double>1.244212173824E13</double>
          <double>1.2454708471808E13</double>
          <double>1.2466414381056E13</double>
          <double>1.2477353119744E13</double>
          <double>1.2487605798912E13</double>
          <double>1.2497201475584E13</double>
          <double>1.2506149767168E13</double>
          <double>1.2514465767424E13</double>
          <double>1.252215547904E13</double>
          <double>1.2529208086528E13</double>
          <double>1.2535625619456E13</double>
          <double>1.2541447284736E13</double>
          <double>1.2546732535808E13</double>
          <double>1.2551535593472E13</double>
          <double>1.255590825984E13</double>
          <double>1.2559910787072E13</double>
          <double>1.256360257536E13</double>
          <double>1.2567029446656E13</double>
          <double>1.2570229082112E13</double>
          <double>1.257323828224E13</double>
          <double>1.2576085583872E13</double>
          <double>1.2578787121152E13</double>
          <double>1.2581358741504E13</double>
          <double>1.2583822764032E13</double>
          <double>1.258619595776E13</double>
          <double>1.258848167936E13</double>
          <double>1.2590680610816E13</double>
          <double>1.2592797376512E13</double>
          <double>1.2594830108672E13</double>
          <double>1.2596768735232E13</double>
          <double>1.2598616051712E13</double>
          <double>1.2600400318464E13</double>
          <double>1.2602155790336E13</double>
          <double>1.2603899224064E13</double>
          <double>1.2605634975744E13</double>
          <double>1.2607372939264E13</double>
          <double>1.2609128210432E13</double>
          <double>1.2610907830272E13</double>
          <double>1.2612707889152E13</double>
          <double>1.2614520576E13</double>
          <double>1.2616338143232E13</double>
          <double>1.2618155044864E13</double>
          <double>1.2619970803712E13</double>
          <double>1.2621784543232E13</double>
          <double>1.2623584270336E13</double>
          <double>1.2625352196096E13</double>
          <double>1.2627085328384E13</double>
          <double>1.2628797734912E13</double>
          <double>1.2630493509632E13</double>
          <double>1.2632148690944E13</double>
          <double>1.2633730197504E13</double>
          <double>1.2635222982656E13</double>
          <double>1.2636628770816E13</double>
          <double>1.26379496448E13</double>
          <double>1.2639187625984E13</double>
          <double>1.264035329024E13</double>
          <double>1.264145997824E13</double>
          <double>1.2642513065984E13</double>
          <double>1.2643517054976E13</double>
          <double>1.2644489142272E13</double>
          <double>1.2645452490752E13</double>
          <double>1.2646417188864E13</double>
          <double>1.2647378081792E13</double>
          <double>1.2648328718336E13</double>
          <double>1.2649266302976E13</double>
          <double>1.2650186000384E13</double>
          <double>1.2651085602816E13</double>
          <double>1.2651979528192E13</double>
          <double>1.2652897062912E13</double>
          <double>1.2653860769792E13</double>
          <double>1.2654872850432E13</double>
          <double>1.2655926714368E13</double>
          <double>1.2657026019328E13</double>
          <double>1.2658186379264E13</double>
          <double>1.265941967872E13</double>
          <double>1.266071990272E13</double>
          <double>1.2662064048128E13</double>
          <double>1.2663424509952E13</double>
          <double>1.2664778694656E13</double>
          <double>1.2666107392E13</double>
          <double>1.2667389861888E13</double>
          <double>1.2668608202752E13</double>
          <double>1.266975709184E13</double>
          <double>1.267084276736E13</double>
          <double>1.267186987008E13</double>
          <double>1.267283346432E13</double>
          <double>1.2673724688384E13</double>
          <double>1.267453846528E13</double>
          <double>1.2675274995712E13</double>
          <double>1.2675941595136E13</double>
          <double>1.2676556089344E13</double>
          <double>1.2677140578304E13</double>
          <double>1.2677706446848E13</double>
          <double>1.2678250153984E13</double>
          <double>1.2678766379008E13</double>
          <double>1.2679258898432E13</double>
          <double>1.267973568512E13</double>
          <double>1.2680201086976E13</double>
          <double>1.2680657686528E13</double>
          <double>1.2681109450752E13</double>
          <double>1.2681558233088E13</double>
          <double>1.2682002040832E13</double>
          <double>1.2682438828032E13</double>
          <double>1.268286599168E13</double>
          <double>1.2683277197312E13</double>
          <double>1.2683671345152E13</double>
          <double>1.268406537216E13</double>
          <double>1.2684481820672E13</double>
          <double>1.26849174528E13</double>
          <double>1.2685340827648E13</double>
          <double>1.2685731188736E13</double>
          <double>1.2686103721984E13</double>
          <double>1.2686482956288E13</double>
          <double>1.2686867808256E13</double>
          <double>1.2687242502144E13</double>
          <double>1.2687609337856E13</double>
          <double>1.2687986405376E13</double>
          <double>1.2688378447872E13</double>
          <double>1.2688773474304E13</double>
          <double>1.2689166866432E13</double>
          <double>1.268956607488E13</double>
          <double>1.2689968846848E13</double>
          <double>1.2690358501376E13</double>
          <double>1.269072816128E13</double>
          <double>1.2691092371456E13</double>
          <double>1.2691465785344E13</double>
          <double>1.269184400384E13</double>
          <double>1.2692214370304E13</double>
          <double>1.2692574099456E13</double>
          <double>1.2692928108544E13</double>
          <double>1.2693277599744E13</double>
          <double>1.2693620133888E13</double>
          <double>1.269395551232E13</double>
          <double>1.2694284384256E13</double>
          <double>1.2694605094912E13</double>
          <double>1.269491677184E13</double>
          <double>1.2695221336064E13</double>
          <double>1.2695518836736E13</double>
          <double>1.2695805779968E13</double>
          <double>1.2696082071552E13</double>
          <double>1.2696355700736E13</double>
          <double>1.2696636973056E13</double>
          <double>1.2696930359296E13</double>
          <double>1.2697232580608E13</double>
          <double>1.2697535164416E13</double>
          <double>1.2697829603328E13</double>
          <double>1.2698115221504E13</double>
          <double>1.2698401124352E13</double>
          <double>1.2698693875712E13</double>
          <double>1.2698984214528E13</double>
          <double>1.269925448704E13</double>
          <double>1.2699500312576E13</double>
          <double>1.2699736662016E13</double>
          <double>1.2699980580864E13</double>
          <double>1.2700235511808E13</double>
          <double>1.2700494139392E13</double>
          <double>1.270074743808E13</double>
          <double>1.2700987316224E13</double>
          <double>1.270120901632E13</double>
          <double>1.2701416820736E13</double>
          <double>1.2701622065152E13</double>
          <double>1.270183135232E13</double>
          <double>1.2702041397248E13</double>
          <double>1.2702247565312E13</double>
          <double>1.2702451103744E13</double>
          <double>1.2702655522816E13</double>
          <double>1.27028634112E13</double>
          <double>1.2703080689664E13</double>
          <double>1.2703316185088E13</double>
          <double>1.2703570884608E13</double>
          <double>1.2703832895488E13</double>
          <double>1.2704088537088E13</double>
          <double>1.2704334727168E13</double>
          <double>1.2704577497088E13</double>
          <double>1.2704824416256E13</double>
          <double>1.2705082632192E13</double>
          <double>1.2705357606912E13</double>
          <double>1.270564711424E13</double>
          <double>1.2705940946944E13</double>
          <double>1.270623265792E13</double>
          <double>1.2706527576064E13</double>
          <double>1.2706833055744E13</double>
          <double>1.2707144658944E13</double>
          <double>1.270744994816E13</double>
          <double>1.2707745323008E13</double>
          <double>1.2708042131456E13</double>
          <double>1.2708353775616E13</double>
          <double>1.2708679702528E13</double>
          <double>1.2709003757568E13</double>
          <double>1.2709307727872E13</double>
          <double>1.2709586530304E13</double>
          <double>1.27098504192E13</double>
          <double>1.2710113038336E13</double>
          <double>1.2710380048384E13</double>
          <double>1.2710650650624E13</double>
          <double>1.2710924023808E13</double>
          <double>1.2711196821504E13</double>
          <double>1.2711458297856E13</double>
          <double>1.271169922048E13</double>
          <double>1.2711926294528E13</double>
          <double>1.2712156510208E13</double>
          <double>1.2712393777152E13</double>
          <double>1.2712622104576E13</double>
          <double>1.2712828018688E13</double>
          <double>1.2713020106752E13</double>
          <double>1.2713020106752E13</double>
        </data>
        <size>
          <int>409</int>
        </size>
        <fullSize>
          <int>409</int>
        </fullSize>
        <fullRange>
          <PhysicalRange>
            <start>2.2758585607452595</start>
            <end>2.190795389405583</end>
            <ref>599.899958191723</ref>
            <unit>ppm</unit>
          </PhysicalRange>
        </fullRange>
        <intensityRange class="PhysicalRange">
          <start>2.84092416E8</start>
          <end>1.2713020106752E13</end>
          <ref>1.0</ref>
          <unit></unit>
        </intensityRange>
        <integratedIndexRange class="de.bruker.nmr.jview.data.IndexRange">
          <start>44730</start>
          <num>409</num>
        </integratedIndexRange>
        <normalizingFactor>1.0</normalizingFactor>
        <iBias>0.0</iBias>
        <iSlope>0.0</iSlope>
        <baselineCorr>false</baselineCorr>
        <baselinePoints>4</baselinePoints>
        <thisCluster>19</thisCluster>
        <label></label>
        <comment></comment>
        <isModified>false</isModified>
        <createdByAutomation>true</createdByAutomation>
        <type>Substance</type>
        <visibilityDisplay>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
        </visibilityDisplay>
        <visibilityHint>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
        </visibilityHint>
        <protonContent>3.0</protonContent>
        <isConsistent>true</isConsistent>
        <usedForEretic>true</usedForEretic>
        <concentration>9.802269164939794</concentration>
      </PeakCluster>
      <PeakCluster>
        <properties/>
        <dataType>INTEGRAL</dataType>
        <dataName>name not defined</dataName>
        <selected>false</selected>
        <dataVisible>true</dataVisible>
        <dimension>1</dimension>
        <data>
          <double>7663616.0</double>
          <double>1.7076224E7</double>
          <double>2.5972736E7</double>
          <double>4.00896E7</double>
          <double>6.308864E7</double>
          <double>8.9739264E7</double>
          <double>1.10931968E8</double>
          <double>1.22486784E8</double>
          <double>1.27975424E8</double>
          <double>1.34664192E8</double>
          <double>1.46939904E8</double>
          <double>1.62603008E8</double>
          <double>1.76113664E8</double>
          <double>1.8622464E8</double>
          <double>1.99165952E8</double>
          <double>2.22885888E8</double>
          <double>2.59104768E8</double>
          <double>3.01953024E8</double>
          <double>3.43195648E8</double>
          <double>3.7804032E8</double>
          <double>4.07597056E8</double>
          <double>4.37366784E8</double>
          <double>4.72809472E8</double>
          <double>5.15538944E8</double>
          <double>5.63611648E8</double>
          <double>6.14086656E8</double>
          <double>6.63728128E8</double>
          <double>7.08921344E8</double>
          <double>7.48355584E8</double>
          <double>7.85272832E8</double>
          <double>8.23742464E8</double>
          <double>8.63326208E8</double>
          <double>9.01634048E8</double>
          <double>9.41572096E8</double>
          <double>9.89919232E8</double>
          <double>1.046509568E9</double>
          <double>1.099659264E9</double>
          <double>1.135816704E9</double>
          <double>1.15136512E9</double>
          <double>1.153697792E9</double>
          <double>1.154469888E9</double>
          <double>1.163327488E9</double>
          <double>1.183297536E9</double>
          <double>1.2086784E9</double>
          <double>1.23086848E9</double>
          <double>1.24954624E9</double>
          <double>1.275019264E9</double>
          <double>1.316388864E9</double>
          <double>1.370374144E9</double>
          <double>1.424871424E9</double>
          <double>1.470369792E9</double>
          <double>1.5049216E9</double>
          <double>1.532188672E9</double>
          <double>1.559519232E9</double>
          <double>1.594591232E9</double>
          <double>1.638060032E9</double>
          <double>1.681266688E9</double>
          <double>1.716641792E9</double>
          <double>1.748658176E9</double>
          <double>1.788041216E9</double>
          <double>1.835728896E9</double>
          <double>1.879771136E9</double>
          <double>1.909981184E9</double>
          <double>1.928900608E9</double>
          <double>1.944168448E9</double>
          <double>1.955315712E9</double>
          <double>1.955147776E9</double>
          <double>1.943343104E9</double>
          <double>1.932300288E9</double>
          <double>1.936222208E9</double>
          <double>1.956882432E9</double>
          <double>1.983510528E9</double>
          <double>2.006212608E9</double>
          <double>2.025951232E9</double>
          <double>2.049736704E9</double>
          <double>2.079125504E9</double>
          <double>2.10783232E9</double>
          <double>2.1303296E9</double>
          <double>2.148450304E9</double>
          <double>2.167400448E9</double>
          <double>2.188365824E9</double>
          <double>2.208120832E9</double>
          <double>2.224584704E9</double>
          <double>2.239881216E9</double>
          <double>2.257864704E9</double>
          <double>2.279933952E9</double>
          <double>2.302543872E9</double>
          <double>2.3176192E9</double>
          <double>2.317060096E9</double>
          <double>2.300131328E9</double>
          <double>2.277361664E9</double>
          <double>2.265186304E9</double>
          <double>2.274531328E9</double>
          <double>2.303647744E9</double>
          <double>2.341349376E9</double>
          <double>2.376523776E9</double>
          <double>2.404775936E9</double>
          <double>2.42782208E9</double>
          <double>2.449393664E9</double>
          <double>2.47302144E9</double>
          <double>2.501697536E9</double>
          <double>2.536415232E9</double>
          <double>2.575337472E9</double>
          <double>2.617444352E9</double>
          <double>2.666246144E9</double>
          <double>2.724380672E9</double>
          <double>2.783563776E9</double>
          <double>2.82788864E9</double>
          <double>2.8529664E9</double>
          <double>2.875482112E9</double>
          <double>2.914916352E9</double>
          <double>2.969554944E9</double>
          <double>3.021002752E9</double>
          <double>3.06069504E9</double>
          <double>3.09962752E9</double>
          <double>3.149764608E9</double>
          <double>3.208419328E9</double>
          <double>3.2674304E9</double>
          <double>3.327219712E9</double>
          <double>3.39244032E9</double>
          <double>3.460962304E9</double>
          <double>3.52770048E9</double>
          <double>3.595157504E9</double>
          <double>3.66951424E9</double>
          <double>3.747375104E9</double>
          <double>3.816022016E9</double>
          <double>3.868076032E9</double>
          <double>3.908538368E9</double>
          <double>3.945883648E9</double>
          <double>3.98271488E9</double>
          <double>4.017342464E9</double>
          <double>4.048195584E9</double>
          <double>4.0727552E9</double>
          <double>4.086863872E9</double>
          <double>4.090681344E9</double>
          <double>4.09388032E9</double>
          <double>4.10973184E9</double>
          <double>4.142358528E9</double>
          <double>4.182687744E9</double>
          <double>4.220012544E9</double>
          <double>4.256641024E9</double>
          <double>4.3073024E9</double>
          <double>4.382388224E9</double>
          <double>4.475004928E9</double>
          <double>4.567351296E9</double>
          <double>4.646422528E9</double>
          <double>4.708952064E9</double>
          <double>4.754925568E9</double>
          <double>4.78553088E9</double>
          <double>4.808327168E9</double>
          <double>4.8361472E9</double>
          <double>4.877643776E9</double>
          <double>4.934555648E9</double>
          <double>5.008758784E9</double>
          <double>5.10229504E9</double>
          <double>5.20664064E9</double>
          <double>5.302607872E9</double>
          <double>5.379586048E9</double>
          <double>5.448251392E9</double>
          <double>5.526550528E9</double>
          <double>5.61965056E9</double>
          <double>5.72210176E9</double>
          <double>5.8318848E9</double>
          <double>5.949372416E9</double>
          <double>6.066180096E9</double>
          <double>6.168977408E9</double>
          <double>6.25567744E9</double>
          <double>6.337622016E9</double>
          <double>6.424455168E9</double>
          <double>6.515335168E9</double>
          <double>6.605477888E9</double>
          <double>6.69244416E9</double>
          <double>6.775209984E9</double>
          <double>6.85586432E9</double>
          <double>6.942988288E9</double>
          <double>7.043944448E9</double>
          <double>7.152386048E9</double>
          <double>7.253420032E9</double>
          <double>7.343874048E9</double>
          <double>7.437590528E9</double>
          <double>7.546896384E9</double>
          <double>7.66898176E9</double>
          <double>7.795968E9</double>
          <double>7.92838144E9</double>
          <double>8.070189056E9</double>
          <double>8.217352192E9</double>
          <double>8.360083456E9</double>
          <double>8.492611584E9</double>
          <double>8.6147072E9</double>
          <double>8.728848384E9</double>
          <double>8.843300864E9</double>
          <double>8.97304576E9</double>
          <double>9.127569408E9</double>
          <double>9.29796096E9</double>
          <double>9.46335744E9</double>
          <double>9.611249664E9</double>
          <double>9.74682112E9</double>
          <double>9.88274688E9</double>
          <double>1.0025334784E10</double>
          <double>1.0172422144E10</double>
          <double>1.0320871424E10</double>
          <double>1.0472216576E10</double>
          <double>1.0629675008E10</double>
          <double>1.0790680576E10</double>
          <double>1.09465088E10</double>
          <double>1.1093673984E10</double>
          <double>1.1243515904E10</double>
          <double>1.1413202944E10</double>
          <double>1.1606237184E10</double>
          <double>1.1809058816E10</double>
          <double>1.2009269248E10</double>
          <double>1.2209078272E10</double>
          <double>1.2415913984E10</double>
          <double>1.2627781632E10</double>
          <double>1.2836018176E10</double>
          <double>1.303791616E10</double>
          <double>1.3238843392E10</double>
          <double>1.3445165056E10</double>
          <double>1.3662261248E10</double>
          <double>1.3896732672E10</double>
          <double>1.4152896512E10</double>
          <double>1.4427783168E10</double>
          <double>1.4714669056E10</double>
          <double>1.500955648E10</double>
          <double>1.5310249984E10</double>
          <double>1.561437184E10</double>
          <double>1.5925325824E10</double>
          <double>1.6254685184E10</double>
          <double>1.6608899072E10</double>
          <double>1.6977666048E10</double>
          <double>1.7346830336E10</double>
          <double>1.7719826432E10</double>
          <double>1.8112997376E10</double>
          <double>1.8530588672E10</double>
          <double>1.8959396864E10</double>
          <double>1.9390222336E10</double>
          <double>1.9828176896E10</double>
          <double>2.0275724288E10</double>
          <double>2.0722249728E10</double>
          <double>2.11622912E10</double>
          <double>2.1610932224E10</double>
          <double>2.208606208E10</double>
          <double>2.2583969792E10</double>
          <double>2.3088084992E10</double>
          <double>2.3596173312E10</double>
          <double>2.412254208E10</double>
          <double>2.4676114432E10</double>
          <double>2.5253394432E10</double>
          <double>2.5854353408E10</double>
          <double>2.6488766464E10</double>
          <double>2.7161540608E10</double>
          <double>2.7865225216E10</double>
          <double>2.8593897472E10</double>
          <double>2.9353498624E10</double>
          <double>3.015160832E10</double>
          <double>3.0987907072E10</double>
          <double>3.1863627776E10</double>
          <double>3.2790951936E10</double>
          <double>3.3782380544E10</double>
          <double>3.4838444032E10</double>
          <double>3.5958028288E10</double>
          <double>3.7155086336E10</double>
          <double>3.8450112512E10</double>
          <double>3.9845349376E10</double>
          <double>4.132255744E10</double>
          <double>4.2870276096E10</double>
          <double>4.4504242176E10</double>
          <double>4.6255224832E10</double>
          <double>4.8142106624E10</double>
          <double>5.0160723968E10</double>
          <double>5.2294088704E10</double>
          <double>5.4528905216E10</double>
          <double>5.6865540096E10</double>
          <double>5.9317792768E10</double>
          <double>6.1904920576E10</double>
          <double>6.4643080192E10</double>
          <double>6.7542392832E10</double>
          <double>7.060841472E10</double>
          <double>7.3843968E10</double>
          <double>7.7252118528E10</double>
          <double>8.0840466432E10</double>
          <double>8.4621244416E10</double>
          <double>8.8606398464E10</double>
          <double>9.280707584E10</double>
          <double>9.7240446976E10</double>
          <double>1.01932740608E11</double>
          <double>1.06916896768E11</double>
          <double>1.12241852416E11</double>
          <double>1.17994719232E11</double>
          <double>1.24305946624E11</double>
          <double>1.31327711232E11</double>
          <double>1.3922869248E11</double>
          <double>1.48236109824E11</double>
          <double>1.58678638592E11</double>
          <double>1.7097177088E11</double>
          <double>1.85576298496E11</double>
          <double>2.03000297472E11</double>
          <double>2.23822258176E11</double>
          <double>2.48645543936E11</double>
          <double>2.77991477248E11</double>
          <double>3.1225095168E11</double>
          <double>3.51740012544E11</double>
          <double>3.9675549696E11</double>
          <double>4.47558668288E11</double>
          <double>5.04373039104E11</double>
          <double>5.67474423808E11</double>
          <double>6.37262671872E11</double>
          <double>7.1415510016E11</double>
          <double>7.98342846464E11</double>
          <double>8.89603002368E11</double>
          <double>9.8725219328E11</double>
          <double>1.09017990144E12</double>
          <double>1.196949997568E12</double>
          <double>1.306045990912E12</double>
          <double>1.41621844992E12</double>
          <double>1.526714423296E12</double>
          <double>1.637227368448E12</double>
          <double>1.74764171264E12</double>
          <double>1.857745664E12</double>
          <double>1.966998913024E12</double>
          <double>2.07439581184E12</double>
          <double>2.178513238016E12</double>
          <double>2.27778444288E12</double>
          <double>2.370864869376E12</double>
          <double>2.45688341504E12</double>
          <double>2.53550181376E12</double>
          <double>2.606839816192E12</double>
          <double>2.671318421504E12</double>
          <double>2.729445451776E12</double>
          <double>2.78162495488E12</double>
          <double>2.828099762176E12</double>
          <double>2.869031170048E12</double>
          <double>2.904607883264E12</double>
          <double>2.935105230848E12</double>
          <double>2.960908111872E12</double>
          <double>2.982519238656E12</double>
          <double>3.00052931584E12</double>
          <double>3.015542503424E12</double>
          <double>3.028106067968E12</double>
          <double>3.038686162944E12</double>
          <double>3.047675148288E12</double>
          <double>3.05539953664E12</double>
          <double>3.062124838912E12</double>
          <double>3.068062777344E12</double>
          <double>3.073376612352E12</double>
          <double>3.078187597824E12</double>
          <double>3.082591459328E12</double>
          <double>3.086672433152E12</double>
          <double>3.090495041536E12</double>
          <double>3.09408966656E12</double>
          <double>3.097466310656E12</double>
          <double>3.100645974016E12</double>
          <double>3.103664060416E12</double>
          <double>3.106543378432E12</double>
          <double>3.10928539648E12</double>
          <double>3.11189563392E12</double>
          <double>3.114399315968E12</double>
          <double>3.116822194176E12</double>
          <double>3.119172421632E12</double>
          <double>3.121452169216E12</double>
          <double>3.123670759424E12</double>
          <double>3.125832454144E12</double>
          <double>3.127925704704E12</double>
          <double>3.129941600256E12</double>
          <double>3.131893123072E12</double>
          <double>3.13379950592E12</double>
          <double>3.135659003904E12</double>
          <double>3.137454649344E12</double>
          <double>3.13918311424E12</double>
          <double>3.140861165568E12</double>
          <double>3.14250297344E12</double>
          <double>3.144103550976E12</double>
          <double>3.145645295616E12</double>
          <double>3.14711069696E12</double>
          <double>3.148488916992E12</double>
          <double>3.14978031616E12</double>
          <double>3.15099657216E12</double>
          <double>3.152149823488E12</double>
          <double>3.153242558464E12</double>
          <double>3.154274701312E12</double>
          <double>3.155256819712E12</double>
          <double>3.156204468224E12</double>
          <double>3.157118001152E12</double>
          <double>3.157978259456E12</double>
          <double>3.15876736E12</double>
          <double>3.159489265664E12</double>
          <double>3.160167831552E12</double>
          <double>3.160828755968E12</double>
          <double>3.161483585536E12</double>
          <double>3.162125303808E12</double>
          <double>3.16273665024E12</double>
          <double>3.163305719808E12</double>
          <double>3.163835174912E12</double>
          <double>3.16433581056E12</double>
          <double>3.16481463296E12</double>
          <double>3.165274273792E12</double>
          <double>3.165721710592E12</double>
          <double>3.166169358336E12</double>
          <double>3.166624704512E12</double>
          <double>3.167082702848E12</double>
          <double>3.167530194944E12</double>
          <double>3.167955079168E12</double>
          <double>3.168351105024E12</double>
          <double>3.168718430208E12</double>
          <double>3.169062684672E12</double>
          <double>3.169392093184E12</double>
          <double>3.169713508352E12</double>
          <double>3.170030409728E12</double>
          <double>3.170342981632E12</double>
          <double>3.170648346624E12</double>
          <double>3.170942017536E12</double>
          <double>3.171222300672E12</double>
          <double>3.1714941952E12</double>
          <double>3.171767769088E12</double>
          <double>3.172051447808E12</double>
          <double>3.17234545664E12</double>
          <double>3.172640360448E12</double>
          <double>3.172923502592E12</double>
          <double>3.173190301696E12</double>
          <double>3.17344893952E12</double>
          <double>3.17371005952E12</double>
          <double>3.173972207616E12</double>
          <double>3.174222997504E12</double>
          <double>3.174455422976E12</double>
          <double>3.174676568064E12</double>
          <double>3.174898194432E12</double>
          <double>3.175125999616E12</double>
          <double>3.175361337344E12</double>
          <double>3.175604422656E12</double>
          <double>3.175848585216E12</double>
          <double>3.176079030272E12</double>
          <double>3.176287332352E12</double>
          <double>3.17648297984E12</double>
          <double>3.176680974336E12</double>
          <double>3.176881743872E12</double>
          <double>3.177074542592E12</double>
          <double>3.177258887168E12</double>
          <double>3.177449535488E12</double>
          <double>3.177657024512E12</double>
          <double>3.177873680384E12</double>
          <double>3.178083708928E12</double>
          <double>3.178279041024E12</double>
          <double>3.178460485632E12</double>
          <double>3.17863164928E12</double>
          <double>3.178799386624E12</double>
          <double>3.178974384128E12</double>
          <double>3.17916153856E12</double>
          <double>3.179351017472E12</double>
          <double>3.17952722944E12</double>
          <double>3.179688112128E12</double>
          <double>3.179848982528E12</double>
          <double>3.1800240128E12</double>
          <double>3.18020893696E12</double>
          <double>3.18038735872E12</double>
          <double>3.180551651328E12</double>
          <double>3.180710803456E12</double>
          <double>3.180876271616E12</double>
          <double>3.181046259712E12</double>
          <double>3.181208915968E12</double>
          <double>3.181357643776E12</double>
          <double>3.181497145344E12</double>
          <double>3.181635713024E12</double>
          <double>3.181778374656E12</double>
          <double>3.181928536064E12</double>
          <double>3.182089426944E12</double>
          <double>3.182259961856E12</double>
          <double>3.182433112064E12</double>
          <double>3.18260187136E12</double>
          <double>3.182764183552E12</double>
          <double>3.182920169472E12</double>
          <double>3.183068416E12</double>
          <double>3.183208296448E12</double>
          <double>3.183343620096E12</double>
          <double>3.183481792512E12</double>
          <double>3.183630985216E12</double>
          <double>3.183797006336E12</double>
          <double>3.183977490432E12</double>
          <double>3.184158830592E12</double>
          <double>3.1843259904E12</double>
          <double>3.184477650944E12</double>
          <double>3.184625154048E12</double>
          <double>3.184775129088E12</double>
          <double>3.184922761216E12</double>
          <double>3.185065463808E12</double>
          <double>3.185210697728E12</double>
          <double>3.185361358848E12</double>
          <double>3.185504149504E12</double>
          <double>3.185624961024E12</double>
          <double>3.18572874752E12</double>
          <double>3.185831124992E12</double>
          <double>3.185935214592E12</double>
          <double>3.186030508032E12</double>
          <double>3.186111991808E12</double>
          <double>3.186187501568E12</double>
          <double>3.186267662336E12</double>
          <double>3.186361055232E12</double>
          <double>3.186476904448E12</double>
          <double>3.186616936448E12</double>
          <double>3.186763102208E12</double>
          <double>3.186889046016E12</double>
          <double>3.18698954752E12</double>
          <double>3.187086882816E12</double>
          <double>3.187202797568E12</double>
          <double>3.187334883328E12</double>
          <double>3.187465598976E12</double>
          <double>3.187583315968E12</double>
          <double>3.18768728064E12</double>
          <double>3.187781679104E12</double>
          <double>3.18787373056E12</double>
          <double>3.187971340288E12</double>
          <double>3.188075628544E12</double>
          <double>3.18818091008E12</double>
          <double>3.18828686336E12</double>
          <double>3.188403423232E12</double>
          <double>3.1885374976E12</double>
          <double>3.188681701376E12</double>
          <double>3.1888229376E12</double>
          <double>3.18895592448E12</double>
          <double>3.189081372672E12</double>
          <double>3.189197543424E12</double>
          <double>3.189302767616E12</double>
          <double>3.189402370048E12</double>
          <double>3.18950449152E12</double>
          <double>3.189611331584E12</double>
          <double>3.189721532416E12</double>
          <double>3.18983844864E12</double>
          <double>3.189967935488E12</double>
          <double>3.190108491776E12</double>
          <double>3.190250113024E12</double>
          <double>3.190383153152E12</double>
          <double>3.190503583744E12</double>
          <double>3.190610231296E12</double>
          <double>3.190702712832E12</double>
          <double>3.190784114688E12</double>
          <double>3.190862792704E12</double>
          <double>3.190948825088E12</double>
          <double>3.19104723968E12</double>
          <double>3.191153655808E12</double>
          <double>3.19125846016E12</double>
          <double>3.191358099456E12</double>
          <double>3.191459268608E12</double>
          <double>3.19156593664E12</double>
          <double>3.191665676288E12</double>
          <double>3.191739987968E12</double>
          <double>3.191788785664E12</double>
          <double>3.19183166464E12</double>
          <double>3.191880923136E12</double>
          <double>3.191928147968E12</double>
          <double>3.191966609408E12</double>
          <double>3.192011784192E12</double>
          <double>3.192082558976E12</double>
          <double>3.192170887168E12</double>
          <double>3.192249759744E12</double>
          <double>3.192309147648E12</double>
          <double>3.192365432832E12</double>
          <double>3.192433252352E12</double>
          <double>3.192505862144E12</double>
          <double>3.192570595328E12</double>
          <double>3.192629420032E12</double>
          <double>3.1926937088E12</double>
          <double>3.192767952896E12</double>
          <double>3.192849348608E12</double>
          <double>3.192937668608E12</double>
          <double>3.193034749952E12</double>
          <double>3.193136529408E12</double>
          <double>3.193235038208E12</double>
          <double>3.193329020928E12</double>
          <double>3.193425313792E12</double>
          <double>3.193527324672E12</double>
          <double>3.193627342848E12</double>
          <double>3.193714425856E12</double>
          <double>3.193788033024E12</double>
          <double>3.193859762176E12</double>
          <double>3.193940365312E12</double>
          <double>3.194027558912E12</double>
          <double>3.194109728768E12</double>
          <double>3.19418105856E12</double>
          <double>3.194248562688E12</double>
          <double>3.19432192E12</double>
          <double>3.194400466944E12</double>
          <double>3.194475292672E12</double>
          <double>3.194542454784E12</double>
          <double>3.194608009216E12</double>
          <double>3.194679209984E12</double>
          <double>3.194756696064E12</double>
          <double>3.19483901952E12</double>
          <double>3.194930552832E12</double>
          <double>3.19503860736E12</double>
          <double>3.195162451968E12</double>
          <double>3.19529037824E12</double>
          <double>3.195410649088E12</double>
          <double>3.195522267136E12</double>
          <double>3.19563030528E12</double>
          <double>3.19573211136E12</double>
          <double>3.195815643136E12</double>
          <double>3.19587524608E12</double>
          <double>3.195923369984E12</double>
          <double>3.195979505664E12</double>
          <double>3.19604957184E12</double>
          <double>3.19612271616E12</double>
          <double>3.196186841088E12</double>
          <double>3.19623954432E12</double>
          <double>3.196284370944E12</double>
          <double>3.19632600064E12</double>
          <double>3.19637179392E12</double>
          <double>3.19642891264E12</double>
          <double>3.196494915584E12</double>
          <double>3.196558075904E12</double>
          <double>3.19661154304E12</double>
          <double>3.196660197376E12</double>
          <double>3.19670919168E12</double>
          <double>3.196754509824E12</double>
          <double>3.196791906304E12</double>
          <double>3.19682719744E12</double>
          <double>3.196868763648E12</double>
          <double>3.196916176896E12</double>
          <double>3.196965113856E12</double>
          <double>3.19701721088E12</double>
          <double>3.197074931712E12</double>
          <double>3.197132894208E12</double>
          <double>3.19718639616E12</double>
          <double>3.197243551744E12</double>
          <double>3.19731483648E12</double>
          <double>3.197393012736E12</double>
          <double>3.19745841152E12</double>
          <double>3.1975045632E12</double>
          <double>3.197544157184E12</double>
          <double>3.197588033536E12</double>
          <double>3.197633605632E12</double>
          <double>3.197678710784E12</double>
          <double>3.197731342336E12</double>
          <double>3.197796233216E12</double>
          <double>3.197863872512E12</double>
          <double>3.197924212736E12</double>
          <double>3.1979828224E12</double>
          <double>3.1980508672E12</double>
          <double>3.198123429888E12</double>
          <double>3.198179905536E12</double>
          <double>3.198206674944E12</double>
          <double>3.198211710976E12</double>
          <double>3.198215319552E12</double>
          <double>3.198215319552E12</double>
        </data>
        <size>
          <int>642</int>
        </size>
        <fullSize>
          <int>642</int>
        </fullSize>
        <fullRange>
          <PhysicalRange>
            <start>6.999783404408033</start>
            <end>6.866142490612118</end>
            <ref>599.899958191723</ref>
            <unit>ppm</unit>
          </PhysicalRange>
        </fullRange>
        <intensityRange class="PhysicalRange">
          <start>7663616.0</start>
          <end>3.198215319552E12</end>
          <ref>1.0</ref>
          <unit></unit>
        </intensityRange>
        <integratedIndexRange class="de.bruker.nmr.jview.data.IndexRange">
          <start>22072</start>
          <num>642</num>
        </integratedIndexRange>
        <normalizingFactor>1.0</normalizingFactor>
        <iBias>0.0</iBias>
        <iSlope>0.0</iSlope>
        <baselineCorr>false</baselineCorr>
        <baselinePoints>4</baselinePoints>
        <thisCluster>20</thisCluster>
        <label></label>
        <comment></comment>
        <isModified>false</isModified>
        <createdByAutomation>true</createdByAutomation>
        <type>Substance</type>
        <visibilityDisplay>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
        </visibilityDisplay>
        <visibilityHint>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
        </visibilityHint>
        <protonContent>1.0</protonContent>
        <isConsistent>true</isConsistent>
        <usedForEretic>true</usedForEretic>
        <concentration>7.397810177718983</concentration>
      </PeakCluster>
      <PeakCluster>
        <properties/>
        <dataType>INTEGRAL</dataType>
        <dataName>name not defined</dataName>
        <selected>false</selected>
        <dataVisible>true</dataVisible>
        <dimension>1</dimension>
        <data>
          <double>-3747840.0</double>
          <double>-1.5413248E7</double>
          <double>-2.5341952E7</double>
          <double>-2.9093888E7</double>
          <double>-3.0072832E7</double>
          <double>-3.201024E7</double>
          <double>-3.7310464E7</double>
          <double>-4.7945728E7</double>
          <double>-6.002688E7</double>
          <double>-6.2349312E7</double>
          <double>-4.9074176E7</double>
          <double>-3.0517248E7</double>
          <double>-2.330624E7</double>
          <double>-3.2712704E7</double>
          <double>-5.1972096E7</double>
          <double>-7.4258432E7</double>
          <double>-9.480192E7</double>
          <double>-1.04065024E8</double>
          <double>-9.1977728E7</double>
          <double>-6.1878272E7</double>
          <double>-3.0887936E7</double>
          <double>-1.2701696E7</double>
          <double>-6463488.0</double>
          <double>-4816896.0</double>
          <double>-5769216.0</double>
          <double>-1.2675072E7</double>
          <double>-2.7439104E7</double>
          <double>-4.7386624E7</double>
          <double>-6.6248704E7</double>
          <double>-7.7160448E7</double>
          <double>-7.7613056E7</double>
          <double>-7.1456768E7</double>
          <double>-6.3367168E7</double>
          <double>-5.3968896E7</double>
          <double>-4.483072E7</double>
          <double>-4.3292672E7</double>
          <double>-5.257216E7</double>
          <double>-5.91872E7</double>
          <double>-4.1949184E7</double>
          <double>4763648.0</double>
          <double>6.6895872E7</double>
          <double>1.31508224E8</double>
          <double>2.00116224E8</double>
          <double>2.77762048E8</double>
          <double>3.615232E8</double>
          <double>4.47645696E8</double>
          <double>5.39860992E8</double>
          <double>6.41507328E8</double>
          <double>7.47053056E8</double>
          <double>8.49686528E8</double>
          <double>9.49440512E8</double>
          <double>1.044938752E9</double>
          <double>1.125793792E9</double>
          <double>1.185624064E9</double>
          <double>1.237026816E9</double>
          <double>1.300662272E9</double>
          <double>1.382731776E9</double>
          <double>1.476179968E9</double>
          <double>1.582563328E9</double>
          <double>1.719568384E9</double>
          <double>1.90678016E9</double>
          <double>2.158757888E9</double>
          <double>2.498359296E9</double>
          <double>2.967724032E9</double>
          <double>3.620581376E9</double>
          <double>4.510210048E9</double>
          <double>5.687638016E9</double>
          <double>7.200796672E9</double>
          <double>9.082669056E9</double>
          <double>1.1335534592E10</double>
          <double>1.3922719744E10</double>
          <double>1.6767092736E10</double>
          <double>1.9753908224E10</double>
          <double>2.274418688E10</double>
          <double>2.5600301056E10</double>
          <double>2.8211161088E10</double>
          <double>3.0503958528E10</double>
          <double>3.2442966016E10</double>
          <double>3.4023258112E10</double>
          <double>3.5264043008E10</double>
          <double>3.6203173888E10</double>
          <double>3.6892295168E10</double>
          <double>3.7388961792E10</double>
          <double>3.7745451008E10</double>
          <double>3.8002495488E10</double>
          <double>3.8192852992E10</double>
          <double>3.8344974336E10</double>
          <double>3.8477195264E10</double>
          <double>3.8591909888E10</double>
          <double>3.8683568128E10</double>
          <double>3.8752622592E10</double>
          <double>3.8806874112E10</double>
          <double>3.8852612096E10</double>
          <double>3.8893205504E10</double>
          <double>3.8934781952E10</double>
          <double>3.8983022592E10</double>
          <double>3.9033856E10</double>
          <double>3.9078230016E10</double>
          <double>3.9118782464E10</double>
          <double>3.917159424E10</double>
          <double>3.9247149056E10</double>
          <double>3.9338348544E10</double>
          <double>3.9430680576E10</double>
          <double>3.951397888E10</double>
          <double>3.9579858944E10</double>
          <double>3.9620306944E10</double>
          <double>3.9638310912E10</double>
          <double>3.9650117632E10</double>
          <double>3.96662272E10</double>
          <double>3.9677820928E10</double>
          <double>3.9672502272E10</double>
          <double>3.9655716864E10</double>
          <double>3.9644030976E10</double>
          <double>3.9643492352E10</double>
          <double>3.9648647168E10</double>
          <double>3.9658031104E10</double>
          <double>3.9674202112E10</double>
          <double>3.9689969664E10</double>
          <double>3.9691804672E10</double>
          <double>3.9679602688E10</double>
          <double>3.9667769344E10</double>
          <double>3.9662774272E10</double>
          <double>3.9654752256E10</double>
          <double>3.9637276672E10</double>
          <double>3.9619602432E10</double>
          <double>3.9609249792E10</double>
          <double>3.959681024E10</double>
          <double>3.957262336E10</double>
          <double>3.9548493824E10</double>
          <double>3.954572288E10</double>
          <double>3.9565744128E10</double>
          <double>3.9588466688E10</double>
          <double>3.9598862336E10</double>
          <double>3.9600539648E10</double>
          <double>3.9601549312E10</double>
          <double>3.960126464E10</double>
          <double>3.959693312E10</double>
          <double>3.9592163328E10</double>
          <double>3.9591202816E10</double>
          <double>3.9591723008E10</double>
          <double>3.9589480448E10</double>
          <double>3.9584509952E10</double>
          <double>3.9577606144E10</double>
          <double>3.9566833664E10</double>
          <double>3.9553558528E10</double>
          <double>3.9546103808E10</double>
          <double>3.9549792256E10</double>
          <double>3.9557576704E10</double>
          <double>3.9558688768E10</double>
          <double>3.9553830912E10</double>
          <double>3.9553380352E10</double>
          <double>3.9553380352E10</double>
        </data>
        <size>
          <int>152</int>
        </size>
        <fullSize>
          <int>152</int>
        </fullSize>
        <fullRange>
          <PhysicalRange>
            <start>0.015012898962265098</start>
            <end>-0.016260325794970498</end>
            <ref>599.899958191723</ref>
            <unit>ppm</unit>
          </PhysicalRange>
        </fullRange>
        <intensityRange class="PhysicalRange">
          <start>-1.04065024E8</start>
          <end>3.9691804672E10</end>
          <ref>1.0</ref>
          <unit></unit>
        </intensityRange>
        <integratedIndexRange class="de.bruker.nmr.jview.data.IndexRange">
          <start>55573</start>
          <num>152</num>
        </integratedIndexRange>
        <normalizingFactor>1.0</normalizingFactor>
        <iBias>0.0</iBias>
        <iSlope>0.0</iSlope>
        <baselineCorr>false</baselineCorr>
        <baselinePoints>4</baselinePoints>
        <thisCluster>21</thisCluster>
        <label></label>
        <comment></comment>
        <isModified>false</isModified>
        <createdByAutomation>true</createdByAutomation>
        <type>Impurity</type>
        <visibilityDisplay>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
        </visibilityDisplay>
        <visibilityHint>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>true</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
          <boolean>false</boolean>
        </visibilityHint>
        <protonContent>0.0</protonContent>
        <isConsistent>true</isConsistent>
        <usedForEretic>false</usedForEretic>
        <concentration>0.0</concentration>
      </PeakCluster>
    </peakClusters>
  </integralRange>
  <prop>
    <property name="PURITY_AUTOMATION" value="Medium"/>
  </prop>
</CmcaProject>