sci-libs/ccpn-data/files/312+ccpn_rhf22_2013-10-02-16-17-30-923_00001.xml


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<?xml version="1.0" encoding="UTF-8"?>
<_StorageUnit release="2.1.2" originator="CCPN Python XmlIO" packageGuid="www.ccpn.ac.uk_Fogh_2006-08-16-14:22:45_00019" time="Wed Oct  2 16:22:49 2013">

<NMRX.NmrExpPrototype _ID="_1" createdBy="ccpnRef" guid="ccpn_rhf22_2013-10-02-16-17-30-923_00001" lastUnlockedBy="editor" serial="312">
  <NMRX.NmrExpPrototype.category>
    <NMRX.ExpCategory>through-bond</NMRX.ExpCategory>
  </NMRX.NmrExpPrototype.category>
  <NMRX.NmrExpPrototype.details>
    <IMPL.Text>e.g. POST-C7, INADEQUATE</IMPL.Text>
  </NMRX.NmrExpPrototype.details>
  <NMRX.NmrExpPrototype.name>
    <IMPL.Line>C[DQ(CC)]_C.through-space</IMPL.Line>
  </NMRX.NmrExpPrototype.name>
  <NMRX.NmrExpPrototype.synonym>
    <IMPL.Line>13C DQ</IMPL.Line>
  </NMRX.NmrExpPrototype.synonym>
  <NMRX.NmrExpPrototype.atomSites>
    <NMRX.AtomSite _ID="_2" isotopeCode="13C" name="C" serial="1">
      <NMRX.AtomSite.expMeasurements> _3 _4</NMRX.AtomSite.expMeasurements>
      <NMRX.AtomSite.expTransfers> _5 _6</NMRX.AtomSite.expTransfers>
    </NMRX.AtomSite>
    <NMRX.AtomSite _ID="_7" isotopeCode="13C" name="C" serial="2">
      <NMRX.AtomSite.expMeasurements> _4</NMRX.AtomSite.expMeasurements>
      <NMRX.AtomSite.expTransfers> _5</NMRX.AtomSite.expTransfers>
    </NMRX.AtomSite>
    <NMRX.AtomSite _ID="_8" isotopeCode="13C" name="C" serial="3">
      <NMRX.AtomSite.expMeasurements> _9</NMRX.AtomSite.expMeasurements>
      <NMRX.AtomSite.expTransfers> _6</NMRX.AtomSite.expTransfers>
    </NMRX.AtomSite>
  </NMRX.NmrExpPrototype.atomSites>
  <NMRX.NmrExpPrototype.expGraphs>
    <NMRX.ExpGraph _ID="_10" serial="1">
      <NMRX.ExpGraph.expSteps>
        <NMRX.ExpStep _ID="_11" serial="1" stepNumber="1">
        </NMRX.ExpStep>
        <NMRX.ExpStep _ID="_12" serial="2" stepNumber="2">
        </NMRX.ExpStep>
        <NMRX.ExpStep _ID="_13" serial="3" stepNumber="3">
        </NMRX.ExpStep>
        <NMRX.ExpStep _ID="_14" serial="4" stepNumber="4">
        </NMRX.ExpStep>
      </NMRX.ExpGraph.expSteps>
      <NMRX.ExpGraph.expTransfers>
        <NMRX.ExpTransfer _ID="_5" serial="1" transferType="onebond">
          <NMRX.ExpTransfer.atomSites> _7 _2</NMRX.ExpTransfer.atomSites>
        </NMRX.ExpTransfer>
        <NMRX.ExpTransfer _ID="_6" serial="2" transferToSelf="true" transferType="through-space">
          <NMRX.ExpTransfer.atomSites> _8 _2</NMRX.ExpTransfer.atomSites>
        </NMRX.ExpTransfer>
      </NMRX.ExpGraph.expTransfers>
    </NMRX.ExpGraph>
  </NMRX.NmrExpPrototype.expGraphs>
  <NMRX.NmrExpPrototype.expMeasurements>
    <NMRX.ExpMeasurement _ID="_3" serial="1">
      <NMRX.ExpMeasurement.measurementType>
        <NMRX.ExpMeasurementType>Shift</NMRX.ExpMeasurementType>
      </NMRX.ExpMeasurement.measurementType>
      <NMRX.ExpMeasurement.atomSites> _2</NMRX.ExpMeasurement.atomSites>
      <NMRX.ExpMeasurement.expSteps> _11 _13</NMRX.ExpMeasurement.expSteps>
      <NMRX.ExpMeasurement.refExpDimRefs> _15</NMRX.ExpMeasurement.refExpDimRefs>
    </NMRX.ExpMeasurement>
    <NMRX.ExpMeasurement _ID="_4" serial="2">
      <NMRX.ExpMeasurement.atomSiteWeights> 1.0 1.0</NMRX.ExpMeasurement.atomSiteWeights>
      <NMRX.ExpMeasurement.measurementType>
        <NMRX.ExpMeasurementType>MQShift</NMRX.ExpMeasurementType>
      </NMRX.ExpMeasurement.measurementType>
      <NMRX.ExpMeasurement.atomSites> _2 _7</NMRX.ExpMeasurement.atomSites>
      <NMRX.ExpMeasurement.expSteps> _12</NMRX.ExpMeasurement.expSteps>
      <NMRX.ExpMeasurement.refExpDimRefs> _16 _17</NMRX.ExpMeasurement.refExpDimRefs>
    </NMRX.ExpMeasurement>
    <NMRX.ExpMeasurement _ID="_9" serial="3">
      <NMRX.ExpMeasurement.measurementType>
        <NMRX.ExpMeasurementType>Shift</NMRX.ExpMeasurementType>
      </NMRX.ExpMeasurement.measurementType>
      <NMRX.ExpMeasurement.atomSites> _8</NMRX.ExpMeasurement.atomSites>
      <NMRX.ExpMeasurement.expSteps> _14</NMRX.ExpMeasurement.expSteps>
      <NMRX.ExpMeasurement.refExpDimRefs> _18 _19</NMRX.ExpMeasurement.refExpDimRefs>
    </NMRX.ExpMeasurement>
  </NMRX.NmrExpPrototype.expMeasurements>
  <NMRX.NmrExpPrototype.refExperiments>
    <NMRX.RefExperiment _ID="_20" serial="3">
      <NMRX.RefExperiment.name>
        <IMPL.Line>C[DQ(CC)]_C.through-space</IMPL.Line>
      </NMRX.RefExperiment.name>
      <NMRX.RefExperiment.synonym>
        <IMPL.Line>13C DQ-SQ-SQ</IMPL.Line>
      </NMRX.RefExperiment.synonym>
      <NMRX.RefExperiment.refExpDims>
        <NMRX.RefExpDim _ID="_21" dim="1">
          <NMRX.RefExpDim.refExpDimRefs>
            <NMRX.RefExpDimRef _ID="_19" serial="1">
              <NMRX.RefExpDimRef.validScalingFactors> 1.0</NMRX.RefExpDimRef.validScalingFactors>
            </NMRX.RefExpDimRef>
          </NMRX.RefExpDim.refExpDimRefs>
        </NMRX.RefExpDim>
        <NMRX.RefExpDim _ID="_22" dim="2">
          <NMRX.RefExpDim.refExpDimRefs>
            <NMRX.RefExpDimRef _ID="_15" serial="1">
              <NMRX.RefExpDimRef.validScalingFactors> 1.0</NMRX.RefExpDimRef.validScalingFactors>
            </NMRX.RefExpDimRef>
          </NMRX.RefExpDim.refExpDimRefs>
        </NMRX.RefExpDim>
        <NMRX.RefExpDim _ID="_23" dim="3">
          <NMRX.RefExpDim.refExpDimRefs>
            <NMRX.RefExpDimRef _ID="_17" serial="1">
              <NMRX.RefExpDimRef.validScalingFactors> 1.0</NMRX.RefExpDimRef.validScalingFactors>
            </NMRX.RefExpDimRef>
          </NMRX.RefExpDim.refExpDimRefs>
        </NMRX.RefExpDim>
      </NMRX.RefExperiment.refExpDims>
    </NMRX.RefExperiment>
    <NMRX.RefExperiment _ID="_24" serial="4">
      <NMRX.RefExperiment.name>
        <IMPL.Line>c[DQ(CC)]_C.through-space</IMPL.Line>
      </NMRX.RefExperiment.name>
      <NMRX.RefExperiment.synonym>
        <IMPL.Line>13C DQ-SQ-SQ</IMPL.Line>
      </NMRX.RefExperiment.synonym>
      <NMRX.RefExperiment.refExpDims>
        <NMRX.RefExpDim _ID="_25" dim="1">
          <NMRX.RefExpDim.refExpDimRefs>
            <NMRX.RefExpDimRef _ID="_18" serial="1">
              <NMRX.RefExpDimRef.validScalingFactors> 1.0</NMRX.RefExpDimRef.validScalingFactors>
            </NMRX.RefExpDimRef>
          </NMRX.RefExpDim.refExpDimRefs>
        </NMRX.RefExpDim>
        <NMRX.RefExpDim _ID="_26" dim="2">
          <NMRX.RefExpDim.refExpDimRefs>
            <NMRX.RefExpDimRef _ID="_16" serial="1">
              <NMRX.RefExpDimRef.validScalingFactors> 1.0</NMRX.RefExpDimRef.validScalingFactors>
            </NMRX.RefExpDimRef>
          </NMRX.RefExpDim.refExpDimRefs>
        </NMRX.RefExpDim>
      </NMRX.RefExperiment.refExpDims>
    </NMRX.RefExperiment>
  </NMRX.NmrExpPrototype.refExperiments>
</NMRX.NmrExpPrototype>

</_StorageUnit>
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