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Diffstat (limited to 'sci-libs/ccpn-data/files/312+ccpn_rhf22_2013-10-02-16-17-30-923_00001.xml')
-rw-r--r-- | sci-libs/ccpn-data/files/312+ccpn_rhf22_2013-10-02-16-17-30-923_00001.xml | 140 |
1 files changed, 140 insertions, 0 deletions
diff --git a/sci-libs/ccpn-data/files/312+ccpn_rhf22_2013-10-02-16-17-30-923_00001.xml b/sci-libs/ccpn-data/files/312+ccpn_rhf22_2013-10-02-16-17-30-923_00001.xml new file mode 100644 index 000000000000..60e8041c99da --- /dev/null +++ b/sci-libs/ccpn-data/files/312+ccpn_rhf22_2013-10-02-16-17-30-923_00001.xml @@ -0,0 +1,140 @@ +<?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> +<!--End of Memops Data--> |