diff test-data/Rpal_01-mzRefinement.mzML @ 7:e638f7fad66a draft

planemo upload for repository https://github.com/galaxyproteomics/tools-galaxyp/tree/master/tools/msconvert commit d595e3cfe190a61d81005f9be7c2652aa5f91292
author galaxyp
date Sat, 23 Feb 2019 06:21:27 -0500
parents ab59b1826345
children
line wrap: on
line diff
--- a/test-data/Rpal_01-mzRefinement.mzML	Tue Mar 14 16:52:39 2017 -0400
+++ b/test-data/Rpal_01-mzRefinement.mzML	Sat Feb 23 06:21:27 2019 -0500
@@ -11,7 +11,7 @@
         <cvParam cvRef="MS" accession="MS:1000580" name="MSn spectrum" value=""/>
       </fileContent>
       <sourceFileList count="1">
-        <sourceFile id="RAW1" name="Rpal_01.RAW" location="file:///C:\Users\chambem2\.vagrant\precise64\bingomics-galaxy\vagrant\export\src\tools-galaxyp-chambm\tools\msconvert\test-data">
+        <sourceFile id="RAW1" name="Rpal_01.RAW" location="file:///">
           <cvParam cvRef="MS" accession="MS:1000768" name="Thermo nativeID format" value=""/>
           <cvParam cvRef="MS" accession="MS:1000563" name="Thermo RAW format" value=""/>
           <cvParam cvRef="MS" accession="MS:1000569" name="SHA-1" value="4677b1f0c0556933ee113c7712164c37087bfb24"/>
@@ -495,13 +495,13 @@
           <precursorList count="1">
             <precursor>
               <isolationWindow>
-                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="462.15" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="462.14663886796745" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000828" name="isolation window lower offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000829" name="isolation window upper offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
               </isolationWindow>
               <selectedIonList count="1">
                 <selectedIon>
-                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="462.149322509766" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="462.14596138212283" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                   <cvParam cvRef="MS" accession="MS:1000041" name="charge state" value="1"/>
                   <cvParam cvRef="MS" accession="MS:1000042" name="peak intensity" value="15125.09765625" unitCvRef="MS" unitAccession="MS:1000131" unitName="number of detector counts"/>
                 </selectedIon>
@@ -557,13 +557,13 @@
           <precursorList count="1">
             <precursor>
               <isolationWindow>
-                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="429.09" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="429.08686113669586" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000828" name="isolation window lower offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000829" name="isolation window upper offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
               </isolationWindow>
               <selectedIonList count="1">
                 <selectedIon>
-                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="429.09" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="429.08686113669586" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                   <cvParam cvRef="MS" accession="MS:1000042" name="peak intensity" value="11968.4345703125" unitCvRef="MS" unitAccession="MS:1000131" unitName="number of detector counts"/>
                 </selectedIon>
               </selectedIonList>
@@ -618,13 +618,13 @@
           <precursorList count="1">
             <precursor>
               <isolationWindow>
-                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="413.27" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="413.26697686257501" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000828" name="isolation window lower offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000829" name="isolation window upper offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
               </isolationWindow>
               <selectedIonList count="1">
                 <selectedIon>
-                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="413.268890380859" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="413.26586725155101" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                   <cvParam cvRef="MS" accession="MS:1000041" name="charge state" value="1"/>
                   <cvParam cvRef="MS" accession="MS:1000042" name="peak intensity" value="9885.3359375" unitCvRef="MS" unitAccession="MS:1000131" unitName="number of detector counts"/>
                 </selectedIon>
@@ -680,13 +680,13 @@
           <precursorList count="1">
             <precursor>
               <isolationWindow>
-                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="503.11" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="503.10641932066449" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000828" name="isolation window lower offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000829" name="isolation window upper offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
               </isolationWindow>
               <selectedIonList count="1">
                 <selectedIon>
-                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="503.110382080078" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="503.10680139850859" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                   <cvParam cvRef="MS" accession="MS:1000041" name="charge state" value="1"/>
                   <cvParam cvRef="MS" accession="MS:1000042" name="peak intensity" value="4688.15380859375" unitCvRef="MS" unitAccession="MS:1000131" unitName="number of detector counts"/>
                 </selectedIon>
@@ -2584,13 +2584,13 @@
           <precursorList count="1">
             <precursor>
               <isolationWindow>
-                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="1027.27" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="1027.2607056595309" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000828" name="isolation window lower offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000829" name="isolation window upper offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
               </isolationWindow>
               <selectedIonList count="1">
                 <selectedIon>
-                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="1027.27" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="1027.2607056595309" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                   <cvParam cvRef="MS" accession="MS:1000042" name="peak intensity" value="2317.82177734375" unitCvRef="MS" unitAccession="MS:1000131" unitName="number of detector counts"/>
                 </selectedIon>
               </selectedIonList>
@@ -2706,13 +2706,13 @@
           <precursorList count="1">
             <precursor>
               <isolationWindow>
-                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="741.2" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="741.19392788925313" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000828" name="isolation window lower offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000829" name="isolation window upper offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
               </isolationWindow>
               <selectedIonList count="1">
                 <selectedIon>
-                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="741.2" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="741.19392788925313" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                   <cvParam cvRef="MS" accession="MS:1000042" name="peak intensity" value="1801.882934570313" unitCvRef="MS" unitAccession="MS:1000131" unitName="number of detector counts"/>
                 </selectedIon>
               </selectedIonList>
@@ -2767,13 +2767,13 @@
           <precursorList count="1">
             <precursor>
               <isolationWindow>
-                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="698.11" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                <cvParam cvRef="MS" accession="MS:1000827" name="isolation window target m/z" value="698.10447855842551" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000828" name="isolation window lower offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                 <cvParam cvRef="MS" accession="MS:1000829" name="isolation window upper offset" value="2.5" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
               </isolationWindow>
               <selectedIonList count="1">
                 <selectedIon>
-                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="698.11" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
+                  <cvParam cvRef="MS" accession="MS:1000744" name="selected ion m/z" value="698.10447855842551" unitCvRef="MS" unitAccession="MS:1000040" unitName="m/z"/>
                   <cvParam cvRef="MS" accession="MS:1000042" name="peak intensity" value="1764.214965820313" unitCvRef="MS" unitAccession="MS:1000131" unitName="number of detector counts"/>
                 </selectedIon>
               </selectedIonList>
@@ -6016,113 +6016,113 @@
   </mzML>
   <indexList count="2">
     <index name="spectrum">
-      <offset idRef="controllerType=0 controllerNumber=1 scan=1">4548</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=2">9145</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=3">14766</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=4">20425</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=5">25998</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=6">31635</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=7">37170</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=8">42149</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=9">47708</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=10">53269</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=11">58818</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=12">64365</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=13">69941</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=14">75253</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=15">80808</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=16">86433</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=17">91998</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=18">97664</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=19">103161</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=20">108145</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=21">113745</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=22">119205</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=23">124720</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=24">130258</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=25">135712</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=26">140943</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=27">146558</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=28">152168</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=29">157790</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=30">163384</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=31">168988</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=32">174209</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=33">179745</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=34">185325</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=35">190800</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=36">196273</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=37">201808</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=38">207326</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=39">212975</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=40">218544</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=41">224121</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=42">229688</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=43">235223</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=44">240581</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=45">245983</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=46">251437</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=47">256941</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=48">262401</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=49">267893</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=50">273173</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=51">278816</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=52">284355</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=53">289916</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=54">295556</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=55">301039</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=56">306549</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=57">312102</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=58">317567</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=59">323034</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=60">328552</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=61">334066</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=62">339784</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=63">345237</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=64">350714</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=65">356183</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=66">361667</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=67">367143</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=68">372790</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=69">378442</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=70">383935</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=71">389375</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=72">394943</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=73">400444</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=74">405675</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=75">411429</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=76">417080</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=77">422714</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=78">428297</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=79">433909</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=80">439225</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=81">444950</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=82">450556</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=83">456237</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=84">462063</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=85">467770</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=86">475681</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=87">481511</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=88">487262</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=89">492992</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=90">498686</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=91">504313</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=92">510475</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=93">516311</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=94">522214</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=95">528055</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=96">533685</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=97">539368</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=98">545135</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=99">550804</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=100">556406</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=101">562116</offset>
-      <offset idRef="controllerType=0 controllerNumber=1 scan=102">567769</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=1">4429</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=2">9026</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=3">14647</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=4">20306</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=5">25879</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=6">31516</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=7">37051</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=8">42030</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=9">47603</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=10">53188</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=11">58751</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=12">64312</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=13">69888</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=14">75200</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=15">80755</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=16">86380</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=17">91945</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=18">97611</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=19">103108</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=20">108092</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=21">113692</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=22">119152</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=23">124667</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=24">130205</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=25">135659</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=26">140890</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=27">146505</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=28">152115</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=29">157737</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=30">163331</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=31">168935</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=32">174156</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=33">179692</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=34">185272</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=35">190747</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=36">196220</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=37">201755</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=38">207273</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=39">212922</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=40">218491</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=41">224068</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=42">229635</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=43">235170</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=44">240528</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=45">245952</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=46">251406</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=47">256936</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=48">262420</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=49">267912</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=50">273192</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=51">278835</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=52">284374</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=53">289935</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=54">295575</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=55">301058</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=56">306568</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=57">312121</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=58">317586</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=59">323053</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=60">328571</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=61">334085</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=62">339803</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=63">345256</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=64">350733</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=65">356202</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=66">361686</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=67">367162</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=68">372809</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=69">378461</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=70">383954</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=71">389394</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=72">394962</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=73">400463</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=74">405694</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=75">411448</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=76">417099</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=77">422733</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=78">428316</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=79">433928</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=80">439244</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=81">444969</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=82">450575</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=83">456256</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=84">462082</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=85">467789</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=86">475700</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=87">481530</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=88">487281</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=89">493011</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=90">498705</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=91">504332</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=92">510494</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=93">516330</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=94">522233</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=95">528074</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=96">533704</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=97">539387</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=98">545154</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=99">550823</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=100">556425</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=101">562135</offset>
+      <offset idRef="controllerType=0 controllerNumber=1 scan=102">567788</offset>
     </index>
     <index name="chromatogram">
-      <offset idRef="TIC">573506</offset>
+      <offset idRef="TIC">573525</offset>
     </index>
   </indexList>
-  <indexListOffset>611906</indexListOffset>
-  <fileChecksum>c21cb957af41a486a037923b76bb07f9f883c3b6</fileChecksum>
+  <indexListOffset>611925</indexListOffset>
+  <fileChecksum>f6cdf7e6c379dfe7b91b25a6c61099502d6fba3b</fileChecksum>
 </indexedmzML>