##TITLE=$$ Begin of the data block
##JCAMP-DX=5.00 $$ ACD/SpecManager v 12.01
##DATA TYPE=MASS SPECTRUM
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##DATE=10/12/14
##TIME=07:10:12
##.IONIZATION MODE=API-
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##SCAN_NUMBER=1
##RETENTION_TIME=1.601000
##TIC=36048.000000
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##SCAN_NUMBER=4
##RETENTION_TIME=12.553000
##TIC=50448.000000
##NPOINTS=2131
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##TIC=55716.000000
##NPOINTS=2463
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##SCAN_NUMBER=18
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##TIC=45452.000000
##NPOINTS=1883
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##SCAN_NUMBER=35
##RETENTION_TIME=125.737000
##TIC=61625.000000
##NPOINTS=2997
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##SCAN_NUMBER=36
##RETENTION_TIME=129.389999
##TIC=92707.000000
##NPOINTS=4061
##XYDATA=(XY..XY)
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##SCAN_NUMBER=37
##RETENTION_TIME=133.046005
##TIC=94502.000000
##NPOINTS=3946
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##SCAN_NUMBER=40
##RETENTION_TIME=144.013000
##TIC=63049.000000
##NPOINTS=3076
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##TIC=49883.000000
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##SCAN_NUMBER=47
##RETENTION_TIME=169.569000
##TIC=55647.000000
##NPOINTS=2489
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##TIC=64669.000000
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##SCAN_NUMBER=49
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772.059692382812, 476.190472 773.364135742188, 476.190472 775.528259277344, 476.190472
776.325012207031, 476.190472 778.293701171875, 476.190472 778.730163574219, 476.190472
781.151550292969, 476.190472 783.226440429688, 714.285707 784.39013671875, 476.190472
786.193603515625, 476.190472 786.607177734375, 476.190472 786.93310546875, 476.190472
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797.499633789063, 476.190472 801.429626464844, 476.190472 801.55615234375, 476.190472
805.077575683594, 476.190472 805.622924804688, 476.190472 809.382141113281, 476.190472
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843.764526367188, 476.190472 848.41845703125, 476.190472 851.79345703125, 476.190472
858.288452148438, 476.190472 861.473083496094, 476.190472 877.41845703125, 476.190472
##SCAN_NUMBER=52
##RETENTION_TIME=187.845993
##TIC=45765.000000
##NPOINTS=1779
##XYDATA=(XY..XY)
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##TIC=51132.000000
##NPOINTS=2007
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##TIC=56266.000000
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##SCAN_NUMBER=69
##RETENTION_TIME=249.910995
##TIC=53699.000000
##NPOINTS=2174
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##SCAN_NUMBER=75
##RETENTION_TIME=269.782990
##TIC=48001.000000
##NPOINTS=1922
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##TIC=45765.000000
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##SCAN_NUMBER=78
##RETENTION_TIME=280.731995
##TIC=49435.000000
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##TIC=44881.000000
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##SCAN_NUMBER=86
##RETENTION_TIME=309.925995
##TIC=48955.000000
##NPOINTS=1948
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##SCAN_NUMBER=87
##RETENTION_TIME=313.574005
##TIC=44083.000000
##NPOINTS=1594
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##TIC=46563.000000
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##SCAN_NUMBER=90
##RETENTION_TIME=324.522003
##TIC=46090.000000
##NPOINTS=1736
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##SCAN_NUMBER=91
##RETENTION_TIME=328.170013
##TIC=47448.000000
##NPOINTS=1816
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##SCAN_NUMBER=96
##RETENTION_TIME=346.411987
##TIC=43672.000000
##NPOINTS=1615
##XYDATA=(XY..XY)
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##SCAN_NUMBER=97
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##TIC=41720.000000
##NPOINTS=1449
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##SCAN_NUMBER=98
##RETENTION_TIME=353.708008
##TIC=46446.000000
##NPOINTS=1719
##XYDATA=(XY..XY)
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##RETENTION_TIME=357.356995
##TIC=44313.000000
##NPOINTS=1679
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##SCAN_NUMBER=100
##RETENTION_TIME=361.006989
##TIC=48252.000000
##NPOINTS=1753
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##SCAN_NUMBER=106
##RETENTION_TIME=382.902008
##TIC=48012.000000
##NPOINTS=1883
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##SCAN_NUMBER=108
##RETENTION_TIME=390.199005
##TIC=39518.000000
##NPOINTS=1356
##XYDATA=(XY..XY)
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##SCAN_NUMBER=109
##RETENTION_TIME=393.846008
##TIC=40548.000000
##NPOINTS=1399
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##TIC=38418.000000
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##TIC=38993.000000
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##TIC=41123.000000
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##SCAN_NUMBER=119
##RETENTION_TIME=424.242004
##TIC=38968.000000
##NPOINTS=1307
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##TIC=40308.000000
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##SCAN_NUMBER=122
##RETENTION_TIME=433.158997
##TIC=40046.000000
##NPOINTS=1337
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##SCAN_NUMBER=123
##RETENTION_TIME=436.806000
##TIC=38808.000000
##NPOINTS=1274
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##TIC=40981.000000
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##SCAN_NUMBER=130
##RETENTION_TIME=454.239014
##TIC=39809.000000
##NPOINTS=1316
##XYDATA=(XY..XY)
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##SCAN_NUMBER=131
##RETENTION_TIME=455.862000
##TIC=38848.000000
##NPOINTS=1223
##XYDATA=(XY..XY)
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##SCAN_NUMBER=132
##RETENTION_TIME=459.509003
##TIC=38349.000000
##NPOINTS=1246
##XYDATA=(XY..XY)
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##SCAN_NUMBER=137
##RETENTION_TIME=473.694000
##TIC=38906.000000
##NPOINTS=1265
##XYDATA=(XY..XY)
208.91911315918, 1818.181801 212.063888549805, 1818.181801 212.070388793945, 2727.272797
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##SCAN_NUMBER=142
##RETENTION_TIME=491.928986
##TIC=39845.000000
##NPOINTS=1302
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##TIC=41870.000000
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##SCAN_NUMBER=158
##RETENTION_TIME=546.237976
##TIC=40235.000000
##NPOINTS=1391
##XYDATA=(XY..XY)
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##SCAN_NUMBER=160
##RETENTION_TIME=549.484009
##TIC=41699.000000
##NPOINTS=1416
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##SCAN_NUMBER=161
##RETENTION_TIME=553.132019
##TIC=40351.000000
##NPOINTS=1363
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##SCAN_NUMBER=162
##RETENTION_TIME=556.778992
##TIC=41560.000000
##NPOINTS=1437
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##SCAN_NUMBER=163
##RETENTION_TIME=560.427979
##TIC=42507.000000
##NPOINTS=1487
##XYDATA=(XY..XY)
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##SCAN_NUMBER=164
##RETENTION_TIME=564.075012
##TIC=40523.000000
##NPOINTS=1360
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##SCAN_NUMBER=165
##RETENTION_TIME=565.697998
##TIC=42784.000000
##NPOINTS=1484
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##SCAN_NUMBER=167
##RETENTION_TIME=572.994019
##TIC=40712.000000
##NPOINTS=1355
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##RETENTION_TIME=576.638977
##TIC=41134.000000
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##RETENTION_TIME=583.932983
##TIC=42591.000000
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##SCAN_NUMBER=176
##RETENTION_TIME=605.822998
##TIC=39274.000000
##NPOINTS=1297
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##SCAN_NUMBER=183
##RETENTION_TIME=631.354980
##TIC=40905.000000
##NPOINTS=1370
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##TIC=48554.000000
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##SCAN_NUMBER=188
##RETENTION_TIME=649.593994
##TIC=43155.000000
##NPOINTS=1505
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##RETENTION_TIME=653.242004
##TIC=47830.000000
##NPOINTS=1733
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##SCAN_NUMBER=202
##RETENTION_TIME=700.671021
##TIC=46767.000000
##NPOINTS=1760
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##SCAN_NUMBER=203
##RETENTION_TIME=704.317993
##TIC=49457.000000
##NPOINTS=1801
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##SCAN_NUMBER=218
##RETENTION_TIME=759.046997
##TIC=45074.000000
##NPOINTS=1693
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##SCAN_NUMBER=219
##RETENTION_TIME=762.695984
##TIC=45707.000000
##NPOINTS=1711
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##TIC=42521.000000
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##RETENTION_TIME=769.992981
##TIC=42296.000000
##NPOINTS=1475
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##SCAN_NUMBER=222
##RETENTION_TIME=771.616028
##TIC=45092.000000
##NPOINTS=1631
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##TIC=41957.000000
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##SCAN_NUMBER=227
##RETENTION_TIME=785.809998
##TIC=46927.000000
##NPOINTS=1821
##XYDATA=(XY..XY)
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##SCAN_NUMBER=228
##RETENTION_TIME=789.458984
##TIC=47517.000000
##NPOINTS=1859
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##TIC=47204.000000
##NPOINTS=1837
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##SCAN_NUMBER=230
##RETENTION_TIME=796.757019
##TIC=46261.000000
##NPOINTS=1683
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##SCAN_NUMBER=231
##RETENTION_TIME=800.406006
##TIC=41731.000000
##NPOINTS=1541
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##SCAN_NUMBER=233
##RETENTION_TIME=807.702026
##TIC=46992.000000
##NPOINTS=1775
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##SCAN_NUMBER=234
##RETENTION_TIME=811.351013
##TIC=44731.000000
##NPOINTS=1669
##XYDATA=(XY..XY)
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##SCAN_NUMBER=235
##RETENTION_TIME=814.999023
##TIC=43024.000000
##NPOINTS=1510
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##SCAN_NUMBER=236
##RETENTION_TIME=818.645020
##TIC=41083.000000
##NPOINTS=1449
##XYDATA=(XY..XY)
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##SCAN_NUMBER=237
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##TIC=45008.000000
##NPOINTS=1663
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##TIC=38123.000000
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##SCAN_NUMBER=240
##RETENTION_TIME=831.210999
##TIC=41506.000000
##NPOINTS=1484
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##SCAN_NUMBER=242
##RETENTION_TIME=836.481995
##TIC=43814.000000
##NPOINTS=1541
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##SCAN_NUMBER=243
##RETENTION_TIME=840.130005
##TIC=44520.000000
##NPOINTS=1534
##XYDATA=(XY..XY)
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##SCAN_NUMBER=247
##RETENTION_TIME=854.731018
##TIC=50597.000000
##NPOINTS=1805
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##SCAN_NUMBER=251
##RETENTION_TIME=869.323975
##TIC=45077.000000
##NPOINTS=1684
##XYDATA=(XY..XY)
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##SCAN_NUMBER=252
##RETENTION_TIME=872.971985
##TIC=43355.000000
##NPOINTS=1553
##XYDATA=(XY..XY)
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##SCAN_NUMBER=255
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##TIC=41888.000000
##NPOINTS=1439
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##SCAN_NUMBER=258
##RETENTION_TIME=894.856995
##TIC=45394.000000
##NPOINTS=1667
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##SCAN_NUMBER=259
##RETENTION_TIME=898.505005
##TIC=46468.000000
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##TIC=43250.000000
##NPOINTS=1621
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##SCAN_NUMBER=265
##RETENTION_TIME=920.403992
##TIC=39146.000000
##NPOINTS=1320
##XYDATA=(XY..XY)
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##SCAN_NUMBER=266
##RETENTION_TIME=924.049988
##TIC=34049.000000
##NPOINTS=1132
##XYDATA=(XY..XY)
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##SCAN_NUMBER=268
##RETENTION_TIME=931.343994
##TIC=41553.000000
##NPOINTS=1503
##XYDATA=(XY..XY)
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##SCAN_NUMBER=269
##RETENTION_TIME=934.991028
##TIC=44200.000000
##NPOINTS=1614
##XYDATA=(XY..XY)
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##TIC=44782.000000
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##TIC=53440.000000
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##TIC=49046.000000
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##TIC=46665.000000
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##SCAN_NUMBER=284
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##TIC=45973.000000
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812.436584472656, 1428.571415 815.560546875, 1428.571415 817.974609375, 1428.571415
821.096374511719, 1428.571415 838.165588378906, 1428.571415 
##SCAN_NUMBER=291
##RETENTION_TIME=1015.267029
##TIC=45096.000000
##NPOINTS=1695
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##SCAN_NUMBER=292
##RETENTION_TIME=1018.916016
##TIC=41560.000000
##NPOINTS=1486
##XYDATA=(XY..XY)
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##SCAN_NUMBER=293
##RETENTION_TIME=1022.565002
##TIC=43861.000000
##NPOINTS=1601
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##SCAN_NUMBER=294
##RETENTION_TIME=1026.213013
##TIC=44495.000000
##NPOINTS=1621
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##SCAN_NUMBER=295
##RETENTION_TIME=1029.860962
##TIC=49275.000000
##NPOINTS=1840
##XYDATA=(XY..XY)
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##RETENTION_TIME=1044.457031
##TIC=49770.000000
##NPOINTS=1945
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##SCAN_NUMBER=300
##RETENTION_TIME=1048.108032
##TIC=46683.000000
##NPOINTS=1812
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##SCAN_NUMBER=302
##RETENTION_TIME=1055.406006
##TIC=37300.000000
##NPOINTS=1143
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##SCAN_NUMBER=304
##RETENTION_TIME=1062.699951
##TIC=45161.000000
##NPOINTS=1766
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##TIC=45489.000000
##NPOINTS=1664
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##TIC=46210.000000
##NPOINTS=1717
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##SCAN_NUMBER=324
##RETENTION_TIME=1135.682983
##TIC=38870.000000
##NPOINTS=1367
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##SCAN_NUMBER=325
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##TIC=42864.000000
##NPOINTS=1427
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##SCAN_NUMBER=330
##RETENTION_TIME=1157.569946
##TIC=42831.000000
##NPOINTS=1534
##XYDATA=(XY..XY)
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##TIC=54434.000000
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