view test-data/output.msp @ 3:89b026d67e9f draft default tip

planemo upload for repository https://github.com/RECETOX/galaxytools/tree/master/tools/qcxms commit 5a088c3d758c9a1dbd119dad55ecffa173139a40

NAME: Lindane
Num Peaks: 49
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96.956708 0.668804095247536257
96.959630 0.006270038392945652
97.950404 18.872816291174281389
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98.953758 0.408597509163542982
98.956680 0.006270038392945652
99.947454 3.027383551460257394
99.957112 0.001045006398824275
100.950808 0.060610371892150218
100.953730 0.001045006398824275
112.007977 100.000000000000000000
113.011331 6.469344248109893947
113.014253 0.062015503068284489
114.005027 31.968992563911168503
114.014685 0.191684279973595856
114.017607 0.002818886409876120
115.008381 2.170542578675819456
115.011303 0.016913318459256720
116.011735 0.056377728197522396
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117.015089 0.002818886409876120
121.969004 48.616737474503565863
122.972358 2.314913873279450307
122.975280 0.028382084687048212
123.966054 31.214972837163390551
123.975712 0.030155965625322630
123.978634 0.003547760585881026
124.969408 1.333958011267293520
124.972330 0.010643281757643079
125.963104 4.931387222118633673
125.972762 0.017738802929405131
126.966458 0.184483555628484647
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127.969812 0.001773880292940513
147.984654 75.667375851606607284
148.988008 4.978153862789445938
148.990930 0.042283303452986920
149.981704 48.524317372305198148
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150.985058 3.038759966527995626
150.987980 0.036645528018447289
151.978754 7.912614881227955976
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153.985462 0.019732207867858554