##TITLE=$$ Begin of the data block
##JCAMP-DX=5.00 $$ ACD/SpecManager v 12.01
##TIC=19296532.000000
##DATA TYPE=MASS SPECTRUM
##DATA CLASS=PEAK TABLE
##ORIGIN=
##OWNER=
##DATE=12/ 9/ 9
##TIME=16:48:45
##.IONIZATION MODE=ESI+
##NPOINTS=337
##FIRSTX=54.79999924
##LASTX=435.29998779
##MAXX=10000.00000000
##MINX=42.37288284
##MAXY=0.00000000
##MINY=0.00000000
##XFACTOR=1.0000000000
##YFACTOR=1.000000000000000
##FIRSTY=42.37288284
##XUNITS=M/Z
##YUNITS=RELATIVE ABUNDANCE
##PEAK TABLE=(XY..XY)
54.799999237061, 42.372882 55, 42.372882 56.799999237061, 84.745765 56.900001525879, 84.745765
57, 42.372882 57.099998474121, 127.118647 57.200000762939, 84.745765 57.299999237061, 84.745765
60.799999237061, 42.372882 62.599998474121, 42.372882 68.800003051758, 42.372882
68.900001525879, 42.372882 69, 84.745765 69.099998474121, 127.118647 69.300003051758, 211.8644
69.5, 127.118647 70.400001525879, 84.745765 70.599998474121, 974.576283
70.699996948242, 1525.423717 70.800003051758, 1694.915199 70.900001525879, 3347.457886
71, 4279.660797 71.099998474121, 4237.287903 71.199996948242, 3855.932236
71.300003051758, 2754.237366 71.400001525879, 1652.542305 71.5, 84.745765
73, 42.372882 73.099998474121, 84.745765 73.199996948242, 42.372882 74.400001525879, 42.372882
74.599998474121, 42.372882 74.699996948242, 42.372882 74.800003051758, 42.372882
74.900001525879, 42.372882 75, 84.745765 75.099998474121, 254.237294 75.199996948242, 169.491529
75.300003051758, 84.745765 81, 42.372882 82.5, 42.372882 82.699996948242, 127.118647
82.800003051758, 127.118647 82.900001525879, 42.372882 83.099998474121, 169.491529
83.199996948242, 42.372882 83.400001525879, 42.372882 84.099998474121, 42.372882
84.300003051758, 84.745765 84.400001525879, 381.355929 84.5, 1016.949177
84.599998474121, 3601.69487 84.699996948242, 1694.915199 84.800003051758, 5508.474731
84.900001525879, 6694.915771 85, 5042.372894 85.099998474121, 6398.30513
85.199996948242, 4364.406586 85.300003051758, 2457.627106 85.400001525879, 1228.813553
85.5, 254.237294 85.599998474121, 42.372882 86.5, 42.372882 86.699996948242, 169.491529
86.900001525879, 127.118647 87, 296.610165 87.099998474121, 169.491529
87.199996948242, 169.491529 87.300003051758, 84.745765 87.5, 84.745765
89.400001525879, 84.745765 91.199996948242, 84.745765 91.300003051758, 42.372882
96.699996948242, 42.372882 96.800003051758, 42.372882 96.900001525879, 84.745765
97.099998474121, 42.372882 97.300003051758, 84.745765 98.599998474121, 84.745765
98.699996948242, 84.745765 98.800003051758, 127.118647 99.099998474121, 84.745765
101.199996948242, 42.372882 101.400001525879, 84.745765 102.699996948242, 296.610165
102.800003051758, 296.610165 102.900001525879, 127.118647 103, 211.8644
103.099998474121, 211.8644 103.199996948242, 127.118647 106.800003051758, 42.372882
110.800003051758, 254.237294 111, 42.372882 111.099998474121, 84.745765
111.199996948242, 84.745765 111.400001525879, 84.745765 111.5, 42.372882
119.300003051758, 42.372882 122.900001525879, 84.745765 126.699996948242, 42.372882
127, 42.372882 127.199996948242, 42.372882 128.5, 169.491529 128.600006103516, 296.610165
128.699996948242, 635.593224 128.800003051758, 1186.440659 128.899993896484, 1355.932236
129, 1271.186447 129.100006103516, 1355.932236 129.199996948242, 1016.949177
129.300003051758, 635.593224 129.399993896484, 127.118647 144.800003051758, 42.372882
144.899993896484, 84.745765 145, 42.372882 145.300003051758, 84.745765
146.699996948242, 169.491529 146.899993896484, 550.847483 147, 550.847483
147.100006103516, 720.339012 147.199996948242, 423.7288 147.300003051758, 211.8644
147.399993896484, 296.610165 147.5, 127.118647 147.600006103516, 42.372882
149.5, 42.372882 150.899993896484, 42.372882 151.300003051758, 42.372882
152.5, 211.8644 152.600006103516, 169.491529 152.699996948242, 1059.321976
152.800003051758, 720.339012 152.899993896484, 1186.440659 153, 1440.678024
153.100006103516, 720.339012 153.199996948242, 1694.915199 153.300003051758, 974.576283
153.399993896484, 84.745765 163, 42.372882 164.800003051758, 42.372882
164.899993896484, 84.745765 165, 42.372882 165.100006103516, 42.372882
165.199996948242, 42.372882 171.399993896484, 42.372882 176.899993896484, 84.745765
177, 42.372882 178.600006103516, 84.745765 178.800003051758, 84.745765
178.899993896484, 42.372882 182.899993896484, 42.372882 190.800003051758, 42.372882
190.899993896484, 42.372882 191.100006103516, 84.745765 191.300003051758, 42.372882
194.600006103516, 381.355929 194.699996948242, 254.237294 194.800003051758, 635.593224
194.899993896484, 1059.321976 195, 1016.949177 195.100006103516, 805.084705
195.199996948242, 677.966118 195.300003051758, 42.372882 203.199996948242, 42.372882
203.399993896484, 42.372882 203.5, 42.372882 213, 42.372882 217.100006103516, 84.745765
218.300003051758, 42.372882 218.399993896484, 211.8644 218.600006103516, 296.610165
218.699996948242, 338.983059 218.800003051758, 466.101694 218.899993896484, 296.610165
219, 550.847483 219.100006103516, 338.983059 219.199996948242, 296.610165
219.300003051758, 211.8644 219.399993896484, 127.118647 219.600006103516, 127.118647
221.399993896484, 42.372882 224.699996948242, 42.372882 230.800003051758, 84.745765
230.899993896484, 42.372882 235.199996948242, 42.372882 236.899993896484, 42.372882
237, 42.372882 237.199996948242, 84.745765 244.699996948242, 127.118647
244.800003051758, 42.372882 244.899993896484, 127.118647 245, 169.491529
245.100006103516, 296.610165 245.199996948242, 254.237294 245.300003051758, 84.745765
245.399993896484, 169.491529 249.100006103516, 42.372882 249.399993896484, 42.372882
257.100006103516, 42.372882 260.799987792969, 42.372882 260.899993896484, 42.372882
261, 42.372882 261.200012207031, 84.745765 262.5, 127.118647 262.600006103516, 127.118647
262.700012207031, 338.983059 262.799987792969, 550.847483 262.899993896484, 508.474588
263, 805.084705 263.100006103516, 296.610165 263.200012207031, 932.203388
263.299987792969, 423.7288 263.399993896484, 169.491529 263.5, 42.372882
269.200012207031, 84.745765 272.100006103516, 42.372882 272.200012207031, 42.372882
272.399993896484, 127.118647 272.5, 169.491529 272.600006103516, 762.711859
272.700012207031, 4364.406586 272.799987792969, 6101.69487 272.899993896484, 7415.254211
273, 9322.034454 273.100006103516, 6779.660797 273.200012207031, 10000
273.299987792969, 8347.457123 273.399993896484, 2372.881317 273.5, 677.966118
273.600006103516, 42.372882 273.700012207031, 211.8644 279.200012207031, 42.372882
280.700012207031, 84.745765 280.799987792969, 84.745765 280.899993896484, 42.372882
281, 127.118647 281.100006103516, 42.372882 281.200012207031, 127.118647
281.299987792969, 211.8644 281.399993896484, 42.372882 281.5, 127.118647
281.600006103516, 42.372882 284.5, 84.745765 284.700012207031, 169.491529
284.799987792969, 254.237294 284.899993896484, 84.745765 285, 169.491529
285.100006103516, 42.372882 285.200012207031, 84.745765 285.299987792969, 381.355929
285.399993896484, 84.745765 294.899993896484, 42.372882 296.600006103516, 42.372882
296.700012207031, 42.372882 296.799987792969, 169.491529 296.899993896484, 127.118647
297, 296.610165 297.100006103516, 42.372882 297.200012207031, 169.491529
297.299987792969, 211.8644 297.399993896484, 84.745765 297.600006103516, 42.372882
298.899993896484, 42.372882 299.5, 42.372882 305.100006103516, 42.372882
309.399993896484, 42.372882 309.5, 84.745765 309.799987792969, 42.372882
311, 42.372882 311.100006103516, 42.372882 313.100006103516, 42.372882
313.299987792969, 42.372882 314.600006103516, 42.372882 314.799987792969, 84.745765
314.899993896484, 42.372882 315, 169.491529 315.100006103516, 296.610165
315.200012207031, 127.118647 315.299987792969, 42.372882 315.399993896484, 169.491529
321.299987792969, 84.745765 322.600006103516, 42.372882 322.899993896484, 127.118647
323.100006103516, 84.745765 323.200012207031, 84.745765 329.200012207031, 42.372882
334.899993896484, 42.372882 335.100006103516, 42.372882 336.399993896484, 42.372882
337, 42.372882 338.600006103516, 84.745765 338.799987792969, 84.745765
338.899993896484, 169.491529 339, 84.745765 339.100006103516, 254.237294
339.299987792969, 42.372882 339.399993896484, 211.8644 339.5, 42.372882
341.200012207031, 42.372882 344.799987792969, 42.372882 348.600006103516, 42.372882
350.899993896484, 42.372882 351, 42.372882 351.200012207031, 42.372882
351.299987792969, 42.372882 351.399993896484, 42.372882 355.200012207031, 42.372882
362.899993896484, 42.372882 364.700012207031, 42.372882 364.899993896484, 211.8644
365, 127.118647 365.100006103516, 211.8644 365.200012207031, 169.491529
365.299987792969, 169.491529 365.399993896484, 42.372882 365.5, 42.372882
369.100006103516, 42.372882 381.299987792969, 42.372882 381.600006103516, 42.372882
382.799987792969, 84.745765 382.899993896484, 42.372882 383, 127.118647
383.200012207031, 84.745765 383.299987792969, 42.372882 383.399993896484, 84.745765
394.600006103516, 42.372882 398.799987792969, 42.372882 401, 42.372882
401.5, 42.372882 405.200012207031, 42.372882 406.5, 42.372882 407, 42.372882
417.399993896484, 42.372882 418.899993896484, 42.372882 419.299987792969, 42.372882
419.399993896484, 42.372882 435.299987792969, 42.372882 
##END=$$ End of the data block
