##TITLE=$$ Begin of the data block
##JCAMP-DX=5.00 $$ ACD/SpecManager v 12.01
##TIC=2708.000000
##DATA TYPE=MASS SPECTRUM
##DATA CLASS=PEAK TABLE
##ORIGIN=
##OWNER=
##DATE=12/ 1/17
##TIME=23:50:25
##.IONIZATION MODE=ESI-
##NPOINTS=334
##FIRSTX=131.07127380
##LASTX=938.81268311
##MAXX=10000.00000000
##MINX=80.64516449
##MAXY=0.00000000
##MINY=0.00000000
##XFACTOR=1.0000000000
##YFACTOR=1.000000000000000
##FIRSTY=80.64516449
##XUNITS=M/Z
##YUNITS=RELATIVE ABUNDANCE
##PEAK TABLE=(XY..XY)
131.071273803711, 80.645162 160.993835449219, 80.645162 161.005172729492, 161.290324
164.007446289062, 80.645162 178.776947021484, 80.645162 179.010055541992, 80.645162
179.728286743164, 80.645162 206.735046386719, 80.645162 208.87385559082, 80.645162
212.584625244141, 80.645162 223.011093139648, 80.645162 251.971435546875, 80.645162
298.513458251953, 80.645162 299.378875732422, 80.645162 305.065826416016, 80.645162
306.730682373047, 80.645162 308.172515869141, 80.645162 309.491912841797, 80.645162
309.664916992188, 80.645162 309.672760009766, 80.645162 314.647125244141, 80.645162
315.075317382813, 80.645162 315.09912109375, 80.645162 315.107055664063, 80.645162
317.037719726562, 80.645162 317.993316650391, 80.645162 322.648345947266, 80.645162
324.746887207031, 80.645162 327.353363037109, 80.645162 329.921569824219, 80.645162
331.880737304687, 80.645162 335.841094970703, 80.645162 357.345520019531, 80.645162
367.092498779297, 80.645162 367.109619140625, 80.645162 373.352416992187, 161.290324
393.832000732422, 80.645162 394.053771972656, 80.645162 394.941375732422, 80.645162
404.27685546875, 80.645162 405.382843017578, 80.645162 406.057983398437, 80.645162
406.130004882812, 80.645162 407.049163818359, 80.645162 407.094268798828, 80.645162
407.445983886719, 80.645162 408.104766845703, 80.645162 408.158935546875, 80.645162
408.285369873047, 80.645162 408.727935791016, 80.645162 408.755065917969, 80.645162
409.080383300781, 80.645162 409.333526611328, 80.645162 409.966674804687, 80.645162
417.246673583984, 80.645162 417.374481201172, 80.645162 418.562225341797, 80.645162
424.535491943359, 80.645162 427.422515869141, 80.645162 436.132873535156, 80.645162
438.600250244141, 80.645162 442.455383300781, 80.645162 443.104248046875, 161.290324
443.170104980469, 80.645162 444.478759765625, 80.645162 447.300354003906, 80.645162
448.567779541016, 80.645162 453.265228271484, 80.645162 458.896148681641, 80.645162
458.934448242188, 80.645162 458.953582763672, 80.645162 459.049346923828, 80.645162
459.279174804687, 80.645162 459.317474365234, 80.645162 459.394104003906, 161.290324
459.556945800781, 80.645162 459.710235595703, 80.645162 459.892333984375, 80.645162
459.997741699219, 80.645162 460.026489257813, 161.290324 460.084014892578, 80.645162
460.112762451172, 80.645162 460.151123046875, 80.645162 460.179870605469, 80.645162
460.457946777344, 161.290324 460.467529296875, 161.290324 460.477111816406, 241.935492
460.496307373047, 80.645162 460.505889892578, 241.935492 460.525054931641, 161.290324
460.53466796875, 241.935492 460.544250488281, 80.645162 460.553833007812, 241.935492
460.563446044922, 241.935492 460.573028564453, 161.290324 460.592193603516, 161.290324
460.601806640625, 241.935492 460.611389160156, 80.645162 460.630554199219, 80.645162
460.659332275391, 80.645162 460.784057617188, 80.645162 460.841613769531, 80.645162
460.899169921875, 80.645162 460.9951171875, 80.645162 461.033508300781, 80.645162
461.052703857422, 241.935492 461.062286376953, 241.935492 461.071868896484, 887.096786
461.081481933594, 1612.903214 461.091064453125, 2338.709641 461.100677490234, 2500
461.110260009766, 2580.64518 461.119873046875, 2338.709641 461.129455566406, 2258.064461
461.139068603516, 2258.064461 461.148651123047, 2338.709641 461.158264160156, 2983.870888
461.167846679688, 2338.709641 461.177459716797, 2338.709641 461.187042236328, 2500
461.196655273438, 2016.129112 461.206237792969, 1532.258034 461.215850830078, 887.096786
461.225433349609, 564.516115 461.235046386719, 806.451607 461.24462890625, 80.645162
461.254241943359, 322.580647 461.263824462891, 80.645162 461.2734375, 80.645162
461.302215576172, 80.645162 461.475006103516, 80.645162 461.484619140625, 80.645162
461.494201660156, 80.645162 461.503814697266, 322.580647 461.551818847656, 80.645162
461.561401367188, 241.935492 461.571014404297, 80.645162 461.590209960938, 80.645162
461.599822998047, 80.645162 461.820678710937, 80.645162 461.993560791016, 80.645162
462.070404052734, 241.935492 462.080017089844, 322.580647 462.089630126953, 483.870983
462.099243164062, 483.870983 462.108856201172, 645.161295 462.118438720703, 1129.03223
462.128051757812, 403.225803 462.137664794922, 564.516115 462.147277832031, 403.225803
462.156890869141, 322.580647 462.166473388672, 241.935492 462.176086425781, 564.516115
462.185699462891, 483.870983 462.1953125, 403.225803 462.204925537109, 403.225803
462.214538574219, 645.161295 462.22412109375, 403.225803 462.233734130859, 80.645162
462.377868652344, 80.645162 462.387481689453, 80.645162 463.070037841797, 80.645162
463.079650878906, 161.290324 463.118103027344, 80.645162 463.127716064453, 161.290324
463.137359619141, 80.645162 463.14697265625, 241.935492 463.156585693359, 161.290324
463.166198730469, 80.645162 463.175811767578, 241.935492 463.185424804687, 80.645162
463.195068359375, 80.645162 463.214294433594, 80.645162 463.223907470703, 80.645162
463.243133544922, 80.645162 463.281616210937, 80.645162 464.080352783203, 80.645162
464.176635742187, 80.645162 464.186248779297, 80.645162 464.234405517578, 80.645162
467.890930175781, 80.645162 469.400177001953, 80.645162 473.893798828125, 80.645162
476.455871582031, 80.645162 476.475402832031, 80.645162 477.060882568359, 80.645162
477.090148925781, 80.645162 477.109680175781, 80.645162 477.217071533203, 80.645162
478.105865478516, 80.645162 478.115661621094, 161.290324 479.04443359375, 80.645162
485.846862792969, 80.645162 486.556365966797, 80.645162 490.438140869141, 80.645162
498.457489013672, 80.645162 527.134887695313, 80.645162 530.763061523438, 80.645162
534.031860351562, 80.645162 537.020629882813, 80.645162 559.549255371094, 80.645162
559.898132324219, 80.645162 569.957092285156, 80.645162 582.281860351562, 80.645162
621.751037597656, 80.645162 622.263732910156, 80.645162 622.319458007812, 80.645162
622.330627441406, 80.645162 622.352905273438, 80.645162 622.665100097656, 161.290324
622.765502929687, 80.645162 622.810119628906, 80.645162 623.066650390625, 80.645162
623.077819824219, 241.935492 623.088928222656, 161.290324 623.10009765625, 322.580647
623.111267089844, 1048.387051 623.122436523438, 2580.64518 623.133544921875, 3064.516068
623.144714355469, 5483.871078 623.155883789063, 6935.483551 623.167053222656, 7096.774292
623.17822265625, 6048.387146 623.189331054687, 7419.355011 623.200500488281, 10000
623.211669921875, 6209.677124 623.222839355469, 7741.93573 623.233947753906, 7500
623.2451171875, 6290.322876 623.256286621094, 5645.161057 623.267456054687, 5806.451797
623.278625488281, 5403.225708 623.289733886719, 3629.032135 623.300903320312, 2500
623.312072753906, 2661.290359 623.3232421875, 1612.903214 623.334411621094, 2096.774101
623.345520019531, 1370.96777 623.356689453125, 887.096786 623.367858886719, 403.225803
623.379028320312, 241.935492 623.390197753906, 645.161295 623.4013671875, 241.935492
623.412475585937, 161.290324 623.434814453125, 80.645162 623.445983886719, 80.645162
623.46826171875, 322.580647 623.490600585938, 241.935492 623.501770019531, 80.645162
623.512939453125, 80.645162 623.524108886719, 80.645162 623.579895019531, 80.645162
623.602172851562, 80.645162 623.713806152344, 80.645162 623.814270019531, 80.645162
624.093322753906, 161.290324 624.1044921875, 161.290324 624.115661621094, 322.580647
624.126831054687, 645.161295 624.138000488281, 1129.03223 624.149169921875, 1532.258034
624.160339355469, 2096.774101 624.171508789063, 2177.419472 624.182678222656, 2419.35482
624.19384765625, 1612.903214 624.204956054687, 2500 624.216125488281, 1612.903214
624.227294921875, 1290.32259 624.238464355469, 1370.96777 624.249633789063, 1532.258034
624.260803222656, 1854.838753 624.27197265625, 1451.612949 624.283142089844, 1854.838753
624.294311523438, 1048.387051 624.305480957031, 967.741966 624.316650390625, 806.451607
624.327819824219, 322.580647 624.338989257812, 645.161295 624.350158691406, 645.161295
624.361328125, 483.870983 624.383666992188, 241.935492 624.417175292969, 161.290324
624.428283691406, 80.645162 624.439453125, 80.645162 624.472961425781, 80.645162
624.495300292969, 80.645162 624.506469726563, 80.645162 624.517639160156, 80.645162
624.551147460938, 80.645162 624.606994628906, 80.645162 625.120910644531, 161.290324
625.132080078125, 241.935492 625.154418945313, 322.580647 625.165588378906, 403.225803
625.1767578125, 322.580647 625.187927246094, 403.225803 625.199096679687, 241.935492
625.210266113281, 241.935492 625.221435546875, 322.580647 625.232604980469, 322.580647
625.243774414062, 403.225803 625.254943847656, 322.580647 625.266174316406, 241.935492
625.27734375, 80.645162 625.288513183594, 161.290324 625.299682617188, 483.870983
625.310852050781, 80.645162 625.322021484375, 161.290324 625.333190917969, 161.290324
625.344360351562, 161.290324 625.355529785156, 80.645162 625.36669921875, 80.645162
625.3779296875, 80.645162 625.556701660156, 80.645162 626.149291992188, 80.645162
626.160461425781, 161.290324 626.182800292969, 161.290324 626.194030761719, 161.290324
626.216369628906, 80.645162 626.238708496094, 80.645162 626.294677734375, 80.645162
626.339416503906, 80.645162 626.3505859375, 80.645162 626.372924804687, 80.645162
627.2568359375, 80.645162 627.26806640625, 80.645162 627.290405273437, 80.645162
627.324035644531, 80.645162 634.609436035156, 80.645162 765.849182128906, 80.645162
840.490600585938, 80.645162 892.446411132813, 80.645162 923.552734375, 80.645162
938.812683105469, 80.645162 
##END=$$ End of the data block
