BEGIN IONS TITLE=MassSpecGymID0383256 PRECURSOR_MZ=708.33 ADDUCT=[M+H]+ FORMULA=C38H49N3O8S 499.169006 0.102 500.169006 0.022 500.190002 0.006 501.17099 0.005 706.278015 0.008 707.297974 0.009 708.301025 1.0 709.302979 0.44 710.304016 0.155 711.299011 0.034 END IONS BEGIN IONS TITLE=MassSpecGymID0191002 PRECURSOR_MZ=617.186 ADDUCT=[M+H]+ FORMULA=C30H32O14 73.026314 0.00043178 81.031914 0.0015750500000000001 85.026711 0.00101745 91.054527 0.02224711 92.056969 0.00140125 97.027397 0.00126728 99.045792 0.00036027000000000005 105.069328 0.0018466099999999998 109.027206 0.00058566 115.054115 0.00159858 116.061783 0.00143565 117.069061 0.00200502 119.049446 0.16291522 119.084969 0.00036751 120.053078 0.01233154 121.059433 0.00062006 127.039238 0.0009504600000000001 128.062119 0.00212994 129.070663 0.01120004 130.073486 0.00105456 131.086029 0.00623864 132.059006 0.00036117 132.088715 0.00045713 133.030319 0.00118219 133.065384 0.00413676 134.067825 0.00057028 135.064667 0.00040190999999999995 139.039047 0.00169182 141.070908 0.0042336200000000004 143.050446 0.00077214 144.057816 0.0019117799999999999 145.066452 0.00080472 146.031906 0.00041911 146.813782 0.00070515 146.882019 0.00035393 146.910675 0.00056484 147.044846 1.0 147.08046 0.0014021600000000002 147.184479 0.00037113 147.2052 0.00060648 147.224457 0.0005684700000000001 148.002487 0.00067347 148.048309 0.07635454 149.050888 0.00393491 155.05983 0.00101382 156.057968 0.00048427999999999996 157.065994 0.02319394 158.068893 0.0030206499999999997 159.044861 0.00042272999999999996 159.080383 0.006959180000000001 160.050903 0.00049695 160.081741 0.00064631 161.061447 0.00732669 162.065048 0.00103374 163.077637 0.00036208 165.056503 0.007185479999999999 166.059738 0.00067981 167.054382 0.00044536 169.074188 0.00188463 175.076172 0.00295729 179.071075 0.00043631000000000003 185.060242 0.04003881 186.064758 0.00714475 187.034424 0.0004987699999999999 187.076889 0.00603769 188.07695 0.00112969 189.054794 0.00430966 189.089935 0.0009504600000000001 195.044067 0.00116047 197.06189 0.0010789999999999999 201.092987 0.00035303 203.070679 0.01915404 204.074341 0.0013740900000000001 213.011459 0.00039738 213.055374 0.02665724 214.058655 0.00252098 215.070999 0.00043269 217.087372 0.00245943 227.072342 0.00245219 229.088486 0.00127905 231.010956 0.00075222 231.066055 0.0709505 232.068451 0.0074326 233.073654 0.00054493 235.096222 0.0005938100000000001 241.049881 0.0071248299999999995 242.054901 0.00088529 245.082687 0.00359727 246.086945 0.00045441000000000004 249.076401 0.003912280000000001 250.0802 0.00048881 259.061554 0.00261241 263.091553 0.00715832 264.094238 0.00133336 273.07605 0.015763160000000002 274.079041 0.00207381 285.087891 0.00036842 291.026031 0.0003648 291.087097 0.03638995 292.092194 0.0054665 309.096893 0.010831630000000002 310.098114 0.00223856 331.097565 0.00035574 437.121613 0.0030278899999999997 438.130066 0.00063002 455.133026 0.00068886 END IONS BEGIN IONS TITLE=MassSpecGymID0376830 PRECURSOR_MZ=703.26 ADDUCT=[M+H]+ FORMULA=C37H42N4O6S2 235.076004 0.207 250.082993 0.824 251.069 0.045 251.091995 1.0 252.076996 0.631 254.091003 0.312 264.101013 0.572 266.084015 0.313 278.075989 0.279 279.091003 0.19 280.093994 0.732 290.11499 0.67 292.091003 0.849 306.10199 0.03 318.112 0.557 334.102997 0.116 END IONS BEGIN IONS TITLE=MassSpecGymID0249628 PRECURSOR_MZ=692.442 ADDUCT=[M+H]+ FORMULA=C44H57N3O4 53.03912 0.011611565747879093 55.05489 0.00211610223546663 58.660858 0.0009959743114889069 62.387989 0.0009520477262348785 66.737907 0.0012098113688713643 67.054787 0.0019105014128193028 69.070221 0.004531759378707259 75.375778 0.0009971944944126298 80.94809 0.0051204976394036116 81.070152 0.02219116178801945 82.39444 0.0012799718869854373 83.049362 0.005601859802812339 83.085953 0.002066989872786779 85.102348 0.001594779081305974 85.982536 0.001183272390280389 90.976768 0.007684101962145655 91.054199 0.002036180253962773 92.370041 0.0017323547059557433 93.069832 0.010865423890022473 95.049347 0.006621322635582913 95.085587 0.03347175291783868 97.065376 0.0018613890501394516 105.044594 0.005271800321945265 105.069946 0.01101032061221458 107.085693 0.02041060985657665 109.064743 0.0022530677686545377 109.101143 0.013173399890244545 119.085548 0.02669028127351712 121.101128 0.023538548781540585 123.081039 0.002235375116260554 123.116547 0.010305664973764542 131.085754 0.0017878730289851404 133.101227 0.02205297607190782 135.080414 0.002640170801205663 135.116714 0.026237593408815884 136.197571 0.0014389007128003594 137.132309 0.00501037613053761 145.101151 0.00750778552966768 147.080688 0.0020276389734967116 147.116745 0.016958102273902393 149.09613 0.012059067835154508 149.132355 0.007636514828120457 157.101135 0.005384362196658712 158.963867 0.002455313088261627 159.117157 0.008009280711317837 160.703812 0.0013315246155127347 161.096375 0.0068354647386963015 161.132385 0.01189373304899004 163.112076 0.0016905634408182302 163.147766 0.001912636732935818 171.116684 0.0061603985361465465 175.111862 0.0065865474222568075 175.148102 0.036159205807338606 177.163773 0.007162168716523138 185.132736 0.0015267538833084163 187.148422 0.005544816251128288 189.130447 0.003907330767492009 189.163589 0.07984205952235329 191.179108 0.009286202140993967 197.132416 0.0014733708803955346 198.102188 0.03475691058224994 198.121674 0.0016692102396530775 199.086578 0.0023586135915565783 199.148102 0.011969079344529935 201.164429 0.004371610369968614 203.143509 0.0018455266721310525 204.993912 0.0011872379847824887 211.147247 0.0014721506974718114 213.162979 0.0014199878774826529 215.142853 0.002512661685676608 215.179749 0.0026767762889173532 216.92247 0.007948881656593548 217.158447 0.03197763892773985 224.082443 0.0014334098896436058 226.952072 0.005342265885790268 235.169724 0.0026767762889173532 241.19545 0.0013220681978538813 253.196213 0.005249531983587319 255.176331 0.0014440864902261822 255.206726 0.0013574535026418485 271.205383 0.00942926858880049 277.177551 0.0029555880869880607 285.220551 0.0019156871902451255 294.938141 0.0013968044019319157 320.177887 0.0013351851642839036 334.335571 0.0013559282739871949 348.206665 0.0014001599049721539 352.898315 0.004419502549724742 389.322205 0.004892628478398339 389.70813 0.001290343441837083 407.329163 0.009083346729925017 414.255035 0.008903064702944942 420.885254 0.006688432696387679 467.351166 0.00807517058919888 488.872437 0.004804165216428421 496.290253 0.001629249248901149 548.388306 0.0011631393720389592 556.861389 0.002297299399639497 632.416809 0.009349956698758495 692.441772 1.0 718.917419 0.0012308595243055863 END IONS BEGIN IONS TITLE=MassSpecGymID0240781 PRECURSOR_MZ=457.051 ADDUCT=[M+H]+ FORMULA=C23H17ClO6S 56.965229 0.0003209516237409676 64.745781 0.00026958443885237253 67.00267 0.0002583284334470024 69.962448 0.00026075376057854623 86.999863 0.00044650894370473694 88.469566 0.00027194757810874857 89.545441 0.0002835767107651254 114.018021 0.00025932343944968703 116.426613 0.0002708903842308961 121.02916 0.0019413810869880889 174.962006 0.001803199628365258 181.064438 0.0006041552072550862 197.060333 0.001998967059393463 225.054764 0.016722444008369246 226.062363 0.011234612776312389 237.054733 0.004608805616560133 253.049744 0.09390972372725517 253.085342 0.02117951120951997 254.057388 0.3438350205422099 267.064941 0.00036050311234768245 280.869934 0.0005320172720604491 281.080414 0.021295864723958904 282.088562 1.0 283.316589 0.0005183359395235351 454.538788 0.0004377404533060785 457.050476 0.7500169306490144 END IONS BEGIN IONS TITLE=MassSpecGymID0059650 PRECURSOR_MZ=664.1164 ADDUCT=[M+H]+ FORMULA=C21H27N7O14P2 97.0284 0.06306306306306306 119.0366 0.022022022022022022 123.057 0.022022022022022022 136.062 1.0 232.0854 0.07607607607607608 348.0728 0.16716716716716717 428.0167 0.022022022022022022 428.0468 0.04504504504504504 END IONS BEGIN IONS TITLE=MassSpecGymID0207016 PRECURSOR_MZ=407.17231 ADDUCT=[M+H]+ FORMULA=C17H25F3N4O2S 68.049057 0.05165 80.049118 0.05943 94.064651 0.07192 95.072357 0.0412 123.07872 0.0919 123.091339 0.03986 137.094467 0.25476 137.107117 0.18838000000000002 146.070984 0.07319 150.114517 0.03129 152.117859 0.09951 164.11795 0.13595000000000002 166.133743 0.19783 176.118057 0.08448 178.133865 0.07400000000000001 179.141418 0.0351 188.118134 0.26433 189.113388 0.04677 190.133575 0.06756999999999999 202.133789 0.20192 203.141129 0.07704 204.126801 0.03142 204.149384 1.0 205.144852 0.21088 216.149918 0.07548 219.173172 0.055529999999999996 245.176025 0.2053 247.191788 0.12242000000000001 407.174438 0.04639 END IONS BEGIN IONS TITLE=MassSpecGymID0375801 PRECURSOR_MZ=701.33 ADDUCT=[M+H]+ FORMULA=C38H44N4O7S 164.091995 0.013 191.069 0.011 202.108994 0.02 283.104004 0.014 339.17099 0.007 361.153015 0.02 405.247986 0.008 499.188995 0.05 534.190002 0.009 587.171021 0.006 642.263 0.012 701.26001 1.0 701.294006 0.458 END IONS BEGIN IONS TITLE=MassSpecGymID0366392 PRECURSOR_MZ=733.38 ADDUCT=[M+H]+ FORMULA=C40H52N4O9 135.054001 0.022 136.056 0.15 151.042007 0.067 165.063995 0.147 166.070007 1.0 167.074997 0.015 181.095993 0.059 280.112 0.011 306.126007 0.06 END IONS BEGIN IONS TITLE=MassSpecGymID0383258 PRECURSOR_MZ=708.33 ADDUCT=[M+H]+ FORMULA=C38H49N3O8S 499.169006 0.103 500.166992 0.033 708.301025 1.0 709.302002 0.475 710.301025 0.134 710.333008 0.018 711.302979 0.034 END IONS