68919703 -OEChem-04252405173D 57 60 0 1 0 0 0 0 0999 V2000 -6.3397 1.1207 2.5945 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.4766 2.5356 0.2518 F 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 0.2629 -1.2418 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2748 -2.0902 -0.1516 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5687 1.4265 -0.1126 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7858 -0.1838 -0.8573 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1424 -3.6321 0.7355 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0577 -2.2884 0.1588 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5037 1.5590 1.3497 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9006 1.7856 -0.6198 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5409 0.6653 2.0316 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9835 0.8995 -0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5404 2.2505 -0.7473 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9468 0.9586 1.5207 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1883 1.5460 -0.6324 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5133 3.6398 -0.1093 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4228 -0.7024 -0.7524 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0462 -0.5063 -0.7991 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9303 -1.8771 -0.2083 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8217 -1.4922 -0.2983 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3214 -2.6827 0.2536 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0606 -2.8528 0.2876 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2073 -1.3583 -0.3148 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4657 -3.3835 0.6619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9749 0.5053 -0.5712 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8756 -2.7389 -1.2707 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5065 0.4752 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6252 1.2198 -1.5773 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6884 1.1598 1.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8073 1.9042 -1.2941 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3389 1.8743 -0.0047 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7128 2.5773 1.6979 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5227 1.2652 1.7368 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9345 1.6455 -1.7073 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1532 2.8333 -0.4202 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2964 -0.3883 1.8448 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5041 0.8135 3.1169 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9699 1.2140 -0.3612 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8397 -0.1379 -0.3307 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7631 2.3442 -1.8186 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6578 0.2397 1.9423 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2583 1.9554 1.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8526 1.4716 0.4096 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4348 2.1341 -1.1713 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0578 3.6524 0.8872 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8804 4.2923 -0.7247 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4908 4.1283 -0.0671 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3328 0.4169 -1.2291 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4761 -3.7660 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3665 0.0897 -1.7418 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1217 -4.1522 1.0519 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9488 -2.8255 -1.0801 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7289 -2.1502 -2.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4602 -3.7433 -1.4003 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9999 -0.0670 1.5131 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2228 1.2511 -2.5866 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3142 2.4600 -2.0773 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 31 1 0 0 0 0 3 15 1 0 0 0 0 3 17 1 0 0 0 0 4 19 1 0 0 0 0 4 26 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 6 23 1 0 0 0 0 6 25 1 0 0 0 0 6 50 1 0 0 0 0 7 21 1 0 0 0 0 7 24 2 0 0 0 0 8 23 2 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 14 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 18 48 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 22 49 1 0 0 0 0 24 51 1 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 29 1 0 0 0 0 27 55 1 0 0 0 0 28 30 2 0 0 0 0 28 56 1 0 0 0 0 29 31 2 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 M END > 68919703 > 1 > 3 82 53 145 62 137 143 110 104 116 58 139 78 146 43 99 72 33 76 118 75 79 69 52 107 83 85 103 21 71 68 38 113 112 140 127 119 37 86 32 132 28 25 111 61 93 29 125 124 73 35 136 45 49 105 149 74 129 88 20 98 48 115 126 77 65 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17899716819246019596 14020679 6 17458344169505402618 16112460 7 18269559355515559904 19246450 95 17680112280351693160 19301679 30 8790878610795632343 19438510 23 17918001563912129131 20715895 44 18411978057600903360 21033648 144 18409441463106847335 21033648 29 17822571587089293925 21315759 148 13912586252919643652 21774942 28 16773523183352018520 21859007 373 17532920624180998581 22889206 1 17460016406068675859 23559900 14 18341339933481045150 2838139 119 17418093238871550737 3459 39 18339632425617773777 397638 26 18335695048756844744 4093350 32 17489591121629995566 4144715 1 18117844515626967370 5104073 3 18116426145495189608 5385378 56 18337668625078831490 57816373 69 12540990603063255345 59755656 215 18411698764837045836 6086070 43 17203320161304320850 7226269 152 18272369806200108440 > 600.9 18.78 4.22 1.58 4.47 2.37 0.75 -18.47 5.71 -0.15 0.05 0.68 -0.6 0.81 > 1283.28 > 335 > 2 5 10 $$$$