B3U4LV -OEChem-04022118523D 39 40 0 0 0 0 0 0 0999 V2000 8.3501 -0.9128 1.1084 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.6759 -0.0032 0.7481 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0174 1.3420 1.2005 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0404 -1.1497 1.5727 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8096 1.9926 -0.2934 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2336 -0.2510 0.0816 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2549 -0.2011 -0.7698 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4551 -0.0390 -0.0235 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1340 -0.3612 -2.2597 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9425 -0.0760 0.5526 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1729 -0.1923 0.2396 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2814 -1.3010 0.6421 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 1.0908 0.3065 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8967 -1.3591 0.4855 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8342 1.0326 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5323 0.4298 -0.2545 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1284 0.7991 -0.1677 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2251 -0.2792 -0.4225 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5202 1.3626 0.0613 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8909 -0.8577 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8665 1.0082 -0.0228 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2373 -1.2122 -0.7381 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6650 -0.6578 -0.5123 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5348 -0.2043 -1.0308 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8242 -2.2242 0.8244 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 2.0541 0.2259 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3942 -2.3205 0.5556 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3444 1.9770 -0.0395 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6111 -1.1849 0.2145 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2631 2.3697 0.3794 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1614 -1.6062 -0.9482 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6268 1.7443 0.2251 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5031 -2.2164 -1.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8085 -1.5801 -1.0844 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2428 0.1286 -1.0095 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1951 0.0902 0.9472 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4493 -0.0414 -0.2253 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5803 -0.4935 -3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1428 -0.3494 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 5 17 2 0 0 0 0 6 11 1 0 0 0 0 6 17 1 0 0 0 0 6 29 1 0 0 0 0 7 24 2 0 0 0 0 8 24 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 24 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 13 15 2 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 18 23 1 0 0 0 0 19 21 1 0 0 0 0 19 30 1 0 0 0 0 20 22 2 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 M END $$$$