BR5UA9 -OEChem-04042102283D 37 39 0 0 0 0 0 0 0999 V2000 -6.4744 2.1639 0.5255 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.0491 -0.8562 1.2514 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4038 -2.2147 1.6008 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4151 0.0645 2.1696 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 -0.0840 -2.4948 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2092 0.8614 0.1517 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 -1.3467 -1.4432 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1360 -0.9681 0.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2513 -0.8221 -0.2741 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4119 -0.7927 -0.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4569 -0.0786 0.5816 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3078 0.1973 -0.7774 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0089 -0.2253 -1.3374 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8949 -1.3743 -0.3968 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5988 0.2398 1.2872 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3268 0.8151 -1.4814 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1189 -0.2878 -0.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6299 0.8628 0.5829 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4957 1.1480 -0.7887 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6296 -0.0942 -0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8282 -0.7711 -0.2073 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5961 1.2516 0.2702 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 -0.0821 -0.0296 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7961 1.9404 0.4479 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0119 1.2736 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2744 -0.8203 -0.1958 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7464 -1.7751 -1.4051 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7545 -2.1953 0.3143 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7003 0.0193 2.3434 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2341 1.0398 -2.5384 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5486 1.1320 1.0976 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3128 1.6340 -1.3156 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5105 -1.7776 -0.4727 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8344 -1.8292 -0.4587 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6986 1.8370 0.4032 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7676 2.9970 0.7028 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2416 -1.8414 -1.5474 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 5 13 2 0 0 0 0 6 17 2 0 0 0 0 7 26 1 0 0 0 0 7 37 1 0 0 0 0 8 26 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 17 1 0 0 0 0 10 20 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 14 17 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 18 1 0 0 0 0 15 29 1 0 0 0 0 16 19 1 0 0 0 0 16 30 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 22 24 2 0 0 0 0 22 35 1 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 M END $$$$