BM4RA6 -OEChem-04022100222D 35 36 0 0 0 0 0 0 0999 V2000 4.5981 -3.3080 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.3080 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 -0.3080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3301 -0.3080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1097 0.7853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.6920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3007 2.1865 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.1920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 2.3944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 1.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6856 3.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -0.8330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -0.8330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.4980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 1.0020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.1180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.9280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3954 1.4636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2520 3.0558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9377 3.8744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1192 3.5602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.2710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.1180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 5 17 1 0 0 0 0 5 20 1 0 0 0 0 6 18 1 0 0 0 0 6 22 1 0 0 0 0 7 18 2 0 0 0 0 8 17 1 0 0 0 0 8 26 1 0 0 0 0 9 17 2 0 0 0 0 9 19 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 18 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 15 2 0 0 0 0 13 25 1 0 0 0 0 14 16 2 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 29 1 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$