BH25CN -OEChem-04022100302D 44 45 0 0 0 0 0 0 0999 V2000 9.7942 -3.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.7942 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7942 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7942 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2163 -3.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8363 -1.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 -1.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 -3.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 3 18 1 0 0 0 0 6 11 1 0 0 0 0 7 11 2 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 22 1 0 0 0 0 10 40 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 14 19 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 18 20 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 26 1 0 0 0 0 23 41 1 0 0 0 0 24 27 2 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M CHG 2 6 -1 11 1 M END $$$$