B0B7TQ -OEChem-04022104552D 40 42 0 0 0 0 0 0 0999 V2000 7.1962 2.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.5000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.7942 0.5000 0.0000 N 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 6.3301 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.0000 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 9.7942 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.0000 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 4.5981 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 1.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 1.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4048 -1.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0063 -0.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -2.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 19 1 0 0 0 0 2 15 1 0 0 0 0 2 22 1 0 0 0 0 3 8 1 0 0 0 0 4 8 2 0 0 0 0 5 26 2 0 0 0 0 6 19 1 0 0 0 0 6 26 1 0 0 0 0 6 39 1 0 0 0 0 7 19 2 0 0 0 0 7 22 1 0 0 0 0 8 16 1 0 0 0 0 9 22 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 17 1 0 0 0 0 12 29 1 0 0 0 0 13 18 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 20 23 1 0 0 0 0 20 35 1 0 0 0 0 21 24 2 0 0 0 0 21 36 1 0 0 0 0 23 25 2 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 40 1 0 0 0 0 M CHG 2 3 -1 8 1 M END $$$$