BM98PY -OEChem-04022107292D 56 58 0 0 0 0 0 0 0999 V2000 4.5981 4.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 4.5000 0.0000 O 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 8.0622 -2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.5000 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 7.1962 -1.0000 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 7.1962 -0.0000 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 6.3301 0.5000 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 7.1962 -3.0000 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 7.1962 -4.0000 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 4.5981 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -5.5000 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 3.7320 2.0000 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 3.0000 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 5.4641 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -0.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 0.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -1.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 -2.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -3.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 -3.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1403 -2.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 -4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1403 -4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 -3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4422 -5.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6822 -5.5000 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 6.0010 1.6900 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 5.2181 5.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 5.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 28 1 0 0 0 0 1 30 1 0 0 0 0 2 17 2 0 0 0 0 3 22 2 0 0 0 0 6 11 1 0 0 0 0 7 11 2 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 9 22 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 10 23 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 12 31 1 0 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 18 20 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 21 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 26 29 2 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M CHG 2 6 -1 11 1 M END $$$$