B78KLS -OEChem-04022107242D 47 48 0 0 0 0 0 0 0999 V2000 4.5981 4.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.3301 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -5.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -5.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -4.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -5.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -5.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -4.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -2.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -3.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -3.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -2.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -1.3923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -2.0826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 -0.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 0.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 5.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 5.0000 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 21 1 0 0 0 0 1 26 1 0 0 0 0 2 16 2 0 0 0 0 3 18 2 0 0 0 0 6 10 1 0 0 0 0 7 10 2 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 9 20 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 22 2 0 0 0 0 19 24 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 23 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$