BUC3S5 -OEChem-04012114362D 61 65 0 0 0 0 0 0 0999 V2000 4.5981 -5.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1424 0.6953 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 4.5981 0.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.0000 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 4.5981 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 5.0000 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 7.1962 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0000 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 4.5981 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.0000 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 8.1424 2.3047 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 8.7260 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 -1.0000 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 2.0000 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 4.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 5.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 3.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 3.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 5.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 5.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 4.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 3.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 5.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 4.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -4.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -3.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -3.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -4.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -5.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -4.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -4.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -5.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3350 2.8940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3350 0.1059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3460 1.5000 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 6.0010 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 29 1 0 0 0 0 2 31 1 0 0 0 0 3 9 1 0 0 0 0 3 15 1 0 0 0 0 3 43 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 4 20 1 0 0 0 0 5 15 2 0 0 0 0 5 23 1 0 0 0 0 6 19 1 0 0 0 0 6 26 1 0 0 0 0 6 53 1 0 0 0 0 7 19 1 0 0 0 0 7 23 2 0 0 0 0 8 23 1 0 0 0 0 8 25 1 0 0 0 0 8 55 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 14 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 19 2 0 0 0 0 16 24 1 0 0 0 0 17 21 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 22 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 20 27 2 0 0 0 0 20 28 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 24 26 2 0 0 0 0 24 52 1 0 0 0 0 25 29 2 0 0 0 0 25 30 1 0 0 0 0 26 56 1 0 0 0 0 27 29 1 0 0 0 0 27 54 1 0 0 0 0 28 30 2 0 0 0 0 28 57 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 M END $$$$