B4T1PU -OEChem-04022101372D 47 48 0 1 0 0 0 0 0999 V2000 4.5981 0.8450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 0.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 0.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8450 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.3301 3.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 2.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 2.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 1.7624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 2.4527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 2.8819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.8081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 0.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 0.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -3.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 5.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 13 1 0 0 0 0 4 16 2 0 0 0 0 5 7 1 0 0 0 0 5 47 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 7 16 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 28 1 0 0 0 0 10 16 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 18 1 0 0 0 0 14 37 1 0 0 0 0 15 19 2 0 0 0 0 15 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 22 24 2 0 0 0 0 22 43 1 0 0 0 0 23 25 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 M END $$$$