B4YVL5 -OEChem-04022105282D 36 37 0 0 0 0 0 0 0999 V2000 4.5981 2.3450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1550 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.1550 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 2.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 2.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 5.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.7250 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 8 1 0 0 0 0 1 11 1 0 0 0 0 2 19 1 0 0 0 0 3 20 1 0 0 0 0 6 18 2 0 0 0 0 7 12 1 0 0 0 0 7 18 1 0 0 0 0 7 29 1 0 0 0 0 8 24 2 0 0 0 0 9 24 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 24 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 14 16 2 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 2 0 0 0 0 21 23 2 0 0 0 0 21 30 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 32 1 0 0 0 0 M END $$$$