D04TLI -OEChem-10191521542D 43 45 0 0 0 0 0 0 0999 V2000 7.1962 4.1550 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 4.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1962 4.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 5.1550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.1550 0.0000 C 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 2.8660 -3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.6550 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 2.8660 -4.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.0350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -4.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -3.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 -2.3081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 5.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 5.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.4650 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 9 1 0 0 0 0 1 11 1 0 0 0 0 4 22 1 0 0 0 0 4 43 1 0 0 0 0 5 10 1 0 0 0 0 5 17 1 0 0 0 0 5 28 1 0 0 0 0 6 12 1 0 0 0 0 6 21 1 0 0 0 0 6 31 1 0 0 0 0 7 17 2 0 0 0 0 7 21 1 0 0 0 0 8 21 2 0 0 0 0 8 26 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 13 2 0 0 0 0 10 18 1 0 0 0 0 11 14 1 0 0 0 0 11 15 2 0 0 0 0 12 14 2 0 0 0 0 12 16 1 0 0 0 0 13 19 1 0 0 0 0 13 23 1 0 0 0 0 14 27 1 0 0 0 0 15 20 1 0 0 0 0 15 29 1 0 0 0 0 16 20 2 0 0 0 0 16 30 1 0 0 0 0 17 25 1 0 0 0 0 18 22 2 0 0 0 0 18 32 1 0 0 0 0 19 24 2 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 22 24 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 25 26 2 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$