BJ0TN4 -OEChem-04012120152D 39 39 0 0 0 0 0 0 0999 V2000 6.0010 -1.6550 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -3.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4685 -2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 -2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 -0.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 -2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 -2.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -1.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 -1.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 -3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5072 -2.1919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 -1.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8872 -1.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 2.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 16 1 0 0 0 0 2 14 1 0 0 0 0 2 21 1 0 0 0 0 3 11 1 0 0 0 0 3 33 1 0 0 0 0 4 20 1 0 0 0 0 4 37 1 0 0 0 0 5 20 2 0 0 0 0 6 22 2 0 0 0 0 7 22 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 23 3 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 20 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 M END $$$$