TDT2MOL O=C(C1C(C2CC1C=C2)c3ccccc3)N4CCOC4=O 38 41 0 0 0 0 0 0.2700 1.5600 -1.0200 O 0 0 0 0 0 0 0.8900 0.4800 -0.7700 C 0 0 0 0 0 0 0.2100 -0.8000 -1.1900 C 0 0 0 1 0 0 -1.2800 -0.8200 -0.9700 C 0 0 0 1 0 0 -1.4900 -1.9800 0.0200 C 0 0 0 1 0 0 -0.2200 -1.8500 0.8900 C 0 0 0 2 0 0 0.7400 -1.9300 -0.3100 C 0 0 0 1 0 0 0.2200 -3.2300 -0.9700 C 0 0 0 1 0 0 -1.1300 -3.2600 -0.7600 C 0 0 0 1 0 0 -1.8700 0.4200 -0.3700 C 0 0 0 0 0 0 -1.1800 1.2300 0.5300 C 0 0 0 1 0 0 -1.7900 2.3800 1.0500 C 0 0 0 1 0 0 -3.0900 2.7200 0.6700 C 0 0 0 1 0 0 -3.7900 1.9100 -0.2300 C 0 0 0 1 0 0 -3.1800 0.7600 -0.7500 C 0 0 0 1 0 0 2.1400 0.5300 -0.1200 N 0 0 0 0 0 0 2.7500 1.8500 0.2900 C 0 0 0 2 0 0 3.9900 1.2800 0.9900 C 0 0 0 2 0 0 4.3500 0.3000 0.1900 O 0 0 0 0 0 0 3.0600 -0.4400 0.3300 C 0 0 0 0 0 0 3.5100 -1.4000 0.6800 O 0 0 0 0 0 0 0.5100 -0.9600 -2.2400 H 0 0 0 0 0 0 -1.8600 -1.0100 -1.8900 H 0 0 0 0 0 0 -2.4000 -2.0200 0.5500 H 0 0 0 0 0 0 -0.1600 -0.9000 1.4200 H 0 0 0 0 0 0 -0.1000 -2.6800 1.5800 H 0 0 0 0 0 0 1.7700 -1.9400 -0.0700 H 0 0 0 0 0 0 0.8300 -3.9600 -1.4700 H 0 0 0 0 0 0 -1.8300 -4.0100 -1.0800 H 0 0 0 0 0 0 -0.1500 1.0000 0.8500 H 0 0 0 0 0 0 -1.2400 3.0200 1.7600 H 0 0 0 0 0 0 -3.5700 3.6300 1.0800 H 0 0 0 0 0 0 -4.8100 2.1700 -0.5300 H 0 0 0 0 0 0 -3.7300 0.1200 -1.4600 H 0 0 0 0 0 0 2.0700 2.3600 0.9500 H 0 0 0 0 0 0 2.9900 2.3800 -0.6200 H 0 0 0 0 0 0 3.8000 1.0400 2.0300 H 0 0 0 0 0 0 4.7900 2.0400 0.9700 H 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 7 1 0 3 4 1 0 4 5 1 0 5 9 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 4 10 1 0 10 15 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 2 16 1 0 16 20 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 22 3 1 0 23 4 1 0 24 5 1 0 25 6 1 0 26 6 1 0 27 7 1 0 28 8 1 0 29 9 1 0 30 11 1 0 31 12 1 0 32 13 1 0 33 14 1 0 34 15 1 0 35 17 1 0 36 17 1 0 37 18 1 0 38 18 1 0 M END $$$$