TDT2MOL CC=CC(=O)N1CCOC1=O 20 20 0 0 0 0 0 -3.4500 0.2000 0.3400 C 0 0 0 3 0 0 -1.9700 0.0400 0.1500 C 0 0 0 1 0 0 -1.4800 -1.1100 -0.3700 C 0 0 0 1 0 0 0.0000 -1.2900 -0.5700 C 0 0 0 0 0 0 0.3900 -2.3800 -1.0500 O 0 0 0 0 0 0 0.9300 -0.2700 -0.2400 N 0 0 0 0 0 0 2.4100 -0.4500 -0.4000 C 0 0 0 2 0 0 2.8300 0.8700 0.2600 C 0 0 0 2 0 0 1.9700 1.7300 -0.2100 O 0 0 0 0 0 0 0.7800 1.0100 0.3400 C 0 0 0 0 0 0 0.3500 1.8700 0.9000 O 0 0 0 0 0 0 -3.8700 -0.7500 0.7000 H 0 0 0 0 0 0 -3.6300 0.9800 1.0900 H 0 0 0 0 0 0 -3.9200 0.4700 -0.6100 H 0 0 0 0 0 0 -1.2900 0.8600 0.4200 H 0 0 0 0 0 0 -2.1600 -1.9300 -0.6400 H 0 0 0 0 0 0 2.7300 -1.3200 0.1300 H 0 0 0 0 0 0 2.6200 -0.4600 -1.4600 H 0 0 0 0 0 0 2.9200 0.7700 1.3400 H 0 0 0 0 0 0 3.8300 1.1600 -0.1200 H 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 4 6 1 0 6 10 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 12 1 1 0 13 1 1 0 14 1 1 0 15 2 1 0 16 3 1 0 17 7 1 0 18 7 1 0 19 8 1 0 20 8 1 0 M END $$$$