TDT2MOL CN1CCc2ccc(cc2C1)C(=O)C 29 30 0 0 0 0 0 3.9100 1.0500 0.2000 C 0 0 0 3 0 0 2.7000 0.2900 0.3000 N 0 0 0 0 0 0 2.6700 -0.8600 -0.5700 C 0 0 0 2 0 0 1.5700 -1.7900 -0.1300 C 0 0 0 2 0 0 0.2700 -1.0500 -0.0400 C 0 0 0 0 0 0 -0.9400 -1.7500 -0.0800 C 0 0 0 1 0 0 -2.1600 -1.0600 0.0000 C 0 0 0 1 0 0 -2.1600 0.3300 0.1300 C 0 0 0 0 0 0 -0.9500 1.0400 0.1700 C 0 0 0 1 0 0 0.2600 0.3500 0.0800 C 0 0 0 0 0 0 1.5400 1.1300 0.1200 C 0 0 0 2 0 0 -3.4600 1.0700 0.2200 C 0 0 0 0 0 0 -3.4700 2.3200 0.3300 O 0 0 0 0 0 0 -4.7500 0.3100 0.1800 C 0 0 0 3 0 0 3.9400 1.8100 0.9900 H 0 0 0 0 0 0 4.7800 0.3900 0.3000 H 0 0 0 0 0 0 3.9600 1.5500 -0.7800 H 0 0 0 0 0 0 2.4900 -0.5400 -1.6100 H 0 0 0 0 0 0 3.6300 -1.4000 -0.5400 H 0 0 0 0 0 0 1.4700 -2.6200 -0.8300 H 0 0 0 0 0 0 1.8000 -2.1800 0.8700 H 0 0 0 0 0 0 -0.9400 -2.8400 -0.1800 H 0 0 0 0 0 0 -3.1100 -1.6100 -0.0300 H 0 0 0 0 0 0 -0.9500 2.1300 0.2700 H 0 0 0 0 0 0 1.6200 1.6900 -0.8200 H 0 0 0 0 0 0 1.4900 1.8600 0.9600 H 0 0 0 0 0 0 -4.7500 -0.4600 0.9600 H 0 0 0 0 0 0 -5.5900 1.0000 0.3500 H 0 0 0 0 0 0 -4.8700 -0.1700 -0.8100 H 0 0 0 0 0 0 1 2 1 0 2 11 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 10 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 8 12 1 0 12 13 2 0 12 14 1 0 15 1 1 0 16 1 1 0 17 1 1 0 18 3 1 0 19 3 1 0 20 4 1 0 21 4 1 0 22 6 1 0 23 7 1 0 24 9 1 0 25 11 1 0 26 11 1 0 27 14 1 0 28 14 1 0 29 14 1 0 M END $$$$