TDT2MOL CCCCCCN1C(CCCC=C)NC(C1c2ccccc2)c3ccccc3 64 66 0 0 0 0 0 5.5400 1.9000 0.7300 C 0 0 0 3 0 0 4.8800 0.7800 -0.0100 C 0 0 0 2 0 0 3.7200 1.2900 -0.8100 C 0 0 0 2 0 0 2.7300 1.9700 0.0800 C 0 0 0 2 0 0 2.3100 1.1000 1.2200 C 0 0 0 2 0 0 1.7200 -0.2100 0.8100 C 0 0 0 2 0 0 0.3600 -0.1400 0.3900 N 0 0 0 0 0 0 0.0500 0.6200 -0.8100 C 0 0 0 1 0 0 -0.5700 1.9300 -0.4100 C 0 0 0 2 0 0 -0.7700 2.7900 -1.6200 C 0 0 0 2 0 0 -1.3700 4.1100 -1.2200 C 0 0 0 2 0 0 -2.7000 3.8800 -0.5600 C 0 0 0 1 0 0 -3.2500 4.8500 0.2000 C 0 0 0 2 0 0 -0.8700 -0.1900 -1.6100 N 0 0 0 1 0 0 -1.4600 -1.1500 -0.6800 C 0 0 0 1 0 0 -0.3000 -1.4400 0.2600 C 0 0 0 1 0 0 -0.7300 -1.9600 1.5800 C 0 0 0 0 0 0 -0.6000 -3.3200 1.8900 C 0 0 0 1 0 0 -1.0000 -3.8100 3.1300 C 0 0 0 1 0 0 -1.5500 -2.9400 4.0800 C 0 0 0 1 0 0 -1.6900 -1.5800 3.7800 C 0 0 0 1 0 0 -1.2800 -1.0900 2.5400 C 0 0 0 1 0 0 -1.9600 -2.3500 -1.4100 C 0 0 0 0 0 0 -1.5800 -2.5800 -2.7400 C 0 0 0 1 0 0 -2.0500 -3.7000 -3.4200 C 0 0 0 1 0 0 -2.9000 -4.6000 -2.7800 C 0 0 0 1 0 0 -3.2900 -4.3800 -1.4500 C 0 0 0 1 0 0 -2.8200 -3.2500 -0.7700 C 0 0 0 1 0 0 4.8200 2.3500 1.4400 H 0 0 0 0 0 0 5.8700 2.6700 0.0200 H 0 0 0 0 0 0 6.4000 1.5300 1.2900 H 0 0 0 0 0 0 4.5400 0.0200 0.7000 H 0 0 0 0 0 0 5.6200 0.3100 -0.6900 H 0 0 0 0 0 0 4.0900 2.0000 -1.5700 H 0 0 0 0 0 0 3.2500 0.4500 -1.3500 H 0 0 0 0 0 0 3.1600 2.9100 0.4700 H 0 0 0 0 0 0 1.8500 2.2800 -0.5200 H 0 0 0 0 0 0 3.2100 0.9400 1.8700 H 0 0 0 0 0 0 1.5800 1.6500 1.8500 H 0 0 0 0 0 0 1.7600 -0.9300 1.6700 H 0 0 0 0 0 0 2.3400 -0.6700 0.0100 H 0 0 0 0 0 0 0.9400 0.7700 -1.4300 H 0 0 0 0 0 0 0.0600 2.4600 0.3100 H 0 0 0 0 0 0 -1.5500 1.7400 0.0600 H 0 0 0 0 0 0 -1.4500 2.2900 -2.3300 H 0 0 0 0 0 0 0.2000 2.9700 -2.1100 H 0 0 0 0 0 0 -1.5100 4.7400 -2.1100 H 0 0 0 0 0 0 -0.7000 4.6100 -0.5100 H 0 0 0 0 0 0 -3.2300 2.9300 -0.7100 H 0 0 0 0 0 0 -2.7200 5.8000 0.3500 H 0 0 0 0 0 0 -4.2200 4.6800 0.6800 H 0 0 0 0 0 0 -1.5300 0.3100 -2.1300 H 0 0 0 0 0 0 -2.2800 -0.6700 -0.1300 H 0 0 0 0 0 0 0.3900 -2.1600 -0.2200 H 0 0 0 0 0 0 -0.1600 -4.0100 1.1400 H 0 0 0 0 0 0 -0.8900 -4.8800 3.3700 H 0 0 0 0 0 0 -1.8700 -3.3200 5.0600 H 0 0 0 0 0 0 -2.1200 -0.8900 4.5300 H 0 0 0 0 0 0 -1.4000 -0.0200 2.3000 H 0 0 0 0 0 0 -0.9000 -1.8700 -3.2400 H 0 0 0 0 0 0 -1.7400 -3.8800 -4.4600 H 0 0 0 0 0 0 -3.2800 -5.4900 -3.3200 H 0 0 0 0 0 0 -3.9600 -5.0900 -0.9500 H 0 0 0 0 0 0 -3.1200 -3.0800 0.2700 H 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 16 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 8 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 22 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 15 23 1 0 23 28 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 29 1 1 0 30 1 1 0 31 1 1 0 32 2 1 0 33 2 1 0 34 3 1 0 35 3 1 0 36 4 1 0 37 4 1 0 38 5 1 0 39 5 1 0 40 6 1 0 41 6 1 0 42 8 1 0 43 9 1 0 44 9 1 0 45 10 1 0 46 10 1 0 47 11 1 0 48 11 1 0 49 12 1 0 50 13 1 0 51 13 1 0 52 14 1 0 53 15 1 0 54 16 1 0 55 18 1 0 56 19 1 0 57 20 1 0 58 21 1 0 59 22 1 0 60 24 1 0 61 25 1 0 62 26 1 0 63 27 1 0 64 28 1 0 M END $$$$