PUBCHEM-ZINC00704227 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 1.1340 3.1990 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 3.6310 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 2.8400 -1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 1.6040 -2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 1.1790 -2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 1.9740 -2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 0.7500 -2.5230 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4930 1.3720 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 0.2340 -3.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5450 1.3490 -5.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 2.2790 -4.8930 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6380 -0.4060 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -1.0930 -1.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2300 -2.3460 -2.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0360 -2.1780 -3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7540 -2.5680 -1.9050 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0950 -1.6020 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9620 -0.6410 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 0.3340 0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1480 -1.5120 -0.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1830 -4.0010 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5280 -4.4040 -0.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1560 -4.9730 -2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 -6.3330 -2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2940 -7.2890 -3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1010 -6.8940 -4.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9370 -5.5440 -5.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9650 -4.5820 -4.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3290 -3.4720 -1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -4.1390 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -5.1750 -2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -5.5550 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 -4.9070 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2810 -3.8650 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 -6.8360 -0.2670 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 3.8180 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 4.5880 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 3.1960 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 0.2290 -3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 1.6380 -2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 -0.2790 -4.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -0.5040 -4.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4300 0.0020 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -1.1430 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2910 -2.1660 -2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4730 -6.6630 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4240 -8.3420 -3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0820 -7.6380 -5.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 -5.2350 -6.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8410 -3.5440 -4.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -3.8560 -3.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -5.6750 -2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -5.2030 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8990 -3.3720 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 1.1800 -5.9000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 55 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 19 2 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 M CHG 1 55 -1 M END