PUBCHEM-ZINC05979248 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.5870 -1.9380 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.0040 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -0.4750 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -0.0920 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -0.3620 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 1.1460 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 1.4740 2.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 1.7230 3.9060 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1430 2.5690 3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9380 2.1560 4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8550 2.6390 6.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 2.8220 6.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 3.9690 6.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 4.0780 7.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 3.1370 8.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 2.0430 8.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 1.8430 7.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 2.9990 6.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 1.9850 4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3570 2.1200 4.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 1.5710 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 1.3580 1.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 0.5030 4.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -0.7190 4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -1.8300 5.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -1.7350 5.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -0.5270 5.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 0.5860 4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -0.4710 5.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -2.9130 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 -1.2010 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -1.6760 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -2.2940 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -2.7200 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 0.3190 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -1.4160 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 0.8410 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -0.8660 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 0.0600 -3.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -0.8580 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -0.8310 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 1.5180 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 1.6980 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 4.7650 5.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 4.9530 7.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 1.3040 8.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 0.9380 7.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 3.3220 7.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -0.8200 4.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -2.7690 5.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -2.5940 5.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 1.5220 4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 0.4570 5.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -0.6380 -0.3610 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8640 0.0630 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 54 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 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 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END