PUBCHEM-ZINC05795110 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 -4.5630 -5.7760 2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -5.4050 2.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -4.2580 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6490 -3.5110 1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 -2.3330 0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 -1.9140 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -2.6650 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -3.8360 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -4.5690 0.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -5.5820 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -2.2580 -0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -1.0450 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 -1.5330 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9230 -1.8990 1.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0470 -0.3970 0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2560 0.3030 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2490 1.6930 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4200 2.3910 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6400 1.7110 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6520 0.3080 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4560 -0.3900 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9820 -0.0630 -0.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.3260 -0.9680 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7200 1.0770 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9360 2.1140 -0.2320 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.3830 3.5050 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2570 3.8510 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7230 5.3040 0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5340 5.4860 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6610 5.1400 -1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1940 3.6870 -1.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3660 -6.7070 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -4.9900 3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4080 -5.9150 2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4950 -3.8370 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6950 -1.0040 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -6.3030 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -5.1260 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -6.0910 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -1.1490 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 -0.2240 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.8350 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -0.0640 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 2.2240 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4020 3.4690 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4590 -1.4680 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7990 1.1150 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5160 4.1650 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1240 3.1920 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6790 3.7220 1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3460 5.5510 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8560 5.9640 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4020 4.8260 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8670 6.5210 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2390 5.2690 -2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7940 5.7990 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5720 3.4400 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0620 3.0270 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 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 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M CHG 1 25 1 M END