PUBCHEM-ZINC06822826 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8110 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.6690 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -4.0370 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5520 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -3.7020 -2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -2.3300 -2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -1.4920 -3.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -2.0950 -4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -6.0440 -1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -6.5410 -2.5790 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0270 -6.6050 -3.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -6.1900 -4.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -6.2490 -5.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -6.7500 -6.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -6.8300 -8.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -7.3020 -8.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -7.6990 -8.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -7.6260 -6.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -7.1520 -5.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -7.0780 -4.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -7.3600 -4.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -5.8170 -6.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -6.5160 -6.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -6.1090 -7.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -5.0090 -8.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4810 -4.3120 -8.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -4.7130 -7.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -6.9670 -1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -2.2690 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -4.7050 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -4.1070 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -1.3170 -5.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -2.7050 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 -2.7230 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -6.2750 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 -6.5240 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -5.8260 -4.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -6.5220 -8.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -7.3640 -9.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -8.0670 -8.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -7.9370 -6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -7.3750 -5.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -6.6490 -7.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 -4.6940 -8.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -3.4540 -8.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -4.1700 -7.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -6.1160 -1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -7.7500 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -7.3510 -0.8740 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 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 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 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 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 30 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M CHG 1 13 1 M END