PUBCHEM-ZINC01529377 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 -0.5490 1.2580 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 0.1260 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -0.6800 0.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -0.7500 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -1.8870 -0.7420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0080 -2.6000 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -2.6010 -0.6290 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2750 -3.6130 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -4.0250 1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6690 -4.2440 0.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0280 -4.3410 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6270 -3.3850 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0170 -3.9670 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4840 -4.4440 2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7530 -5.0180 2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5600 -5.1120 1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1200 -4.6360 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8530 -4.0600 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8050 -5.6690 1.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9840 -5.9290 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -6.6770 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -8.0410 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 -8.8410 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -10.0910 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2550 -10.5510 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -9.7620 1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0330 -8.5100 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -1.4180 -2.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 -0.6390 -2.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 1.9140 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 1.8710 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 0.8650 2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 0.5870 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -1.2140 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -1.4140 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -0.0220 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -1.1840 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 -0.1050 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -2.2690 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 -3.2310 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -2.3800 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8670 -4.3700 3.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0930 -5.3790 3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7670 -4.7070 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5350 -3.6790 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 -6.3900 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 -6.6510 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -8.5020 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1860 -10.7090 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 -11.5260 2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -10.1270 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -7.9110 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -2.2200 -2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 0.1940 -2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 -5.6480 0.8250 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0090 -5.6060 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5270 -5.9700 1.1250 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 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 55 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 M CHG 1 55 1 M END