PUBCHEM-ZINC02983230 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 2.0170 -0.6170 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -0.4120 0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -1.0820 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -0.9600 2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -0.6980 2.6730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9320 -1.0280 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -1.5480 3.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -0.8790 5.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 0.7200 2.9860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 1.6900 2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 1.4920 0.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 3.1030 2.7650 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7920 3.4540 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 4.0600 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 5.4950 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 6.2930 2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 7.6130 2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 8.1440 3.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 7.3570 3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 6.0390 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 3.0590 4.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 2.7510 4.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 2.5220 4.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 2.7500 6.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -1.6800 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -0.2060 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -0.1110 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 0.6660 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -2.1690 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 -0.8780 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.7110 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -2.0400 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -0.5240 2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 0.9490 3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 4.0320 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 3.7310 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 5.8890 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 8.2250 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 9.1710 3.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1470 7.7680 4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 5.4320 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 3.2750 4.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 3.7810 6.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 2.2520 6.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 2.2150 6.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -2.7810 3.8240 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 46 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M CHG 1 46 -1 M END