PUBCHEM-ZINC02851194 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -1.6270 1.0010 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -0.4790 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -0.9850 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -2.3400 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -3.1970 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -2.6870 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -1.3300 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -0.7760 -2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -4.5720 -0.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -5.1700 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -4.5350 2.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -6.6290 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -7.0280 2.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -8.3230 2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -9.1930 1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -10.5100 1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -10.9740 3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -10.1240 4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -8.7850 3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -7.8730 5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -8.3330 6.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -7.4810 7.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -6.8060 8.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -9.7160 6.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -10.6460 7.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -11.9330 7.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -12.3000 6.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -11.3810 5.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -10.0900 5.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -13.6810 6.7060 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1720 -14.4920 7.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 -14.0070 6.0800 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9220 1.4810 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 1.1680 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 1.4240 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.3180 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -2.7340 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -3.3510 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -0.5200 -3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -1.5240 -2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 0.1170 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -5.0940 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -7.2240 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 -6.7840 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -8.8410 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -11.1840 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 -12.0050 3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -10.4900 5.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -6.8360 5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -10.3610 7.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -12.6540 7.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -11.6730 5.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -9.3720 5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 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 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 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 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 3 0 0 0 0 24 25 1 0 0 0 0 24 29 2 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 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 M CHG 1 30 1 M CHG 1 32 -1 M END