IBS-ZINC02263671 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 1.7990 0.5220 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -0.5760 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -1.1090 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -0.5640 -2.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7340 0.5060 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.6350 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -0.5940 -3.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -0.6510 -4.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -0.7360 -4.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -0.4740 -5.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 -1.0880 -3.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -1.2450 -2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -1.8430 -1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 -1.3300 -3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 -1.8400 -4.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9290 -2.0680 -4.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7570 -1.7980 -3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 -1.2750 -2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 -1.0510 -2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2390 -2.0100 -3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -2.1570 -1.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -3.3910 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -4.1770 -0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -5.4090 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -5.8870 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -5.0940 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -3.8630 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 -7.2230 1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -7.9080 1.2740 O 0 5 0 0 0 0 0 0 0 0 0 0 2.5260 0.8300 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 1.3970 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 0.1900 1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -0.9960 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -0.5660 -5.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -2.1060 -5.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3470 -2.4650 -5.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8080 -1.0350 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 -0.6270 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7240 -1.1020 -4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6610 -2.2610 -2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4730 -2.8380 -4.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -2.0090 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -3.8390 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 -6.0050 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -5.4420 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -3.2910 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -7.5640 2.3180 O 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 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 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 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 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 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 2 0 0 0 0 M CHG 1 29 -1 M END