IFLAB-ZINC04569408 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 -0.9060 0.8030 8.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -0.6200 8.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -1.1890 9.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -2.7090 9.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -3.0440 7.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -4.3330 7.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -5.2180 8.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -4.6750 6.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -3.7920 5.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -5.9630 5.7650 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -6.2920 4.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -7.8120 4.2710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9780 -8.2170 4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -8.4440 5.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -9.5790 4.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -8.9380 3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -8.1510 2.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -7.7220 1.4990 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -8.7340 0.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -7.3720 1.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -6.2450 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 -6.3170 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 -5.1600 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7770 -3.9260 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -3.8560 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -5.0160 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -2.7860 -0.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -1.5510 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 1.1570 7.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 1.0920 9.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 1.2470 8.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.7860 9.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -0.9420 10.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -3.1500 9.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -3.1020 9.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -2.3370 7.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -6.6710 6.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -5.8460 3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -5.9010 4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -7.7150 5.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -8.8510 6.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -9.8080 4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 -10.4710 4.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 -8.2860 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -9.7100 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -7.2780 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 -5.2170 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -2.8960 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -4.9620 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 -0.7220 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -1.5340 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 -1.4530 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 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 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END