IFLAB-ZINC04853876 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 1 0 0 0 0 0999 V2000 0.2630 1.3810 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 0.1440 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -0.3870 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 0.3190 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 1.5570 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 2.0870 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 2.3260 0.1980 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4620 1.7180 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 2.7190 1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 1.9290 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 2.7330 3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 3.9860 3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 3.9890 1.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 5.1400 0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 4.6380 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 3.5750 -0.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 3.7740 -1.4030 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 4.7330 -2.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 2.4690 -1.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 4.5220 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 5.0560 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 5.6420 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 5.6950 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 5.1620 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 4.5790 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 4.0130 -1.9830 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0590 3.9390 -2.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 3.6220 -2.7880 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2950 -0.2000 -0.9660 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.7980 1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -0.4060 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -1.3530 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 3.0530 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 0.8730 2.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3400 2.4050 4.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 4.8410 3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 5.7460 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5290 5.7410 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 5.4630 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 4.2430 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 5.0140 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 6.0580 2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 6.1520 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 5.2030 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 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 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END