IFLAB-ZINC00251820 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 1.1580 -0.7150 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -0.3780 -0.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0220 0.7020 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -0.7490 1.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6840 -0.2670 1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -2.2390 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -2.8480 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -4.2640 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -4.7010 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -3.4100 1.1750 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.6890 3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 0.0250 4.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 2.0790 3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 1.4290 2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 2.1140 5.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -1.0480 -0.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -0.5540 -0.1540 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -1.6110 -0.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 -0.0940 1.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 0.8370 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -1.7930 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -0.3690 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 -0.2260 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 -2.3070 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -4.9300 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -5.7190 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -0.6150 3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -1.7370 3.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8930 -0.1600 4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -0.4280 5.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 3.1450 3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 2.0090 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 1.8710 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 1.5620 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 1.6830 6.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 2.0100 5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 3.1810 5.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -2.0320 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 0.5030 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 1.2210 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 1.6100 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -0.0740 2.1730 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1370 -0.1760 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 1.4680 4.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 42 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 11 42 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 44 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 42 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 38 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 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END