NCID-ZINC04722222 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0220 0.8980 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 0.9690 2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 3.1000 1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 3.7760 2.2350 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5930 3.5340 3.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 5.2740 2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 5.4830 2.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 4.3090 1.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 4.1490 1.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 3.2730 1.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 6.7130 2.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 6.8580 3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0610 5.9060 4.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1270 6.1820 4.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 5.2560 5.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6380 5.3350 6.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 4.1750 7.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5600 3.4510 7.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8860 4.0710 6.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0310 2.2000 7.5840 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.6350 1.6350 8.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 1.7760 7.0140 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2500 -0.1690 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 1.0770 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 1.3090 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 1.1540 3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -0.1030 2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 1.4150 3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 3.3800 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 3.3380 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 5.8320 2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 5.5940 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1020 7.8470 3.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 4.9950 4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6990 7.0950 4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3520 6.1480 6.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3560 3.9130 8.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 1.5880 1.5070 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7230 1.4340 1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 38 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 19 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M CHG 1 38 1 M END