IBS-ZINC00542261 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.3050 1.5560 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 0.1020 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.2450 -0.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -0.7130 -0.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -2.1190 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -2.9170 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -4.3050 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -4.9060 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 -4.1290 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 -2.7340 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -4.7620 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -6.2100 -0.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -6.8340 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -6.2680 -0.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -6.9360 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 -6.4560 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4000 -7.1810 -0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3220 -8.4160 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 -8.9390 -1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 -8.1840 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9850 -10.2810 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -10.7070 -2.3750 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5820 2.1690 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 1.8680 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 1.7070 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -0.2530 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 -2.4930 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -4.9160 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -2.1290 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -4.5130 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5670 -4.3220 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -6.7230 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -7.9110 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3460 -5.5080 0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3670 -6.7820 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2310 -8.9770 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 -8.5950 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0770 -10.8850 -2.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 2 0 0 0 0 M CHG 1 22 -1 M END