IBS-ZINC02124270 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 1 0 0 0 0 0999 V2000 0.1980 1.4810 1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 0.0920 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.6570 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 0.0410 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 1.4320 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 2.1620 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 1.8010 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3670 0.6180 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -0.4240 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -1.3980 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 3.2040 -0.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4150 3.9120 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2780 3.4600 -1.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3300 4.5380 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5370 3.1250 -0.6000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 3.4280 0.6640 N 0 3 0 0 0 0 0 0 0 0 0 0 5.0970 3.5220 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 3.8860 2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 4.6590 2.3140 O 0 5 0 0 0 0 0 0 0 0 0 0 7.3400 3.6780 1.4020 O 0 5 0 0 0 0 0 0 0 0 0 0 5.0600 2.7590 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 1.9690 -2.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 2.0450 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -0.4200 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -1.7390 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 3.2450 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 0.4350 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 3.3790 3.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 3.0920 -3.1720 O 0 5 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 28 2 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 M CHG 1 16 1 M CHG 1 19 -1 M CHG 1 20 -1 M CHG 1 29 -1 M END