IBS-ZINC05341677 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -1.2290 0.4850 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 1.7630 3.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 2.9460 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 3.3850 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 3.4530 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 3.9250 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 4.3590 -2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 4.2990 -2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 3.8260 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 3.8590 -1.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 4.3710 -2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 4.5760 -3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 4.2620 -3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 2.9740 -2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 2.7240 -2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2340 3.7790 -2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 5.0350 -2.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 5.2450 -3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 4.6770 -3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 5.1370 -4.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 3.0230 1.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -0.2500 1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 0.2150 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 0.5680 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 1.5640 3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 0.9670 3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 2.7240 3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 2.6130 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 3.8000 1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 3.9600 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 4.7300 -2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 5.0120 -4.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 2.1580 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 1.7320 -1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2460 3.6370 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 6.2670 -3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 3.2150 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 1.8130 1.8770 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2970 2.0590 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 38 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 21 37 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 38 1 M END