IBS-ZINC01076306 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.8230 -1.1190 -2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -1.3890 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -2.3410 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -2.6660 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -1.5540 1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -0.5970 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -0.6220 0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 0.1190 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -0.4500 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 0.2850 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 1.5860 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 2.1560 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 1.4290 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 2.5210 -1.2180 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.5800 3.5290 -2.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0080 1.5780 -1.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4390 3.3040 0.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6170 4.2720 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 5.0930 1.6350 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 6.0290 2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 6.1450 1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 5.2700 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 4.3530 0.3190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 0.4020 2.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -1.5020 3.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -1.4610 4.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 -2.8750 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -1.7080 0.5250 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -3.1780 2.2410 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -3.9320 0.0860 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -3.9530 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -5.0000 0.3850 F 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -4.2620 2.5450 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -3.7750 1.1040 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -1.8100 -3.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -1.2560 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -0.0940 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -2.9090 -1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -1.4670 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6350 -0.1570 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1990 3.1730 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 1.8760 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2820 3.0840 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7550 6.6950 2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 6.9010 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 5.3340 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 0.4770 3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 1.0330 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 3 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 M END