IBS-ZINC02140498 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.5270 1.5290 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 0.0010 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.6050 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -0.5190 0.5370 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0210 0.0030 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -0.2920 1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -1.3590 2.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -1.9510 0.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -2.5390 1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -2.4990 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 -1.8320 -0.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -4.0390 -0.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4960 -4.3170 -0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 -4.5860 1.1750 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5240 -4.1240 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -6.0990 1.1960 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1750 -6.4350 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 -6.7090 0.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2620 -7.7620 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -5.9590 -1.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4870 -6.2080 -1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -4.5480 -1.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 -6.4240 -2.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -6.6800 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -6.6730 0.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6140 -5.5970 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1430 -8.0560 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -6.5110 1.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -5.5250 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -4.3280 1.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -5.2340 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -6.0340 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 1.8640 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 1.9790 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 1.9260 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -0.2990 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -1.6990 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -0.2820 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -0.2980 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0660 -5.5390 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 -5.7740 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1850 -4.6120 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3670 -8.8290 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8960 -8.3150 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5950 -8.1050 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -4.8800 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -4.4540 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -6.1360 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -6.9780 3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -5.2980 3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 -6.2180 3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 0.8940 2.0850 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 M CHG 1 52 -1 M END