IBS-ZINC05197854 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -3.1340 1.1190 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -0.2420 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -0.6760 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -2.0640 1.7010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -3.0460 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 -4.3420 1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -4.6950 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 -3.7510 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -2.3760 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4890 -1.2970 1.1400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 0.0550 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -0.4010 1.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 1.3800 2.7630 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8920 2.2560 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 2.4550 3.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 3.0750 3.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 1.8680 4.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 1.2730 4.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1040 1.9610 4.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -0.0990 4.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -0.4420 5.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -1.7160 5.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -2.6640 5.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.3320 5.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -1.0700 5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -3.2430 5.6980 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 1.9400 6.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 3.2530 6.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 4.8920 8.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 2.4910 9.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 2.7640 1.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 1.7130 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 1.0690 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 1.6330 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -2.7320 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -5.1320 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -5.7470 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1840 -4.0100 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 0.2750 5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -1.9710 5.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -3.6580 6.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -0.8650 4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 1.0790 6.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 1.8800 6.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 4.1020 6.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 3.2780 6.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 5.0610 8.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 5.5660 7.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 5.0200 9.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 1.4910 8.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 2.5540 9.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 2.7480 10.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 1.9390 2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 3.4750 8.1880 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5410 3.3690 8.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 31 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 42 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 54 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 54 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 54 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END