IBS-ZINC02102955 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 1 0 0 0 0 0999 V2000 0.4650 2.1890 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 1.5980 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 0.7010 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 0.3690 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 0.9890 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 1.8850 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 -0.5170 0.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -0.4090 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 -0.3910 1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2340 -1.4810 0.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 -1.6210 -0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -1.6630 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3600 -2.2280 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2040 -2.4990 -0.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2450 -3.1510 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4800 -3.6280 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8020 -3.5220 -1.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2950 -4.2410 0.6100 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1750 -4.5950 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9670 -4.3830 1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8470 -3.9530 2.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0230 -3.3520 1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7610 -2.8580 1.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9810 -3.0180 3.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9320 -2.8600 2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4420 -2.1100 4.2120 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2470 -1.4490 3.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0740 -3.1350 5.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1510 -3.2170 4.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3500 -4.4330 4.8540 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3900 -4.5060 5.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0630 -4.4120 3.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1880 -5.6650 5.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4830 -6.8480 4.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1260 -6.6450 3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8680 -2.7350 6.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1320 -2.0820 6.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3930 -1.5650 4.8340 O 0 5 0 0 0 0 0 0 0 0 0 0 11.8880 -5.0070 2.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 2.8840 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 1.8340 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 0.2870 -1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 0.7560 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 2.3370 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 0.5020 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 -1.2640 2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 0.5540 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4710 -0.3810 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5960 -0.7700 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -2.5340 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -2.5820 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 -1.7310 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1330 -5.6650 4.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 -5.7260 6.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7680 -5.3620 2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6840 -5.1260 3.7120 H 0 0 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 40 1 0 0 0 0 2 3 2 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 47 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 2 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 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 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 38 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 36 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 39 55 1 0 0 0 0 39 56 1 0 0 0 0 M CHG 1 38 -1 M END