IBS-ZINC02127102 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 0.1960 1.7540 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 0.2900 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.1800 -1.4510 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4410 0.5120 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -1.5780 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -0.2240 -1.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2880 -0.8350 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -0.8190 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -0.1200 -2.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -2.1290 -2.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -2.6700 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -2.7340 -3.6590 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5160 -2.2710 -3.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6740 -4.2350 -3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -4.4540 -2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 -5.9320 -1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -6.7280 -2.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8560 -2.5190 -4.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 -1.9210 -5.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 1.1360 -0.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 1.4080 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4470 0.5410 1.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 2.7840 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 3.1440 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 4.4450 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 5.3900 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 5.0460 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4930 3.7430 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 3.3560 -1.6650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 4.0070 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 2.0860 -1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 1.7860 -2.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 1.8280 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 2.3400 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 2.1380 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -0.3220 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 0.1930 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -1.5500 -2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -1.9080 -2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -2.2730 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -4.6820 -3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -4.7000 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4560 -4.0060 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -3.9880 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 2.4100 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 4.7300 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 6.4060 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 5.7900 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 -6.3630 -0.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -2.9910 -6.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -2.8280 -6.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3380 -7.3200 -0.6430 H 0 0 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 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 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 18 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 49 1 0 0 0 0 18 19 2 0 0 0 0 18 50 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 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 31 32 2 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END