IBS-ZINC02115988 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 59 0 0 1 0 0 0 0 0999 V2000 -1.3550 1.2870 1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -0.2290 1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -0.6770 3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -1.0010 1.1140 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1940 -0.8360 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -2.5270 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -2.9170 0.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -0.5220 -0.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 0.2520 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 0.7120 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 0.4890 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 0.9470 -2.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9750 1.2710 -4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 0.2830 -4.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7330 0.5830 -6.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5290 1.8740 -6.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 2.8600 -5.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7710 2.5650 -4.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 2.3040 -8.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2980 1.4020 -8.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0060 2.2600 -10.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1850 0.5920 -9.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 0.2650 -3.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -0.1020 -3.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -0.3340 -1.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -0.2640 -4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -1.3140 -4.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -1.5070 -5.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -0.6480 -6.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 0.4090 -6.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 0.6070 -5.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 1.8140 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 1.6800 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 1.5430 2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -0.4190 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -0.5650 3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -1.7220 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -0.0790 3.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -0.8050 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 1.1220 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6180 -0.7320 -4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 -0.2210 -6.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 3.8700 -6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 3.3460 -3.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0550 0.7470 -8.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3120 2.9670 -10.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 1.6430 -10.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 2.8600 -9.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -0.0290 -8.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5830 -0.0630 -10.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 1.2520 -10.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 0.3920 -4.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -1.9860 -3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -2.3260 -5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -0.7970 -7.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 1.0840 -7.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 1.4540 -5.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -3.1980 1.9940 O 0 5 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 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 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 58 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 M CHG 1 58 -1 M END