IBS-ZINC04652824 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.1600 1.5260 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -0.0040 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5150 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -2.0450 -1.2770 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2730 -2.4070 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -2.5580 -1.2560 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1940 -2.2060 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -4.5420 -2.4990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6030 -4.1580 -3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -4.0880 -2.5560 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8520 -4.4580 -3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -2.5580 -2.5370 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9070 -2.1000 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 -2.6130 -3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 -2.1540 -3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.0420 -3.6950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -4.6430 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -6.0480 -2.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -6.7300 -3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -8.1100 -3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -8.8100 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -8.1270 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -6.7460 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -10.5450 -2.4910 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -2.0410 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -2.9270 -3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -2.4540 -4.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -1.0930 -4.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -0.2070 -3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -0.6820 -2.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 -0.4980 -6.0830 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 1.8910 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8870 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 1.8900 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -0.3650 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -0.3690 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -0.1540 -2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -0.1510 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -1.0110 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -2.4970 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -3.7020 -3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -2.2160 -4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 -2.5200 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 -1.0650 -3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5690 -2.5510 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -2.3270 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 -5.7320 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1860 -4.3200 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -4.2720 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -6.1830 -4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -8.6430 -4.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -8.6730 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -6.2130 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -3.9890 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -3.1460 -5.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.8550 -4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 0.0100 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -4.0260 -1.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -4.3980 -0.4530 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 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 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 12 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 58 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 8 58 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 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 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 58 59 1 0 0 0 0 M END