IBS-ZINC06645699 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -1.2340 0.9520 0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -0.0660 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 0.2070 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 -1.3660 0.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -2.3210 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -3.3060 -0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 -4.3360 -1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -4.4070 -2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 -3.4090 -1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 -2.3690 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4150 -1.3860 -0.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7540 -1.3680 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -5.5330 -2.9100 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6340 -5.5020 -2.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -6.9450 -2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -5.2120 -4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -5.5570 -4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -5.0760 -6.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -5.1800 -6.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -4.4270 -6.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -4.4940 -5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -3.8930 -5.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 -3.2540 -6.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 -3.2060 -7.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -3.7920 -7.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 1.9710 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 0.7450 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 0.9010 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 0.0150 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 1.2110 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 0.1090 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -0.5200 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -3.2620 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -5.0680 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -3.4640 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -1.2450 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 -2.2660 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -0.5040 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -7.7140 -3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -7.0990 -2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -6.0960 -4.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -3.9180 -4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 -2.7900 -6.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -2.7050 -8.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -3.7510 -8.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 -7.2190 -1.0760 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5090 -8.1610 -0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 -7.1650 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -6.5510 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 41 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 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 M CHG 1 46 1 M END