IBS-ZINC06759539 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 0.2530 0.7480 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -0.6640 0.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -1.1360 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -0.2760 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 -0.7580 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 -2.0980 0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -2.9610 1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -2.4860 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -3.3350 1.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 0.1790 0.3770 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3440 1.0560 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 0.6290 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4720 0.3790 2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 -0.2610 1.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9460 -0.6750 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7640 -1.2320 -0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 -0.4960 -0.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9760 0.8000 3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2700 1.4570 4.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2180 0.4530 3.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6460 0.9000 5.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 1.3090 2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 0.7550 3.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 2.6680 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 3.2770 3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 4.5450 2.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 5.2150 1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 4.6180 0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 3.3470 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 1.0000 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 1.0610 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 1.2620 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 0.7710 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 -2.4700 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 -4.0070 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -3.4170 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2330 -0.4210 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4520 -0.8060 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6620 0.5540 5.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9770 0.4930 5.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6200 1.9890 5.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 2.7550 4.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 5.0170 3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 6.2080 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 5.1460 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 2.8810 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 36 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 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 M END