IBS-ZINC00627463 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 1.5780 1.5790 -1.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 0.0510 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.5160 -2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -2.0220 -2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -2.6950 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -4.1580 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -4.9110 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -6.2730 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -6.9200 -1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -6.1900 -2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -4.8050 -2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -4.0760 -3.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -2.7350 -3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -2.1190 -4.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -8.2760 -1.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -8.9450 -2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -8.3420 -2.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -10.4480 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -10.9570 -3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -12.4180 -2.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 -13.2190 -3.3400 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -14.6040 -3.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7490 -12.5580 -2.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 -12.9500 -5.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 -13.8250 -5.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 -13.6140 -7.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 -12.5290 -7.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0290 -11.6540 -6.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 -11.8670 -5.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7890 -12.2980 -9.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -1.9580 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 1.9140 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 1.9300 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 1.9830 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6110 -0.3000 -1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -0.2840 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -0.1650 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.1810 -3.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -4.4160 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -6.8540 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -6.6990 -3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -10.8720 -2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -10.7510 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 -10.5340 -2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -10.6550 -4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -12.9170 -2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -14.6730 -5.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -14.2980 -8.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6190 -10.8060 -7.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1850 -11.1860 -4.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7070 -12.8120 -9.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -11.2300 -9.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -12.6870 -9.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -1.8210 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -2.5350 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -0.9840 -0.7570 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 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 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 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 M END