IBS-ZINC01894776 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 0 0 0 0 0 0999 V2000 0.5470 -1.0620 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -0.2690 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -0.6850 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -1.7280 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -2.1140 -3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -1.4500 -3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -0.3960 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -0.0180 -1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -1.8560 -4.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -2.1820 -5.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -2.0360 -6.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -1.5780 -5.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -2.4400 -7.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -2.9330 -8.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -3.5030 -9.6900 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 -2.8770 -7.3530 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -2.3470 -7.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -0.9900 -8.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -0.8930 -8.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 0.4440 -9.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 1.2410 -9.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6220 0.7540 -9.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 1.9850 -10.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1060 2.3970 -10.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 3.7300 -11.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 4.2820 -11.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 3.1920 -10.4550 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 5.6670 -11.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 6.1240 -12.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0350 5.9240 -11.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3260 4.4260 -11.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3150 1.5730 -10.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0160 1.6420 -9.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6500 0.7400 -11.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -2.1280 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 -0.8640 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.7620 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -0.4680 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 0.7960 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -2.2400 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -2.9290 -3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 0.1220 -3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 0.7970 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 -1.8950 -4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -3.1430 -8.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -2.4490 -6.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -0.1940 -7.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -0.8880 -9.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 -1.6890 -9.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 -0.9950 -7.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 0.1170 -9.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 6.3620 -10.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 5.6340 -12.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5840 7.1790 -12.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 5.5340 -13.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9630 6.3580 -10.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8390 6.4100 -12.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5570 4.0230 -12.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1720 4.2680 -11.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0910 0.6850 -12.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4490 0.1950 -11.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 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 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 2 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 32 1 0 0 0 0 25 26 2 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 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 30 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 M END