IBS-ZINC06664720 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.0590 1.0810 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 0.2360 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -0.3620 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -0.1130 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 0.7430 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 1.3330 1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 -0.7480 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 -2.0820 -0.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 0.0200 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2710 -0.4420 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1750 0.7400 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3840 0.6900 -0.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4570 1.8720 -0.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 1.5280 -0.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6200 1.8990 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2850 2.1200 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 2.8110 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 3.3380 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 3.1590 -3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 2.4960 -3.6360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 1.9860 -2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0060 3.2300 -0.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1980 3.9580 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9780 3.3980 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7880 4.6930 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8500 4.9310 -1.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 8.1540 6.1220 -1.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1820 4.7340 -1.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8270 3.4790 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6180 -1.6070 -0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 1.5500 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 0.0440 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 -1.0220 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 0.9400 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 1.9940 2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 2.9340 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 3.8810 -2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 3.5660 -4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6970 1.4540 -2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4160 3.4620 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6550 2.5440 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2840 5.5340 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7950 4.5780 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4570 2.6190 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1700 3.7140 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 -2.4070 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 30 2 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 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 M END