IBS-ZINC03999895 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.0890 1.5750 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 0.1110 0.0930 N 0 3 3 0 0 0 0 0 0 0 0 0 0.8740 -0.3690 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 -0.0110 0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -0.6040 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 -0.1210 -1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -0.5200 -1.1410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5010 -1.6180 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -0.3710 -2.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1480 -1.1310 -3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -0.6760 -1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 0.0620 -0.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -0.2970 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 0.9870 -3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 0.9980 -4.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 2.1420 -5.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 3.2490 -4.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 4.3790 -5.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 4.4100 -6.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 3.3110 -6.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 2.1750 -6.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 0.9970 -6.4620 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4670 -0.1260 -6.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 1.1500 -6.8820 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0910 1.8820 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 1.9590 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 1.9710 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 0.0910 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.4520 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 1.0650 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 -0.4380 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -0.2720 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -1.6920 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 0.9500 -1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -0.6170 -2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -0.3650 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -1.7530 -1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 1.1350 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 -0.2530 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -1.3750 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 0.2080 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 1.7670 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 1.1700 -3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 0.2100 -4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 3.2250 -3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 5.2390 -5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 5.2950 -7.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 3.3390 -7.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 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 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 2 1 M CHG 1 22 1 M CHG 1 24 -1 M END