IBS-ZINC05426144 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.1250 1.5670 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 0.0510 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -0.6620 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -0.4880 -0.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4140 -1.5840 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 0.0420 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 0.9190 -0.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -0.1120 1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.7780 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -1.8080 2.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -0.1110 3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -0.7710 4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -0.1370 5.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 0.8780 6.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 1.1790 7.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 1.8900 8.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 0.3760 7.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6690 -0.4610 6.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 -1.3900 5.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8820 -1.4490 6.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1960 -0.6010 7.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 0.3300 8.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 1.9080 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 2.1120 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 1.8540 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -0.1550 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -0.3970 1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 -1.7490 0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -0.3820 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 0.7020 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 0.9500 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 -0.1690 3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -1.8410 4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -0.7140 5.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 1.4110 6.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3890 -2.0550 5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6190 -2.1630 6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1780 -0.6610 8.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5160 0.9910 8.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -0.4590 -2.3940 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 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 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M CHG 1 40 -1 M END