IBS-ZINC02127328 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.0110 1.2560 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -0.0260 1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -0.6320 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 0.0390 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 1.3300 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 1.9350 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -0.6230 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1580 -1.0040 -1.4100 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1820 -0.0770 -1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5600 -1.6240 -1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 -2.8360 -1.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5760 -0.6900 -1.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9840 -1.0580 -1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5510 -1.1090 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0530 -1.3790 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6590 -1.3440 -1.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 -1.9110 -2.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -3.0690 -1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -3.9010 -1.8430 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -3.6230 -3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -4.5060 -3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -4.2710 -4.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -3.1470 -5.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -2.2570 -5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -2.5020 -3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 -1.5780 -3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 -0.5820 -3.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.7280 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -0.5540 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -1.6330 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 1.8760 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 2.9360 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 0.0680 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 -1.4990 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3620 0.2990 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0960 -2.0260 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4930 -0.3010 -2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3690 -0.1560 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0400 -1.8870 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -3.2700 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -5.3860 -3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -4.9670 -5.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -2.9660 -6.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -1.3810 -5.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5170 -1.5890 0.9780 O 0 5 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 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 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M CHG 1 45 -1 M END