IBS-ZINC04677844 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.0920 -3.0290 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -4.2980 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -5.3190 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -3.9580 0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -3.8700 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -3.5350 2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -3.4400 2.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -3.2170 3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -3.6860 1.9690 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -3.3240 3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 -3.4420 2.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -2.9990 4.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 -2.7980 5.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 -2.5980 6.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1700 -2.2000 7.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -2.7620 7.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -3.7700 6.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -3.9180 7.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -3.0690 8.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -2.0680 8.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.9130 8.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -3.2330 9.3340 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7430 -4.1130 9.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -2.4880 10.2660 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0760 -2.6070 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -3.2750 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -2.3020 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -4.7200 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 -4.8960 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -6.2220 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -5.5650 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -4.0310 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -2.9050 4.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 -1.1130 7.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1480 -2.5770 8.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0280 -2.6210 6.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -4.4330 5.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -4.6970 7.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 -1.4090 9.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 -1.1340 8.4820 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 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 9 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 33 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END