IBS-ZINC04870908 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.7930 -0.9320 2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -1.1330 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -1.5560 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -1.6900 2.5140 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -1.1810 3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -1.8510 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -1.8080 -1.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -2.1960 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 -3.3810 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -3.3080 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 -4.2140 -0.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 -2.0910 0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2400 -1.2950 0.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0860 -0.9900 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -0.0830 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 -0.2390 -2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 0.8720 -2.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 2.1400 -2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 2.2960 -0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 1.1840 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 3.3300 -3.2400 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6730 3.1930 -4.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 4.4470 -2.7570 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8220 -1.6380 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5180 -1.1450 -0.8870 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4270 -1.8860 -1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0060 -0.8410 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3050 0.4090 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9620 0.7140 -2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9560 0.1170 -1.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 -4.4620 -1.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -0.5940 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -0.9740 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -1.0730 4.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -1.2290 -2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 0.7510 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 3.2860 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 1.3060 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 -0.8240 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3880 -2.4650 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1550 -0.6250 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6320 -1.6770 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6020 1.2440 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0790 0.1920 -2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8080 1.7900 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 0.2590 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -5.2240 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 31 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 24 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 30 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 28 29 1 0 0 0 0 28 43 1 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 31 47 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END