IFLAB-ZINC00956722 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.3630 1.3030 -0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.3300 -1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.3300 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -0.0150 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 0.9670 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 1.6200 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -0.7190 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 0.0020 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 -0.7660 0.0850 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2500 -0.4240 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6900 -2.2330 0.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 -2.8080 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 -4.5140 0.0940 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -2.0910 -0.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7040 -0.4040 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 -0.9130 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3110 -0.5830 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3880 0.2560 -3.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6240 0.7680 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7750 0.4400 -0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6820 1.5940 -1.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 1.4110 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 2.0690 0.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 2.0290 -1.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 3.4140 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 4.1900 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 5.5650 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 6.1200 -1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 5.2900 -2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 3.9810 -2.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 1.8200 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 0.0880 -2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -1.0890 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 1.2150 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 2.3800 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4850 -2.7770 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -2.5660 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 -1.5700 -2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1270 -0.9820 -4.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0450 0.5130 -3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9540 0.8410 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4810 2.5310 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2980 1.5090 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 3.7250 0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8450 6.1930 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 7.1900 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0280 5.7160 -3.4300 H 0 0 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 37 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 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 19 21 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 M END