CHEMBRIDGE-ZINC04095360 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.6890 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 0.0160 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -0.6630 -3.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -2.0460 -3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.7570 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -2.0830 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.8030 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -3.8390 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -4.2390 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -3.4600 1.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -2.6050 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -5.3370 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -5.6430 2.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 -6.6640 3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 -7.3880 2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -7.0860 0.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 -6.0620 0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -8.3940 2.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -9.0970 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -2.7670 -4.2760 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9560 -2.1430 -5.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -3.9850 -4.2860 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.4990 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 1.0960 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -0.1130 -3.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -3.8360 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -4.2570 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -1.8600 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -5.0810 3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3140 -6.9010 4.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0840 -7.6500 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -5.8240 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 -8.4000 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5160 -9.5550 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9240 -9.8720 1.8820 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 28 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 38 1 0 0 0 0 21 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