CHEMBRIDGE-ZINC04181844 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -2.4880 -2.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -3.8310 -2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 -4.6910 -1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -6.0570 -1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -6.5800 -2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -5.7400 -3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -4.3550 -3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -3.4510 -4.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -2.2480 -4.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -8.0470 -3.0990 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3700 -8.7910 -2.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -8.5090 -4.0780 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -4.2920 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -6.7230 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -6.1520 -4.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -3.9600 -5.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -3.3270 -6.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END