CHEMBRIDGE-ZINC04369945 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 1 0 0 0 0 0999 V2000 0.0220 1.4750 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -0.0450 0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7520 -0.4940 1.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7100 -1.5550 1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 0.4120 2.2730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3700 1.4510 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -1.5790 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -1.7350 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -0.8870 2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -0.0550 3.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -0.9940 3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 -1.4230 5.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -0.9120 6.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 0.0280 6.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 0.4590 4.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -0.0610 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 0.3940 1.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -0.2840 -0.7010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -0.4600 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.8830 -2.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 -0.3200 -1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -0.5530 -2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -0.5860 -3.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -0.3890 -3.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4190 -0.1570 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -0.1160 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7880 0.0540 -1.4160 N 0 3 0 0 0 0 0 0 0 0 0 0 7.7410 0.0230 -2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9610 0.2590 -0.2280 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0820 1.7260 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 1.8670 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 1.9160 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -2.2720 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -1.7370 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -1.3140 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -2.7790 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -0.5130 3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -1.4840 3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -1.3930 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -2.1570 5.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -1.2470 7.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 0.4270 6.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 1.1960 4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -0.7080 -3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7970 -0.7680 -4.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 -0.4160 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 0.0700 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 0.2240 1.9370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -0.1840 0.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 16 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 48 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 48 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END