CHEMBRIDGE-ZINC00456738 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 0.0240 1.5030 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.0040 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -0.6920 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -2.0740 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.7740 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -2.0800 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -0.6950 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -2.7610 -1.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1750 -0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -4.8500 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.0030 2.6360 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -6.1930 1.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -6.8680 2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -6.2670 3.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -8.3400 2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -9.0340 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -10.4080 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -11.0980 2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -10.4170 3.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -9.0420 3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -11.1640 4.7350 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0470 -12.3770 4.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -10.5660 5.7960 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6830 1.8720 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 1.8620 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 1.8650 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -0.1480 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -2.6080 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -0.1540 -1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -2.9630 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -4.6580 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -6.6720 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -8.4960 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -10.9460 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -12.1740 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -8.5120 4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 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 32 1 0 0 0 0 13 14 2 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 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END