CHEMBRIDGE-ZINC02847042 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.0250 1.4810 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 1.1980 -1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 0.5050 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 0.0940 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 0.3800 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 1.0730 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9260 -0.7900 -0.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1280 0.4960 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 1.8240 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6700 2.8300 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0230 2.5260 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4430 1.2160 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 0.1820 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9380 -1.2150 -0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1000 -1.5400 -1.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8220 -0.5410 -1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3950 0.2520 -2.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6160 -2.9270 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6970 -3.6990 -2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1780 -4.9900 -2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5800 -5.5200 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5030 -4.7590 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0290 -3.4640 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0950 -6.9060 -0.7530 N 0 3 0 0 0 0 0 0 0 0 0 0 10.1640 -7.5790 -1.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 -7.3750 0.3140 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9030 2.0260 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 1.5180 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 0.2840 -2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 0.0620 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 1.2960 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 2.0700 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 3.8610 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7520 3.3220 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 0.9860 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3410 -1.9870 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3820 -3.2870 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2410 -5.5890 -2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8180 -5.1770 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9740 -2.8690 1.1790 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 3 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END