CHEMBRIDGE-ZINC00315733 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2080 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3960 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 3.5640 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 4.1630 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 4.2480 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 5.5960 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 6.4390 0.0270 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 6.2790 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 7.7440 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 8.2660 -0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4280 7.9050 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9080 9.8070 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7050 10.1750 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 8.8800 1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5990 7.8250 1.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.1630 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1700 -2.7810 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -2.7630 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.5200 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 1.9400 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 3.7700 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 5.8010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 8.1080 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 8.0990 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4060 10.1980 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 10.1870 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 11.0190 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0330 10.3870 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4050 8.8500 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 8.8020 2.6030 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 27 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 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END