CHEMBRIDGE-ZINC01149965 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 -1.0780 3.0600 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 1.6090 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 1.5760 -1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 0.9690 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 0.8880 2.4730 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8300 1.8800 2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 0.3720 3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -0.6500 4.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 1.0480 3.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 0.4930 4.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -0.0210 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 0.1130 3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 0.9870 4.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -0.8030 3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -0.9480 2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6090 -1.8060 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9770 -2.5260 3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 -2.3830 4.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1770 -1.5320 4.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 -1.3860 5.6360 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8050 -1.9230 6.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -0.7290 5.6510 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.0400 -3.3700 3.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3620 -4.0770 4.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 -1.9480 0.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 -1.1790 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 3.6140 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 3.5150 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 3.0830 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 1.0540 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 2.1310 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 0.5430 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 2.0320 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -0.0340 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 1.5740 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 0.4300 5.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 -0.5040 4.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 1.1350 4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -0.7180 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -0.3880 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 -2.9420 5.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5130 -4.6920 4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5900 -3.3640 5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2290 -4.7140 4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5290 -1.3860 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9320 -0.1180 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 -1.4460 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 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 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END