CHEMBRIDGE-ZINC04754228 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.5540 0.3370 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -0.1600 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -0.0510 -1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 0.5700 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 1.0890 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 0.9560 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 1.7100 0.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 2.8430 -0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 3.5840 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3770 4.7960 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 5.5100 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 5.0050 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 3.7930 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3900 3.0800 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9220 5.7790 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 5.3690 0.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0910 6.2200 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2400 5.8090 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3610 6.6380 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3380 7.8830 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2000 8.3140 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0850 7.4610 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1680 9.6620 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0740 10.0050 1.9880 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5140 -0.5840 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -0.3810 -3.7220 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0920 0.2400 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -0.6400 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 0.6510 -2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 1.3410 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 3.2960 -1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 5.1940 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 6.4530 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4420 3.4010 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3240 2.1350 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9190 6.7330 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2570 4.8390 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2510 6.3170 -1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2150 8.5260 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1970 7.7710 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2340 10.3530 1.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -1.1900 -2.7760 O 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 25 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 2 0 0 0 0 25 26 1 0 0 0 0 25 42 2 0 0 0 0 M CHG 1 24 -1 M CHG 1 26 -1 M END