CHEMBRIDGE-ZINC00461485 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 0.1040 1.4210 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -0.0850 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -0.7860 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -2.1660 -0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.8510 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -2.1450 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.7640 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -0.0100 2.0570 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5370 -0.4340 2.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 1.0340 2.4890 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0080 -4.2490 0.1050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -4.8960 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -4.2670 2.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -6.3040 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -6.9550 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -8.3660 2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -9.1340 3.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -10.4780 3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -10.8030 2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -9.4120 1.1300 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 1.8110 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 1.7800 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 1.7620 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -0.2530 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -2.7130 -1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -2.6740 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -4.7530 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -6.8620 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -6.3980 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -8.7250 4.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -11.2190 4.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -11.8110 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END