CHEMBRIDGE-ZINC02872794 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 0.2100 0.0620 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -1.4220 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -2.0160 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -3.4010 0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -3.6290 -0.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -2.3950 -1.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -2.1970 -2.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -1.3120 2.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7620 -0.3910 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -0.9790 2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -2.1830 3.4570 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -1.6470 4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -0.4440 4.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -2.5430 5.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -1.7020 6.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 -1.4430 6.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -0.6720 7.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -0.1580 8.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -0.4160 8.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -1.1850 7.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -1.4570 7.6030 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6330 -1.0960 8.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 -2.0420 6.6320 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2340 0.4330 -0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 0.2580 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 0.5690 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -4.1520 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -2.1360 -2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -3.0350 -2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -1.2710 -2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -1.9000 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -0.4690 3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -0.3300 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -3.1450 3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -3.2160 6.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -3.1280 5.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 -1.8440 6.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 -0.4700 7.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7970 0.4440 9.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -0.0160 9.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 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 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END