CHEMBRIDGE-ZINC00463853 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0300 1.4570 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.0050 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.5920 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 0.0760 -1.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -2.0960 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -2.5160 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -4.0440 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -4.6030 -2.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -4.1950 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -2.6650 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -5.4740 -3.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -6.0010 -3.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -5.7850 -4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -6.5730 -5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -6.8860 -6.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -7.7030 -7.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -7.9920 -8.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -7.4750 -8.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -6.6660 -7.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -6.3630 -6.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 -7.7910 -10.0690 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5050 -8.5030 -10.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -7.3380 -10.1950 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9920 1.8360 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 1.8150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.8100 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -2.4800 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -2.1530 -3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -2.0910 -2.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -4.3510 -3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -4.4010 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -4.6020 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -4.5650 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -2.3470 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -2.3010 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -5.3830 -4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -6.9750 -5.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -8.1080 -7.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -8.6230 -9.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -6.2670 -7.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -5.7270 -5.9830 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 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 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