CHEMBRIDGE-ZINC03105877 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -2.0420 1.4760 P 0 0 3 0 0 0 0 0 0 0 0 0 1.8670 -2.8310 0.0870 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -2.8570 1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 -2.2570 3.2900 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -4.0560 3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -4.5810 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -3.8160 1.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 -5.9000 2.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -6.4100 1.5340 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2370 -5.6800 1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 -7.7260 2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 -7.4680 3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 -7.5350 4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 -7.2990 5.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 -6.9960 5.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7780 -6.9300 4.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0960 -7.1700 3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -6.6460 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -6.4120 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -2.7460 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -3.9160 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -2.3950 2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -4.2960 4.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -4.5180 3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -6.5120 3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -8.4260 2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6850 -8.1500 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -7.7720 4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -7.3510 6.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6440 -6.8100 6.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8310 -6.6920 4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6170 -7.1220 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5320 -7.1150 -0.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 -7.2510 -1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 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 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 41 42 1 0 0 0 0 M END