CHEMBRIDGE-ZINC02983177 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.4050 1.8050 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 0.3150 -0.1880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9810 0.1560 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -0.2410 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -1.0560 -1.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -0.3850 1.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -0.2860 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 0.4050 2.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -1.0700 3.3740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9610 -2.0390 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -0.2250 3.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -0.8490 5.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -1.8990 4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 -2.4820 5.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9830 -2.0160 7.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -0.9770 7.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -0.3930 6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 -2.5770 8.1490 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -1.2900 4.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -2.3910 5.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -3.3420 5.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -2.4090 6.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -3.6500 6.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -3.7130 7.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 -2.5380 8.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -1.3000 7.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -1.2320 6.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 1.9820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 2.3330 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 2.2670 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -0.9820 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -0.0210 3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 0.7640 4.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -2.2730 3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 -3.2980 5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -0.6310 8.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 0.4140 6.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -0.5840 4.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -4.5720 6.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -4.6770 8.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 -2.5870 9.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -0.3870 8.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 -0.2560 6.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 0.1670 -2.5600 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 44 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 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 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 M CHG 1 44 -1 M END