CHEMBRIDGE-ZINC03880039 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1590 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4560 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -1.8360 -3.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -2.6060 -2.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -1.9960 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -4.0830 -2.2910 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8800 -4.6190 -3.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -4.7620 -1.4070 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3920 0.3790 -4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 1.2680 -5.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9650 1.4750 -4.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0670 2.3340 -3.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3740 1.7280 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 1.5220 -2.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4020 2.6040 -3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7160 3.4020 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0380 3.6670 -1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0470 3.1390 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7380 2.3440 -3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4190 2.0700 -3.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4620 3.4260 -2.2700 N 0 3 0 0 0 0 0 0 0 0 0 0 11.7360 4.1260 -1.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3520 2.9620 -2.9590 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.2370 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -2.3120 -4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -0.1650 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 1.3160 -4.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 2.2300 -5.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 0.6080 -5.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 0.5100 -4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4750 1.9500 -5.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 0.7670 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 2.3890 -1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 1.0460 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 2.4870 -2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9280 3.8150 -1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2820 4.2870 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5290 1.9340 -4.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1790 1.4460 -4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.7520 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7960 0.6630 -3.9110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -2.9830 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 46 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M CHG 1 24 1 M CHG 1 26 -1 M END