CHEMBRIDGE-ZINC00107805 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 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 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1010 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0230 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.8290 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -3.1680 1.6720 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -4.0930 1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -4.6180 2.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -4.5500 3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -5.2620 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 -5.1120 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -4.3960 0.1700 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 -5.6430 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -5.4150 -2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9050 -5.9110 -3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -6.6330 -2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4050 -6.8630 -1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 -6.3660 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8890 -7.1630 -3.9290 N 0 3 0 0 0 0 0 0 0 0 0 0 6.5760 -6.9630 -5.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8950 -7.7990 -3.6710 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 -2.3340 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0300 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 -2.4300 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -3.7700 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.2660 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 -5.7860 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -4.8510 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 -5.7350 -4.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2970 -7.4280 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9100 -6.5420 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 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 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END