CHEMBRIDGE-ZINC04755995 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0780 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7740 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0650 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2450 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -4.8570 1.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.9920 -1.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4710 -5.3440 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -6.8320 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -7.4660 -2.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -7.3770 -1.4850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -6.3510 -1.1720 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9940 -6.4730 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -6.4490 -2.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -6.2220 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 -6.3120 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -6.6280 -3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -6.8530 -4.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -6.7600 -3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 -6.7240 -4.8290 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.2020 -6.5260 -4.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -7.0030 -5.9980 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0910 -8.8180 -1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -9.3610 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -11.5310 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -11.3210 1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -4.5720 -1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1600 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6180 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5950 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -5.9760 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -6.1350 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -7.1000 -5.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -6.9320 -3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -9.0020 -1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -9.3190 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -9.1770 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -8.8610 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -11.3540 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -11.1780 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -12.5980 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -10.8160 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -11.1360 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -12.3930 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -4.4000 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -10.8060 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 30 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 26 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 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 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 53 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 53 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 53 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END