CHEMBRIDGE-ZINC04842731 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 0.7270 1.3710 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -0.0780 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.8530 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -2.2080 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -2.8000 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -2.0440 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.6940 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 0.1790 -2.7800 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -2.8140 2.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -4.2250 2.3760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2050 -4.7450 1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -4.5530 2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -4.7210 3.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -3.9780 4.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -6.1000 3.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -6.7440 4.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -8.2100 4.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -8.9440 6.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -7.2940 5.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -6.6470 4.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -6.4680 7.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 -7.4740 5.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -10.4640 5.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -8.5480 7.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 1.5630 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 2.0060 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 1.6680 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -0.3990 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -3.8400 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -2.5180 -2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -5.6310 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -4.0770 3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -4.1780 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -6.6680 2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -6.2060 5.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -8.2750 5.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -8.7170 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -7.1250 3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -5.5970 4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -6.1650 7.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 -7.0150 8.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -5.5400 7.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 -6.5060 5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5640 -7.9600 6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1260 -8.0880 4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -10.8160 4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -11.0180 6.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -10.7370 5.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -8.9170 7.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -8.9770 8.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -7.4690 7.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -8.6870 6.1050 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3760 -9.0510 6.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 -9.2950 5.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 23 1 0 0 0 0 18 24 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 19 52 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 52 1 M END