NIH-ZINC04196855 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -1.4190 0.5360 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -0.8690 -1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -1.2180 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -2.5080 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -3.4500 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -3.1050 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -1.8130 -2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -1.4720 -3.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -2.4960 -4.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -1.9380 -6.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -0.7770 -6.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -2.7270 -7.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -5.0920 -0.2680 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -5.5040 0.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -5.8010 -1.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -5.0050 0.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -4.5960 -0.2340 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4810 -4.3130 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -5.7440 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 -5.9970 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 -7.0490 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5270 -7.8480 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 -7.5940 0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 -6.5390 0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 -3.4210 0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 -2.9700 1.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.9450 1.9240 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 1.1470 -1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 0.5200 -2.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 0.9580 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -0.4840 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -3.8400 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -2.8540 -4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -3.3230 -4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -3.6550 -7.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.3680 -8.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 -5.2250 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -5.3730 -2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 -7.2470 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2260 -8.6700 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 -8.2180 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 -6.3390 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -2.8740 -0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 -2.1220 0.4330 H 0 0 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 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 2 0 0 0 0 10 12 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 43 44 1 0 0 0 0 M END