NIH-ZINC06528610 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.7480 1.6250 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 0.2160 1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -0.8410 2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -2.1290 2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -2.2910 0.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -1.2540 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -0.0250 0.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -1.4790 -1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -3.2210 2.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.7440 2.3040 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -5.6340 3.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -4.6640 1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 -5.1110 1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -5.7200 2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -6.0100 1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -5.6880 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 -5.0770 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -4.7950 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2410 -5.9790 -0.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -6.2990 -1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 -6.1800 -2.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 -6.7900 -2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6140 -6.9330 -3.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7460 -7.3780 -4.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7850 -7.6920 -3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7650 -7.5820 -2.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6230 -7.1220 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5620 -7.0020 -0.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9250 -7.9500 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9320 -8.3680 -2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3460 -8.2850 -3.8190 S 0 0 0 0 0 0 0 0 0 0 0 0 10.0450 -7.8780 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 1.8580 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 2.3190 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 1.7180 3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.6740 3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -1.4260 -1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.7110 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -2.4610 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -3.0950 3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -5.9700 3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -6.4850 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 -4.8250 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -4.3240 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -5.9510 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 -6.6840 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9060 -8.6920 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7280 -8.8260 0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0820 -7.6830 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4120 -7.0750 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 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 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 2 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 M END