NIH-ZINC04019711 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.6640 1.7530 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 0.2400 -0.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4400 -0.2550 1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -0.1400 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -0.5820 1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -1.1430 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -1.2700 3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -0.8300 2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -0.9830 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -1.6640 3.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -0.2670 1.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7660 -0.9810 1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 -2.4200 1.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1500 -2.5320 -0.3140 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7510 -2.0010 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -1.9230 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 -0.4280 0.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5320 0.0400 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -4.0080 -0.7140 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5970 -4.0890 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -4.6980 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -5.4890 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -4.3750 1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -3.2990 2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -3.0220 3.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -5.2040 2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -5.0840 3.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -6.0980 3.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 -4.0920 -1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 -6.0870 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1820 -2.8220 0.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 -0.4180 1.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -1.8190 4.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 0.5640 -0.6030 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -0.0400 -1.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 2.2410 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 2.1190 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 1.9750 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 -0.4870 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -1.4820 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -2.4320 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -2.0430 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -3.5870 4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -6.2480 3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -6.5910 4.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 -4.3030 -2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -3.0140 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1820 -4.5640 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8240 -6.4690 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -6.3670 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 -6.5110 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 -2.7050 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 0.7860 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -1.1780 5.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 0.2000 -2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 -4.6230 -0.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 35 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 32 2 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 56 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 56 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 56 1 0 0 0 0 31 52 1 0 0 0 0 33 54 1 0 0 0 0 35 55 1 0 0 0 0 M END