NIH-ZINC04039871 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 65 0 0 1 0 0 0 0 0999 V2000 -0.1210 1.4960 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 0.0260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -0.8320 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -2.1190 0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -2.0670 -0.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.8580 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 -0.7810 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -0.4180 -2.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.7090 -2.9540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -1.5430 -3.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -1.3120 -4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -3.3970 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.4700 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -0.6470 3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -1.2200 2.6780 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3160 -2.2100 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 -1.4350 3.9180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 -0.8830 5.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -0.8560 6.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -0.3410 4.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 0.2200 5.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -2.1380 3.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 -3.3150 4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5830 -5.4650 5.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0160 -3.4990 5.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -0.2980 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -0.6860 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 0.1690 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 1.4260 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3190 1.8170 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 0.9640 2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0820 2.1680 -1.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4610 3.4980 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 0.0680 3.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 2.0220 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 1.7340 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 1.8910 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.9030 -4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -0.6420 -4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -2.2730 -5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -3.8420 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -4.1180 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -3.2340 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 -1.4000 4.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7290 -2.4960 2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 -3.9520 4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 -2.9770 5.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -5.1950 6.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 -5.9770 5.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4520 -6.0970 5.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -2.6870 4.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9660 -3.1200 6.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8310 -4.2200 4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 -1.6480 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 -0.1410 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6610 2.7830 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 1.3090 3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 3.5040 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 4.0880 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8660 3.9660 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 0.3140 4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7230 -4.2020 4.7890 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.7730 -4.5000 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 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 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 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 62 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 62 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 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 56 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 34 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END