CHEMBRIDGE-ZINC04685489 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8250 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -2.6730 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.0430 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -4.5700 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -3.7300 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -2.3560 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -1.5280 3.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -2.1430 4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -4.9630 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -6.1390 -2.5960 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4550 -6.8530 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -6.8920 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -7.7960 -2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 -9.0940 -2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -9.9230 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 -9.4550 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -8.1580 -0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 -7.3300 -1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -5.3280 -3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 -5.8010 -4.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -5.0580 -5.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -3.8420 -5.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -3.3690 -4.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -4.1100 -4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -2.2640 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -5.6400 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -4.1440 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -2.7750 4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -2.7500 4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 -1.3710 5.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -5.8970 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -4.4880 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -7.4900 -4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -6.1780 -3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -9.4600 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -10.9360 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -10.1020 0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 -7.7920 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -6.3180 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -6.7520 -3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -5.4280 -5.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -3.2620 -6.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -2.4190 -5.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -3.7380 -3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -5.2420 -1.5690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -4.3870 -1.9800 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 13 53 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M END