CHEMBRIDGE-ZINC00727280 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 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 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -0.8990 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -1.3450 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -1.3820 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.9740 -3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.5320 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.6550 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -0.3640 2.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -1.1680 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 -1.3170 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 -1.7940 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0200 -2.1270 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 -1.9770 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -1.4960 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4080 -2.6410 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0000 -2.7720 2.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0170 -2.9630 0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3900 -3.4710 0.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.9520 -2.9820 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3740 -4.9820 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0430 -3.1810 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3630 -2.7710 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9620 -2.5060 -2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2410 -2.6490 -3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9210 -3.0580 -3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3210 -3.3200 -2.4240 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 2.5510 -0.8700 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -1.6640 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -1.7300 -4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -1.0030 -4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -0.2170 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.7430 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -1.0590 3.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -1.9100 3.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8280 -2.2360 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -1.3760 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5440 -2.8580 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9020 -5.1910 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3960 -5.3600 0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8120 -5.4700 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9260 -2.6590 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9920 -2.1860 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7090 -2.4420 -4.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3580 -3.1710 -4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2890 -3.6360 -2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 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 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 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 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 M END