CHEMDIV-ZINC06798726 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -0.1480 -1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 -0.5080 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -1.1510 -0.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 -0.1120 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4520 -0.6190 -2.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5320 0.2040 -2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -1.8790 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -2.6930 -3.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 -3.8950 -4.1840 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -4.0610 -4.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3230 -2.6300 -3.2770 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -5.1940 -4.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7540 -6.3780 -5.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9360 -7.1530 -5.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1190 -6.6880 -4.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6770 -5.3450 -4.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4130 -4.5240 -3.7480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -1.2820 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -1.7400 2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -1.4190 3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -0.6390 3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -0.1780 2.4850 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 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 0.3660 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 0.9750 -2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -0.5340 -3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9600 0.8200 -2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3060 -0.4430 -1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1350 0.8450 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -6.0790 -5.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2550 -6.9910 -4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0860 -6.8640 -6.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7850 -8.2300 -5.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0230 -6.5830 -5.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2830 -7.3880 -3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -1.5330 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -2.3490 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -1.7770 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.3890 4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 0.4340 2.5960 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 4 1 0 0 0 0 2 22 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 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 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 M END