CHEMDIV-ZINC06806231 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -0.9110 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -1.3690 2.2430 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 0.7520 -1.0100 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.5480 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 -2.0510 -0.6430 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -0.3400 -2.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -1.1530 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 -1.5030 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -1.9730 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0550 -2.1210 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4410 -1.7700 -2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1410 -1.2850 -2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5860 -2.0580 -3.6210 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.7860 -2.6190 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3120 -2.5670 -1.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0520 -3.0520 -2.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8000 -3.4500 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1420 -4.0600 -2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9400 -3.0280 -2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1190 -2.5940 -4.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7780 -2.0270 -3.5560 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 2.5540 -0.8730 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -1.6890 2.1650 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 0.2450 -1.0490 4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -0.2250 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.7520 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -1.3970 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -2.2380 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -1.0140 -3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2230 -4.1870 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9750 -2.5750 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9670 -4.9430 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7030 -4.3410 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8780 -3.4730 -3.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1480 -2.1610 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9440 -3.4540 -4.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6640 -1.8290 -4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9530 -1.1590 -2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1850 -1.7310 -4.4210 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 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 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 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END