IFLAB-ZINC04367690 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -0.6910 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -2.1400 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1370 -2.4640 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -2.6760 -1.4430 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2390 -1.8480 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -3.5580 -1.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 -3.1280 -0.5200 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8740 -3.9370 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -2.7680 0.6930 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0090 -3.6630 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -1.8050 1.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -2.2890 2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -3.4780 2.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2790 -1.3490 3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -1.9530 -0.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -1.4470 -2.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 -0.3640 -2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 0.2270 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9710 1.2040 -2.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -0.3010 -0.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1960 0.0980 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8490 -1.3840 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 -1.8530 0.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -3.4410 -1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -3.8340 -3.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -1.2150 3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2630 -1.7680 4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -0.3860 3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -1.9110 -2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 0.0460 -3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 -2.8000 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -4.3280 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -4.3250 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 27 28 1 0 0 0 0 27 37 1 0 0 0 0 27 38 1 0 0 0 0 28 39 1 0 0 0 0 M END