IFLAB-ZINC04280282 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -0.0990 1.1800 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -0.3370 0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1460 -0.8000 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -0.8750 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -0.6440 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 -0.1080 1.2690 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2510 0.9790 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -0.6480 0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -0.5260 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -0.7540 3.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 0.0440 4.8990 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1030 -0.1160 5.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -0.4220 6.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 0.2390 7.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -0.0650 8.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 0.5410 9.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 0.2320 10.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -0.6850 10.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -1.2910 9.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -0.9860 8.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -0.9980 12.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -1.0050 13.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.8340 13.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -1.2240 14.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 1.4350 4.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 1.4160 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 1.5630 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.6420 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -1.9620 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -0.5920 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -0.1920 3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -1.7270 2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2830 -0.1170 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 -0.1450 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -1.6140 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -0.5940 3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -1.8140 3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -1.5000 6.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -0.1810 6.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 1.2540 9.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 0.7050 11.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -2.0050 9.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -1.4600 7.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -1.2100 12.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -0.4390 14.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -1.1960 15.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -2.1950 14.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.6510 4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -0.3060 2.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 33 1 0 0 0 0 9 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 10 37 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 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 48 1 0 0 0 0 M END