IFLAB-ZINC04354578 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 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 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5120 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -0.0620 1.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -0.5540 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -0.0460 -1.2580 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0830 1.0430 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.4660 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -0.6190 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -0.4570 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 -0.1340 2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 0.5640 1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2820 0.5630 2.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 -0.1260 3.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 -0.5630 3.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 -1.2530 4.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 -1.5310 4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -1.1450 3.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 -0.3320 4.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4570 -0.5280 4.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4480 -0.7300 5.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1320 -0.7370 6.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8230 -0.5420 6.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 -0.3340 5.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1020 -0.9360 7.3150 F 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 0.2690 -0.1150 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.6010 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 -0.1890 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -1.6440 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -1.7080 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -0.2570 -3.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -0.3010 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 1.0220 0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -2.0930 5.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7040 -0.5230 3.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4690 -0.8830 4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5780 -0.5480 7.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -0.1780 6.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END