IFLAB-ZINC04087172 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 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 1.7250 -1.1860 1.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -0.1910 2.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -0.6500 3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -0.3910 4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -0.9930 5.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -1.6820 5.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -1.6200 3.5390 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -2.4130 6.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -1.9600 8.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -0.8760 7.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 -2.6660 8.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 0.4160 5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -0.1170 5.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 1.7490 5.3780 N 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 0.3560 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -3.4830 6.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -2.2270 5.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -1.7850 9.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -2.9390 7.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 0.1080 7.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -1.0200 7.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -2.6160 7.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1140 -3.7060 8.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -2.2320 9.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 2.1740 5.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 2.2830 5.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -1.9150 7.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 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 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 38 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 M END