IFLAB-ZINC04370314 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 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 -0.3810 0.0100 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 1.9060 -0.7740 1.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.6470 2.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -1.1320 3.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -0.5880 -1.4870 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -0.0070 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.2400 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 0.2470 -5.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -0.1150 -6.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.7910 -6.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -0.8630 -4.7800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 0.0750 -7.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 0.9070 -4.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 1.1020 -3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 0.6580 -2.3850 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 1.2460 -2.1170 3.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -0.4420 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -1.2020 4.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -1.2060 -6.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 1.6420 -2.9860 H 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 8 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 7 22 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 M END