IFLAB-ZINC04553697 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 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 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 0.7390 -2.0040 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.6230 -0.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.6650 -2.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -4.1300 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -4.6230 -3.5520 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0800 -4.2460 -3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -6.1300 -3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 -6.8840 -3.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -8.2490 -3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 -8.6040 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -7.1630 -3.5440 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -4.0220 -5.0220 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -4.5640 -5.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -2.6310 -5.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -4.7800 -6.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -5.9620 -6.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -6.3540 -7.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -5.4900 -8.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 -4.0890 -7.2320 S 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 0.5290 -0.3650 0.8850 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 0.1910 -0.1360 -2.1400 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 1.7280 -2.1700 -3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -4.4910 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -4.5070 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1720 -6.4610 -3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -8.9720 -3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -9.6200 -3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -6.5670 -6.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -7.2880 -8.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 -5.6290 -9.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 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 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 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 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 M END