OTAVA-ZINC01805172 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.1290 1.5830 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 0.0680 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.6500 -0.0410 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0700 -0.2750 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -2.1790 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -2.8020 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -0.3020 1.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 0.5010 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 1.0120 0.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 0.7170 2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 1.4700 2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 1.7820 4.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2430 2.5610 4.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 2.6090 5.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3780 1.8570 6.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 1.3630 5.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 1.4990 7.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 0.6790 8.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 0.3370 9.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 0.8110 10.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 1.6250 10.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6820 1.9700 8.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1800 2.2140 11.6160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -0.0950 3.8120 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -0.7250 2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -1.6580 2.8570 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 2.0420 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 1.9850 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 1.8870 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -0.1660 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -0.2960 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 1.9000 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8750 3.0440 3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1730 3.1310 6.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 0.2930 7.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -0.3000 9.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 0.5430 11.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5530 2.6070 8.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -2.6220 -0.9660 O 0 5 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 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 23 1 0 0 0 0 22 38 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 39 -1 M END