OTAVA-ZINC01935719 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 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 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.0370 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.1080 1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 0.1040 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -0.0430 3.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 0.5250 2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 0.7280 4.0530 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4470 1.2080 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 1.4840 4.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 1.4460 6.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1100 1.7690 7.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5060 2.1510 6.0590 S 0 0 0 0 0 0 0 0 0 0 0 0 8.6220 1.8580 4.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0050 1.9390 3.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1690 1.6730 2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 1.3100 2.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 1.0780 6.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6640 0.1170 7.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 -0.2210 8.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 0.3920 7.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 1.3460 6.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 1.6960 6.4120 C 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.3400 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -2.4610 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -2.3980 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 -0.2390 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 1.4700 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1030 1.7930 8.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5150 1.7490 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 -0.3620 8.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -0.9660 9.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 0.1240 8.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 1.8210 6.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 2.4440 5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 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 20 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 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 37 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 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 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