OTAVA-ZINC01290727 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.6850 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -0.0890 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0150 -0.9970 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 -2.3360 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 -2.4310 -0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5460 -3.2960 -0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8250 -2.9980 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2580 -1.7500 -0.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4100 -0.7300 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0060 0.9280 -0.0680 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7890 0.6220 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5250 1.9370 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9040 2.9790 -0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8720 1.9560 -0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5510 3.1690 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8400 3.2990 -0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3170 4.5290 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3860 5.4850 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8050 4.7080 -0.0930 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9880 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 0.9850 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5480 -3.8000 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0690 0.0500 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0530 0.0580 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3690 1.1230 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3760 4.7450 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5700 6.5500 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 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 31 1 0 0 0 0 9 10 1 0 0 0 0 9 15 2 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 M END