IFLAB-ZINC00427367 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.7730 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0730 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.7720 -2.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -3.6000 -2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -4.0580 -4.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -3.5350 -4.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -2.7550 -3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -1.8450 -3.2750 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -2.3190 -4.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -1.6400 -4.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 -0.9070 -4.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -1.8460 -6.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5760 -1.2200 -6.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3690 -1.3500 -7.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5060 -0.6800 -7.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6810 0.0500 -6.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 -0.1600 -5.0780 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1650 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6250 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -3.8530 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9850 0.2700 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -0.5190 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.0170 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -3.8370 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -4.7330 -4.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 -3.4000 -4.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -2.0150 -5.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 -2.4320 -6.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2350 -0.7200 -8.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5400 0.6660 -5.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 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 M END