IFLAB-ZINC00114515 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 0.0650 1.2440 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0060 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -0.5510 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 0.1540 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4110 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 1.9530 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 2.1280 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 3.4720 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 4.0680 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 4.2350 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 5.8180 -1.0560 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1420 6.6720 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3820 5.8000 -1.9420 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 4.2190 -1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 3.2580 -1.1930 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 -0.3780 1.1470 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 1.6640 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -1.5270 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 2.9290 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 1.6570 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 4.4180 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0310 7.6890 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4680 6.7060 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3890 3.6560 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8140 4.4020 -0.0380 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 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 M END