IFLAB-ZINC04271812 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 1.0990 1.3960 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 0.0150 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.6810 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 0.0060 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 1.3870 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 2.0860 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 3.4880 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 4.1860 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 5.5510 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 6.1990 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 7.4200 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 5.4710 -0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 4.1550 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 3.2390 -0.1840 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 4.5980 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 4.0370 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 2.8370 -0.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 4.8700 -0.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4580 4.3520 -0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5390 5.0620 -0.6560 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6800 4.4050 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5580 3.0760 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8440 2.6870 -0.6010 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 3.5200 0.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.0320 0.0470 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 1.9380 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -0.5230 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -0.5380 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 1.9220 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 6.1240 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 5.2140 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 5.2070 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 5.8300 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6360 4.9020 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3670 2.3640 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5640 2.5540 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 4.0180 0.3370 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 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 31 1 0 0 0 0 15 32 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 33 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 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 M END