IFLAB-ZINC04496146 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.0140 1.5010 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -0.0060 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7130 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0950 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.7700 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.0630 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6810 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -4.5320 0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -4.8570 -1.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -4.8910 1.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -5.0090 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -6.5120 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -7.1940 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -7.0980 -0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -8.4900 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -9.3090 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -10.6820 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -11.2430 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -10.4290 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1860 -9.0540 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 -8.2600 -1.3600 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -12.5860 -0.4460 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.8780 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 1.8690 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.8450 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1860 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -2.6480 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.5900 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.1280 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1630 -4.6210 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -4.5970 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -6.5550 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -8.8730 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -11.3190 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 -10.8690 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 M END