IFLAB-ZINC04940738 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0090 1.5200 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0090 0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3780 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5240 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -1.2150 -0.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -0.2170 1.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -0.6130 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -1.8230 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -2.2130 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 -1.3960 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 -0.1870 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5610 0.2010 1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5380 -1.7810 0.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4940 -0.8910 1.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -0.4780 -1.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -0.2320 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 0.4460 -2.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -0.8060 -3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -0.7120 -4.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -1.3380 -5.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 -2.0700 -5.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -2.1730 -3.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -1.5520 -3.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -1.4250 -1.2760 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -0.6460 -0.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 -2.7150 -0.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 1.8930 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.8890 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 1.8700 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 0.2790 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -2.4580 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 -3.1540 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 0.4480 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2890 1.1400 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2630 -0.7460 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4560 0.0680 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4920 -1.3180 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.1450 -5.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -1.2580 -6.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -2.5570 -5.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9660 -2.7420 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 24 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 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 M END