IFLAB-ZINC00190352 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 0.2430 1.4920 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -0.0140 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.6770 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -2.0580 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -2.7800 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -2.1110 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -0.7300 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -4.1800 -0.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 -4.9810 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -6.2830 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -6.2630 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -5.0020 0.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -7.6270 1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -8.7810 -0.2670 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -7.6640 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -4.5610 -1.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -5.3330 -2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -6.3440 -1.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -4.9400 -3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -5.9620 -3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7350 -5.8070 -2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7380 -6.7450 -3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5360 -7.8380 -3.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 -7.9940 -4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 -7.0530 -4.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 1.8310 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 1.8480 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 1.8870 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.1150 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -2.5750 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -2.6700 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -0.2100 -2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 -7.6680 1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -7.8510 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -7.8990 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -7.7280 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -3.7130 -2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 -3.9630 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -4.8920 -4.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8930 -4.9520 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -6.6240 -2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3190 -8.5720 -3.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1750 -8.8480 -5.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -7.1720 -4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 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 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 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 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END