IFLAB-ZINC04107782 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0100 -0.4080 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -0.5560 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -1.8260 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -2.0140 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -3.1590 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -3.3270 -2.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -4.0690 -0.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -3.8500 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -2.7800 1.6270 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -5.0400 2.3500 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -4.2560 3.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0710 -5.1220 5.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 -6.1660 4.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -4.7350 6.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 -5.5770 7.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -4.9240 8.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -5.2010 9.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -4.6030 10.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -3.7270 11.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 -3.4500 10.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -4.0530 9.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -3.1420 12.2480 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 -5.2740 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -0.6440 -1.4140 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 0.1880 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.7620 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -3.2790 3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -4.1350 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -3.9000 6.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 -6.5540 7.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 -5.6980 7.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -5.8840 8.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -4.8190 10.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 -2.7670 11.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -3.8410 8.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5780 -5.2670 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 -5.2950 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -6.1570 -0.2710 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 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 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END