IFLAB-ZINC04496925 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4190 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0310 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6800 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -0.6510 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 0.0010 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9140 -1.1190 -0.5570 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0150 -1.1740 -1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2060 -2.3770 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 -1.9860 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -2.7630 0.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2200 -0.9280 0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3280 -1.4440 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2450 -2.0670 -1.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6720 -1.2480 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7370 -1.9180 -0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3800 -1.2120 -1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3570 -1.8260 -2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6920 -3.1460 -2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0500 -3.8510 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0760 -3.2360 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7380 -3.8040 -2.9990 N 0 3 0 0 0 0 0 0 0 0 0 0 14.3040 -3.1820 -3.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0330 -4.9660 -2.7880 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1690 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9750 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7590 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 0.7750 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 0.4290 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 -3.2230 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5770 -2.6160 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2870 -0.4310 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8860 -0.1820 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6570 -1.6880 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1180 -0.1810 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8590 -1.2750 -3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3110 -4.8820 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5770 -3.7860 0.3640 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 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 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END