IFLAB-ZINC04939608 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -0.0550 1.4050 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.0240 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.5960 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.1210 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -2.7330 2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -4.8220 3.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8460 -4.2050 3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -6.2120 2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5360 -6.0800 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -4.9820 1.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 -7.1830 1.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 -7.0680 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -5.9680 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7460 -5.8570 -0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 -6.8400 -1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 -7.9360 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 -8.0560 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0080 -9.0040 -2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9760 -8.6670 -3.8600 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3390 -10.2300 -2.3200 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 -9.1080 -3.5300 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -4.9450 4.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -4.5540 4.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 1.7860 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 1.7610 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.7580 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -0.2560 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.2840 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -2.4610 1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -2.4330 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -2.3940 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -2.4220 3.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -6.7100 3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -6.8010 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -8.0560 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 -5.2000 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4020 -5.0020 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4860 -6.7510 -2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -8.9140 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -4.1980 2.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -4.5340 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -5.4900 5.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -5.5470 6.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 6 40 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 M END