IFLAB-ZINC04568906 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.8320 3.3730 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 2.3220 1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 2.2220 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 4.5270 2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 4.6260 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 3.4760 4.8690 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0540 2.7170 5.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 4.8350 5.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 5.2400 5.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 6.8080 5.7530 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 6.8700 5.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 7.6240 5.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 7.1220 7.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 6.9300 8.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 7.2470 9.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 7.6970 9.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 7.7430 8.0850 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0760 3.1160 4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 1.8680 5.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8220 1.5340 5.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7640 2.4500 4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3560 3.7070 4.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 4.0370 4.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4580 4.4160 4.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5780 3.7330 4.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1230 2.3720 4.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 2.3950 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 3.6680 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 4.1070 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 2.6390 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 1.3480 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 1.8790 2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 1.5160 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 5.5010 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 4.2100 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 5.3330 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 4.9700 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 5.5770 5.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 4.7600 6.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 4.5890 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 6.5550 8.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 7.1380 10.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 7.9910 10.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 1.1530 5.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1360 0.5580 5.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 5.0120 4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8040 4.1490 5.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4500 3.7890 3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 3.3040 0.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 3.5450 3.4880 N 0 0 0 0 0 0 0 0 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 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 49 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 50 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 6 50 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 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 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 M END