IFLAB-ZINC04223547 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 0.3610 1.2590 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.2470 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -0.6330 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -2.2490 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -2.6340 2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -1.9170 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -0.8050 3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.1600 5.1200 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -1.3200 5.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 -2.2140 4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 -3.2740 5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -3.4590 6.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -4.0020 4.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 -5.0370 4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -1.3400 7.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -0.4610 8.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 0.5190 7.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -0.8480 9.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -0.1850 10.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.7500 11.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -0.1290 12.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 1.0630 12.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 1.6360 12.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 1.0170 11.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -0.2120 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 1.5310 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 1.5880 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 1.8270 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -0.7410 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -0.3590 -1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -1.7100 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -0.1160 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -2.5810 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -2.6850 1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -3.7190 2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -2.3890 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 -5.7640 5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 -5.5500 3.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 -4.6110 5.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.1020 7.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -1.9370 9.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -0.5970 9.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -1.6760 10.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -0.5720 12.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 1.5470 13.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 2.5680 12.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 1.4830 10.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -0.4970 2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 0.8760 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -0.7310 1.0890 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7320 -0.3460 1.0950 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 29 1 0 0 0 0 2 50 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 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 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END