IBS-ZINC04936094 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 0.3890 0.8930 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -0.5060 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -1.0200 1.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -0.2680 2.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.7050 3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -0.0310 4.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -0.9230 5.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -0.7990 7.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -1.9060 8.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -3.1020 7.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -3.2400 6.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -2.1220 5.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -1.9900 3.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -1.2690 -0.9150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -1.6090 -1.5720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -2.3910 -2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -1.7950 -3.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -2.5700 -4.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -3.9500 -4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -4.5420 -3.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -3.7750 -2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -6.3340 -3.7210 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -6.6200 -2.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -6.8130 -4.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 1.0060 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 1.1020 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 1.6180 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 0.6840 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 0.1270 7.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -1.8330 9.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -3.9430 8.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -4.1570 5.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -0.7170 -3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -2.0980 -5.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -4.5630 -5.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -4.2480 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -6.5070 -4.4590 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 37 1 0 0 0 0 M CHG 1 37 -1 M END