IBS-ZINC05022877 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.1200 1.0740 1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.2720 1.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -0.7810 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -0.1160 0.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -2.1350 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -2.7950 -0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -2.1460 -0.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -2.8770 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 -2.2340 -0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -2.9600 -0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 -4.3260 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3510 -4.9680 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -4.2490 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 -5.2340 -1.0700 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -2.8720 -0.0090 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 -4.4310 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -4.8400 -0.9060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -6.0260 -1.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -6.4620 -1.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 -5.4440 -1.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 -5.4670 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2980 -6.1270 -1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6770 -6.1470 -1.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3280 -5.5110 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6000 -4.8530 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 -4.8340 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 1.3590 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 1.7670 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 1.1050 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -1.1890 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -1.1690 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 -2.4610 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -6.0330 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -4.7520 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 -6.6230 -2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2480 -6.6600 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4060 -5.5280 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1110 -4.3560 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -4.3240 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 25 2 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 M END