IBS-ZINC02265854 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.4130 1.8250 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 0.3210 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -0.3940 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -1.7890 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -2.4590 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -1.7570 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -0.3630 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 0.3850 -2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 1.6000 -2.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 0.3210 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 0.0900 3.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 0.9790 4.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.7260 3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 1.3050 2.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 2.7480 4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 3.3340 3.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 4.3060 4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 4.8290 3.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 2.9230 2.0790 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 2.1620 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2420 1.7610 1.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1700 0.9810 3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 1.2390 1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4430 1.2940 2.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 1.9000 3.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4390 0.6720 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 2.2520 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 2.1600 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 2.1510 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -2.3440 1.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -3.5360 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -2.2880 -2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -0.6410 3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 1.0650 5.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 3.0650 5.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 1.4360 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9150 -0.1810 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9790 0.3500 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.2800 -3.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 4.6210 5.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9660 5.2710 6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 0.2530 -4.4750 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 23 2 0 0 0 0 22 24 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 26 36 1 0 0 0 0 26 37 1 0 0 0 0 26 38 1 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 M END