IBS-ZINC01040354 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -0.8320 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 0.0610 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -2.1210 0.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -1.0640 -1.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 -0.0680 -2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 0.2730 -3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 -0.9650 -4.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 -1.8440 -3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 -2.2740 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6680 -0.6880 -5.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 0.0230 -5.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 0.2850 -7.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 -0.8070 -8.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -1.1160 -6.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 -1.8340 -6.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1790 -2.2280 -7.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6420 -1.9270 -9.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 -1.2300 -9.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 -2.4450 -10.5790 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 0.8320 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1370 -0.4810 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 0.7800 -3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0720 0.9250 -4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -1.3070 -3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0290 -2.7260 -4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 -2.8950 -2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 -2.8340 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 0.3700 -4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 0.8400 -7.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 -2.0730 -5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1040 -2.7810 -7.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 -1.0040 -10.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 -0.1210 -8.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 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 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 44 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 43 1 0 0 0 0 M END