IBS-ZINC02238164 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 1 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 2.3970 0.0290 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1840 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 2.5030 -1.7340 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6810 3.3980 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 3.7250 -0.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3540 4.3880 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5200 4.4960 -1.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4300 3.8490 -2.5270 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6450 5.1620 -2.5950 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3670 4.4160 -2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3160 6.1140 -1.5950 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7020 7.0080 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6740 6.5050 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7930 7.4280 -2.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8860 5.7250 -1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8920 5.7340 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5600 5.2600 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4460 5.4220 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 4.9270 0.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1460 5.9450 -3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2200 6.9550 -3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7620 7.6730 -4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 7.3830 -5.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1530 6.3740 -6.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6190 5.6550 -5.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5340 4.6660 -5.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -0.8180 -0.0380 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 1.2220 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 3.1320 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 1.6030 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8240 4.7000 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7930 6.1980 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6760 5.0710 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0770 6.7470 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5310 4.7490 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0820 4.9580 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8540 7.1830 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0370 8.4620 -4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 7.9460 -6.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5170 6.1480 -7.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1450 3.7950 -5.3920 H 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 31 49 1 0 0 0 0 M END