IBS-ZINC02306358 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.1320 1.1120 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -0.4050 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -0.7470 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -0.9000 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -1.8240 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 -2.2790 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -1.8100 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -0.8830 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -0.4340 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 -2.2560 0.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0590 -1.7290 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4320 -2.3340 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6510 -3.1380 0.1960 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4160 -1.9830 1.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7170 -2.4590 1.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5360 -2.7200 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8210 -3.1920 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3000 -3.4050 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4850 -3.1450 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1900 -2.6640 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9940 -3.3730 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2450 -3.8360 -1.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.9440 -4.0700 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3270 -3.9100 -2.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3210 -4.2980 -3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0820 -4.2530 -5.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8540 -3.8240 -5.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8630 -3.4380 -4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0830 -3.4740 -3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3180 -3.1570 -2.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 1.4700 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 1.3560 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 1.5900 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -0.8830 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -1.8280 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -0.3890 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -0.2690 2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -2.1890 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 -3.0000 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1840 -0.5160 1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 0.2830 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -1.9710 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1270 -0.6460 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2230 -1.3990 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1680 -2.5560 3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4540 -3.3930 3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3040 -3.7740 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5560 -2.4570 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2780 -4.6330 -3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8550 -4.5550 -5.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6800 -3.7940 -6.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9110 -3.1060 -5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 30 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 M END