IBS-ZINC04090757 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 0.8120 -0.8830 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.5420 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 0.4700 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -1.5310 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -0.6330 -0.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7070 0.0360 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -0.2310 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -1.0810 -2.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 1.0730 -1.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 1.4620 -2.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4620 0.7440 -3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 2.8550 -3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 3.5730 -2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 2.8330 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 3.2610 -4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 1.4840 -2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8170 1.2030 -1.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -2.0090 0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -2.4220 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -1.6530 2.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -3.6880 1.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -4.6380 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -5.4330 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 -5.8600 0.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8110 -5.6730 2.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -5.1490 3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -4.1440 3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -3.6150 4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -4.0880 5.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -5.0880 5.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -5.6170 4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -0.7110 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -0.2510 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -1.9300 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -2.5430 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -1.2880 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -1.4660 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 1.7540 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 2.5430 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 2.1140 -4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 3.8250 -3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 3.2760 -4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 4.2530 -4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 2.5420 -5.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -2.6220 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -4.0910 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -5.3140 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5550 -6.2150 2.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -2.8350 3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -3.6770 6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -5.4540 6.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 -6.3970 5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 1.8150 -3.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9670 1.8150 -3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 53 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 53 54 1 0 0 0 0 M END