IBS-ZINC05157549 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 0 0 0 0 0 0999 V2000 1.6730 -2.3560 -5.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -2.9750 -4.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 -4.2960 -4.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -4.9010 -2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -4.1830 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -2.8730 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -2.2500 -3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 -2.3820 -1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -1.4520 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -3.3260 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -4.4480 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -5.5550 0.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -6.6780 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -6.8440 -0.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -7.7690 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -10.1220 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -11.4260 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -10.0680 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -8.7990 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -12.5090 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -12.4590 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 -12.3900 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3540 -12.3170 -2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3670 -12.3120 -1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -12.3880 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 -12.4600 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -3.1370 1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -4.0060 1.8610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 -1.8700 1.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -1.5720 2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -2.5540 -6.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 -1.2730 -5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -2.7610 -6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -4.8770 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -5.9340 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -1.2310 -3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -5.4860 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -7.9670 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -7.4220 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 -9.9000 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -10.2890 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -11.7400 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -12.2240 1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -9.9130 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -10.3480 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -8.0010 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -8.4970 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -13.3120 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -12.7270 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 -12.3920 -3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6080 -12.2660 -3.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4070 -12.2560 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8430 -12.3940 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4890 -12.5210 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -2.2210 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -1.6760 3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -0.5340 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -8.9920 0.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -11.2320 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4490 -10.9740 0.6950 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 58 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 58 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 59 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 59 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END