IBS-ZINC05026536 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 1.1090 -1.3160 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -0.1220 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -0.6140 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -0.7810 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 -1.1060 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 -1.2380 -0.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 -1.2530 -2.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -1.1100 -3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -1.2550 -4.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -0.8150 -3.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -0.6340 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -0.3610 -2.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -0.6870 -4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 0.5530 -5.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 0.6760 -6.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -0.4330 -7.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -1.6680 -6.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -1.7990 -5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -0.2940 -8.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -0.8930 1.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -0.5990 2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -1.0080 3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -0.7010 5.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -0.6010 7.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -0.9800 8.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -2.3970 8.5550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 -2.9100 7.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -2.5510 6.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -0.9600 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -1.9760 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -1.8630 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 0.4250 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 0.5370 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9640 -1.4680 -2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 1.4200 -4.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 1.6400 -6.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -2.5330 -7.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -2.7660 -5.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -0.4520 -8.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -1.0370 -9.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 0.7050 -9.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -1.2880 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -1.1570 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 0.4690 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -0.4500 3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 -2.0750 3.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -1.2590 5.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 0.3670 5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 0.4830 7.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -1.0520 7.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -0.6670 9.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 -0.4840 8.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 -3.9940 7.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 -2.4710 7.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -3.0350 6.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -2.8920 5.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -1.0930 6.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 M END