IBS-ZINC01303001 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 1.2360 1.3860 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -0.0720 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -0.8120 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.1080 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -2.0920 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -0.8420 -1.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -3.1860 -1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -2.9970 -2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -1.7340 -3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.6620 -3.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -1.8170 -5.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -3.0690 -5.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 -3.2780 -6.8430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -2.3320 -7.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -1.0100 -7.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -0.6740 -5.9520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5890 -0.0820 -5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 0.1900 -5.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 1.5670 -5.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 2.3600 -5.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 1.7760 -4.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 0.4000 -4.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -0.3940 -5.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 0.0000 -8.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -0.2950 -9.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 1.2980 -8.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 2.2730 -9.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -2.7160 -9.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -4.2330 -4.2110 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 1.4790 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 1.8520 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 1.8830 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -0.4690 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -2.9540 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -4.1730 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 2.0230 -5.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 3.4360 -5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 2.3960 -4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6710 -0.0570 -4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 -1.4700 -5.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 2.1280 -9.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 2.1620 -9.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 3.2720 -8.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -3.8020 -9.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -2.2950 -9.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -2.3280 -9.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 M END