OTAVA-ZINC06143829 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 65 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 0.1380 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -0.5010 3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -1.9030 3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 -2.6520 2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.0130 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.7480 0.1130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -4.1700 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5400 -2.5270 4.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -1.7810 5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -2.6160 6.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -3.9970 5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 -3.8800 4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -4.9690 3.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -6.1720 4.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -7.3420 3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -8.5600 4.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -8.6700 5.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -7.5620 6.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -6.2840 5.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -5.1870 6.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 -2.1950 7.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -2.0350 8.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 -1.9850 7.3490 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 -1.5640 8.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7140 -0.8150 8.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4540 -0.3750 9.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 -1.6060 10.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5430 -2.3550 10.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8030 -2.7950 9.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -0.4050 5.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4900 0.0930 5.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 0.2660 4.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 1.4830 4.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.2160 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -3.7310 2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -4.4890 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -4.6350 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -4.4710 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -7.2740 2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -9.4550 3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 -9.6490 5.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 -7.6620 6.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 -2.1130 6.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7960 -0.9060 9.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3560 -1.4720 7.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4540 0.0620 7.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3630 0.1580 9.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8120 0.2820 10.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4610 -2.2640 9.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3470 -1.2930 11.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8030 -3.2320 11.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 -1.6980 11.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8940 -3.3280 9.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4450 -3.4520 8.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 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 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 35 36 2 0 0 0 0 M END