OTAVA-ZINC05549785 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8250 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -2.6730 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.0430 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -4.5700 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -3.7300 2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -2.3560 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -1.5280 3.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -2.1430 4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -1.0760 5.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 0.0900 5.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 -1.4230 6.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -0.3430 7.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0840 -0.9200 8.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 -2.1220 8.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6220 -0.0990 9.4330 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3220 -0.6590 10.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8330 0.4780 11.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5530 -0.0980 12.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9120 -0.3460 12.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5770 -0.8740 13.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8820 -1.1570 14.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5150 -0.9090 14.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 -0.3730 13.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8280 -1.1850 16.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4270 -0.9040 16.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5350 -1.6780 15.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9380 -1.9080 15.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -2.2640 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -4.7020 -0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -5.6400 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -4.1440 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -2.7750 4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 -2.7500 4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0500 0.2830 6.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 0.2580 7.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 0.8620 9.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6370 -1.2850 11.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 -1.2610 10.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5190 1.1040 10.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 1.0800 11.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4540 -0.1250 11.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6380 -1.0670 13.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7950 -0.1750 13.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 0.1580 15.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -1.4860 15.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 -1.1710 17.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3340 -2.3230 16.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1100 -2.6100 14.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4400 -0.9650 15.5680 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 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 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 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 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 M END