OTAVA-ZINC06143543 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -0.1480 1.6330 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 0.1070 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -0.4050 -1.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -1.7540 -1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.5700 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -3.9220 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -4.5250 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -3.7000 -2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -2.3180 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -4.7160 -4.1550 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -6.1550 -3.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -5.8330 -2.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -7.4500 -3.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -8.6690 -2.8250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6760 -8.7660 -2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 -9.8200 -3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -9.2840 -4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -7.8140 -4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9210 -7.0480 -5.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -9.9820 -5.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -11.2440 -3.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -11.8660 -3.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -11.9240 -3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -13.2470 -2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -13.8760 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -13.1980 -2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -11.8860 -3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -11.2440 -3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1050 -13.9970 -2.7670 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -8.6310 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 -9.0130 -0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -8.9790 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -8.5630 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -8.1820 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 -8.2200 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 2.0430 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 1.9190 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 2.0240 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -0.1790 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -0.3030 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -2.1260 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.5400 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -1.6870 -3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -9.4320 -6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -13.7760 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -14.8980 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -11.3630 -3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -10.2200 -3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -9.3380 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 -9.2760 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -8.5360 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 -7.8570 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 -7.9260 -2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 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 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 33 34 2 0 0 0 0 33 51 1 0 0 0 0 34 35 1 0 0 0 0 34 52 1 0 0 0 0 35 53 1 0 0 0 0 M END