OTAVA-ZINC06142188 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.2000 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0140 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.0950 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 2.1740 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 1.5830 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -0.8550 -0.0370 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -2.5600 -0.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6320 -2.7180 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 -3.5540 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 -4.3470 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -5.2450 1.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -3.9000 1.8630 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -2.8950 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -2.3430 1.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -4.4380 3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -3.9110 4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -4.4430 5.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -5.5020 5.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -6.0340 4.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -5.5020 3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 -6.1730 1.6940 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -7.4960 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -6.9500 3.1530 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -8.1290 1.2280 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -8.4280 3.0190 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -1.7670 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 3.1750 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3920 -4.2070 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4550 -3.0210 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -3.0850 4.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 -4.0310 6.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -5.9140 6.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -6.8610 4.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 3.5220 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 3.9740 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 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 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 39 40 1 0 0 0 0 M END