IBS-ZINC02266746 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0100 1.3120 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 0.0020 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -0.7360 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -1.8000 0.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -2.5690 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -3.6210 1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 -4.4040 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 -4.1380 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 -3.0780 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -2.3050 0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8780 -4.9710 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9150 -4.7220 0.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1000 -5.4460 0.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1280 -6.4790 1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2080 -7.1790 1.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3490 -6.9080 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6940 -7.4990 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2740 -8.5570 1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5860 -8.8760 1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3490 -8.1530 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7980 -7.1040 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4620 -6.7630 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6590 -5.7860 -0.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9450 -5.1390 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3870 -5.8610 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2060 -5.1150 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 -4.1920 -0.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 1.8630 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.8400 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.5500 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -1.1440 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -0.0480 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -3.8260 2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -5.2210 2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4970 -2.8690 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -1.4890 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -5.7890 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2300 -6.7260 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6860 -9.1240 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0320 -9.6960 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3850 -8.4150 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4000 -6.5480 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 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 3 32 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 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 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END