IBS-ZINC02140162 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 1 0 0 0 0 0999 V2000 0.0320 1.5350 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 0.0050 0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9960 -0.3660 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -0.5300 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 -1.4190 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -1.6810 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -2.5060 2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 -2.5100 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -1.7380 5.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -0.9120 4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -0.8880 3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.2030 2.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 0.4200 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -2.0050 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3050 -1.8480 -1.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5330 -2.6160 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -0.4870 -1.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 0.1380 -2.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 1.2600 -2.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.6150 -3.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -1.8550 -2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -2.7610 -3.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -0.1930 -4.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 1.0250 -4.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 1.4380 -6.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 0.6380 -6.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 -0.5760 -6.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -0.9910 -5.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 1.1600 -8.4650 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 1.8960 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.9100 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 1.8900 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -3.1110 2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 -3.1350 4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -1.7820 6.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -0.3150 5.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 -1.4800 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -3.0620 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 1.6490 -4.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 2.3850 -6.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -1.1990 -6.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -1.9360 -4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 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 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 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 41 1 0 0 0 0 28 42 1 0 0 0 0 M END