IBS-ZINC02105819 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -0.6910 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 -2.1400 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -2.7440 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0450 -2.3350 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -4.2790 -0.1200 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3960 -4.6400 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -4.7580 0.8500 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2600 -5.7450 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -3.6730 1.9530 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6050 -3.9100 2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 -2.4500 1.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6870 -3.5610 2.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 -2.4480 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5340 -2.9390 4.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -4.3420 4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -4.7080 3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7950 -6.0010 3.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1200 -6.9240 4.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6050 -6.6190 5.1970 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 -5.3490 5.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3020 -5.0340 6.8070 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -4.7460 0.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 -5.8790 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4520 -6.8480 -0.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 -5.9420 -1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -4.6990 -1.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 -4.8140 -2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -4.5720 -1.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -5.2450 -3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -2.4640 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -2.4730 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -2.2770 3.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 -1.5400 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4830 -2.6210 4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -7.9640 3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 -4.1070 7.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5290 -5.7420 7.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5430 -5.1930 -1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 -6.9330 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3030 -5.7440 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -5.4160 -3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -4.4640 -4.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -6.1660 -3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 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 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 47 1 0 0 0 0 32 48 1 0 0 0 0 32 49 1 0 0 0 0 M END