IBS-ZINC02108431 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 65 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7220 -0.5640 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -1.1620 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -1.5460 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -2.1850 3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -2.3960 4.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -1.9980 5.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -1.3650 4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.1380 3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.5520 2.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -0.1830 2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -1.3980 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -0.5430 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -0.5470 -1.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -1.0560 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -1.4020 -3.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -1.1390 -1.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -0.5870 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -0.5630 0.6820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -1.7240 -1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -3.0760 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -3.6530 -2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 -2.8900 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -1.5460 -3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -0.9470 -2.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 0.4930 -2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 1.0080 -2.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 1.2360 -3.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 2.6660 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 3.2690 -4.7080 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8360 3.1280 -4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 4.7720 -4.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5240 4.9250 -6.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 3.6580 -6.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 2.6430 -6.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 -2.4990 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -2.8860 4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -2.1900 6.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -1.0610 5.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 -1.1320 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -2.4520 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 0.4770 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 -0.9700 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -3.6780 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -4.7060 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6490 -3.3500 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2250 -0.9540 -3.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 0.8240 -4.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 3.1660 -2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 2.7990 -4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 5.3640 -4.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 5.0650 -4.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 5.8290 -6.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 4.9220 -6.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3470 3.8120 -6.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 3.3870 -7.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 19 1 0 0 0 0 3 4 2 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 13 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 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 36 1 0 0 0 0 33 34 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 34 35 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 35 36 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 M END