IBS-ZINC05235346 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.8490 3.4150 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 3.0290 1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 4.8960 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 4.9200 1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 6.3550 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 6.3780 3.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 6.5630 4.7260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4800 5.7620 5.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 6.5160 5.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 6.3140 4.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 6.2390 3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5670 6.0730 2.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6530 6.2190 4.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 6.6460 6.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 6.7080 7.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 6.7180 7.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 7.7070 8.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 7.7350 9.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 6.8490 9.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 5.9020 8.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 5.7940 7.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 7.8980 4.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 8.9680 5.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 10.1970 5.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 10.3510 5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 9.2820 4.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 8.0510 4.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 6.9970 3.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 7.2560 3.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 11.2500 6.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 12.4860 6.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.3850 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 4.0670 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 3.7170 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 3.6240 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 1.9840 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 3.1160 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 5.2700 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 5.5270 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 4.2890 1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 4.5450 2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 6.9860 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 6.7300 1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 6.7990 8.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 8.4360 8.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 8.4940 10.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 5.1980 8.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 5.0130 6.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 8.8480 5.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 11.3080 5.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 9.4020 4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 8.0530 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 7.5630 4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 6.3520 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 13.2410 6.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 12.3460 6.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 12.8130 5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 3.5180 0.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 58 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 58 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 58 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 30 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M END