IBS-ZINC05348357 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.0010 1.0990 2.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.3080 1.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.8900 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -0.1130 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -0.6800 1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -2.0560 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 -2.9200 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -4.1730 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -4.1380 0.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -4.8990 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -2.8450 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -2.2470 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -5.3730 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2140 -5.3390 0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -6.5100 -0.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 -6.5660 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -6.8380 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -7.8550 1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1530 -7.6910 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 -7.6670 -1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 -8.2660 -2.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 -8.2470 -4.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9010 -7.6260 -4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7980 -7.0230 -3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5560 -7.0510 -2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9140 -6.4120 -4.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7900 -5.8140 -3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1370 -7.6060 -6.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 -8.2440 -6.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 1.4360 2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 1.6230 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 1.3110 2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 0.9460 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 -0.0710 1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7570 -2.6350 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -2.8410 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -7.3630 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -5.6130 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -6.1950 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -8.0500 2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -8.4980 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 -8.5920 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1000 -7.6860 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 -8.7500 -2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 -8.7150 -4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2530 -6.5870 -1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1490 -6.5770 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2520 -5.0460 -2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6380 -5.3630 -3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4810 -8.1560 -7.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -7.7660 -6.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0980 -9.2980 -6.5870 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 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 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 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 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 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END