IBS-ZINC02093775 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 0 0 0 0 0 0999 V2000 -1.1770 2.5480 1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 1.2150 0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 0.4240 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -0.9100 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -1.6890 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 -1.6290 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4750 -2.3680 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2560 -2.3060 -1.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7780 -3.1380 0.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 -3.2420 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -2.5360 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -2.6470 2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2110 -3.4580 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 -4.1540 3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -4.0440 2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7740 -5.0330 4.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -1.9650 2.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -1.5860 3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -1.7580 4.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -0.9470 3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -0.6140 5.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 0.0080 5.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1860 0.8060 6.8120 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 1.2580 6.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 1.6770 7.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -0.3900 8.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -1.0600 8.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 -1.9980 9.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -2.2670 10.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -1.5960 9.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -0.6550 8.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -3.2910 11.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 3.1120 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 3.1220 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 2.3610 2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 1.4020 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 0.6420 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 0.2360 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 0.9970 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -0.7220 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -1.4830 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 -1.0170 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -3.5480 4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2060 -4.5920 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3310 -4.4490 5.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 -5.8620 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -5.4230 5.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -1.6370 3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -0.0320 3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 0.0760 5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4130 -1.5290 5.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 -0.0480 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -0.8500 7.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 -2.5220 9.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -1.8060 10.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -0.1280 8.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -2.8030 12.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -3.7550 11.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -4.0540 10.9870 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 1 0 0 0 0 2 36 1 0 0 0 0 2 37 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 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 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 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 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 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END