IBS-ZINC02219875 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 59 0 0 0 0 0 0 0 0999 V2000 1.1440 1.0660 3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 0.3220 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -1.1280 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -2.9720 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 -2.4060 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -3.5140 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 -2.3370 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -2.4850 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -2.8650 0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -1.9760 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -0.8050 0.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 -2.5200 0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 -1.6790 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5820 -2.1390 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6290 -1.2890 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9450 -1.7650 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2230 -3.1160 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1790 -3.9680 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8730 -3.4760 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8350 -4.3350 0.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0370 -5.3050 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 -3.9380 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -4.7240 -0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5370 -3.5010 1.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8580 -4.8560 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0230 -0.9940 1.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7810 0.3730 2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9800 -0.3430 1.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 1.0720 3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 2.1040 3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 0.6000 4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 0.3760 2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 0.8320 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2400 -1.1560 2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -1.6870 3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -3.6710 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -3.4930 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -1.8790 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 -1.6780 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -4.2410 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 -3.0950 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 -4.0430 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -1.6070 1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -3.2840 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -1.5380 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -3.2550 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -3.8260 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3940 -0.2530 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3640 -5.0110 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9360 -4.9810 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6310 -5.1080 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3490 -5.5350 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1120 0.4750 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3920 0.9090 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7380 0.8290 2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 -0.1530 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -1.8480 1.1290 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6810 -1.1520 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 57 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 57 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 7 57 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 47 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END