IBS-ZINC03859927 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 3.2510 -2.0470 -3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -1.5220 -2.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -3.4840 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 -4.0940 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -2.9410 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -2.2200 -0.9320 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8110 -1.1350 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -2.5820 -1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 -2.0600 -0.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -2.1610 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -1.6310 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4680 -1.8210 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -2.8700 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3660 -3.0080 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2460 -2.1050 -0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7470 -1.0730 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3640 -0.9390 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 0.1630 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 1.0590 1.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 0.1290 1.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -0.7740 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -0.9070 1.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 1.0870 2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 1.6370 2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 2.5550 3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 2.9410 4.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 2.4130 4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 1.4980 3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 -2.5770 -3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -2.7310 -4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -1.2160 -4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -0.8810 -2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -0.9590 -3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -2.8030 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 -4.2250 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -4.9210 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -4.4750 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -3.2820 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -2.2590 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -2.1600 -2.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -3.6700 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 -1.5660 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -2.7460 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 -3.6120 -1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7500 -3.8250 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3170 -2.2080 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4470 -0.3770 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 1.3900 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 2.9720 3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 3.6540 5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2890 2.7090 5.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 1.0960 3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 -2.6640 -1.9440 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3610 -3.3110 -2.6190 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 32 1 0 0 0 0 2 33 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 53 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 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 53 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 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 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END