IBS-ZINC04085522 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.1160 1.2000 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.3010 -0.0540 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4500 -0.8070 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.5260 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -0.5260 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -0.3210 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 0.0240 3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 0.2080 3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 0.0520 2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -0.2900 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -0.4790 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -0.8150 0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -0.7370 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -0.6190 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 -0.9260 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9650 -1.3410 0.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -0.6360 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 -0.7280 -2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 -0.3770 -3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1970 0.0720 -4.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 0.1680 -3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 -0.1850 -2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -0.1950 -1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 0.6550 -4.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -0.0390 -5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -1.2480 -6.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -2.2140 -4.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -2.6290 -4.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -1.3800 -3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 0.4180 -5.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 1.5940 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 1.3660 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 1.7090 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -0.6710 3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 0.1450 4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 0.4750 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 0.1980 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 -0.4100 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 -0.9930 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -1.0750 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -0.4470 -4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 1.1600 -3.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 1.3510 -4.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 0.6440 -6.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 0.4750 -4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -0.9150 -6.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -1.7540 -6.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -1.7200 -4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -3.0970 -5.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -3.2830 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -3.1580 -4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.8600 -2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -1.6720 -2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.3120 -6.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -0.4890 -4.6100 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 2 0 0 0 0 4 13 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 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 30 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 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 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 55 1 0 0 0 0 30 54 1 0 0 0 0 M END