IBS-ZINC02139939 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0010 0.5900 0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 1.6440 3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 2.8210 3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 2.6440 3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 3.2210 4.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 2.9930 4.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2970 2.2120 3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5710 1.6330 2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 1.8980 2.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 1.3420 1.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4790 0.2510 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 1.9040 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 3.3280 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 3.7680 0.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 4.2100 -1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0090 3.7340 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 4.6080 -2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 5.9610 -2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 6.4350 -2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 5.5660 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 6.1030 -0.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8050 6.9070 -3.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8000 6.4780 -4.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 0.7960 1.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4290 0.4210 1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6360 2.1150 3.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7900 2.9190 5.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 3.4770 5.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -0.4150 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 0.8750 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 0.6540 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 1.8010 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 0.6850 3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 2.8820 4.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 3.7640 3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 3.8170 5.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 1.2940 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 1.8600 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3040 2.6890 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3750 4.1980 -3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 7.4840 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 5.3590 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1110 7.3490 -5.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 5.7340 -5.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6830 6.0950 -4.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6150 -0.2800 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6570 -0.1030 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0820 1.2850 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4860 3.7380 4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2170 2.2970 5.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 1.5600 1.6210 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6580 2.5130 1.2200 H 0 0 0 0 0 0 0 0 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 1 51 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 2 51 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 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 51 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END