IBS-ZINC04937825 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.6030 1.6590 -1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 0.3520 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -0.4760 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -0.9960 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -2.1030 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -2.4980 -2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -3.8950 -3.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -4.3360 -3.8930 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2670 -3.7920 -3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -5.8610 -3.6560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8310 -6.1880 -3.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -4.9360 -2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -4.9060 -1.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -7.3010 -2.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -6.1480 -2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -5.3510 -1.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -7.4200 -2.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -7.4800 -2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 -8.6520 -2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -9.7680 -2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -9.7180 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -8.5460 -3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -4.0170 -5.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -3.6480 -6.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -3.3680 -7.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -3.4610 -8.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -3.8340 -7.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -4.1150 -6.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -3.1110 -9.7870 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 2.1070 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 1.5120 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 2.3810 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 0.4710 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -0.0410 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -0.9830 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 0.5960 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -2.0710 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -0.4860 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -0.8150 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -2.1690 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -2.7720 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.8790 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -2.3680 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -6.3960 -4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -6.6180 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 -8.6960 -1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 -10.6830 -2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -10.5980 -3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -8.5570 -3.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 -3.5750 -5.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -3.0830 -8.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -3.9130 -7.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -4.4060 -5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -0.6750 -1.0130 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6270 -0.5270 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 54 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 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 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 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 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END