IFLAB-ZINC05258652 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 1 0 0 0 0 0999 V2000 0.0010 1.5220 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.0080 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5410 -0.3600 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -0.5120 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -2.4950 2.3660 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3110 -1.8980 3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -3.9510 2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -4.0120 2.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -2.9910 2.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -5.2000 3.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -5.2480 3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -4.1610 4.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0810 -4.2100 4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 -5.3420 4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 -6.4310 3.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -6.3940 3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -7.5200 2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -8.4130 2.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -2.4210 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -1.9800 1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -0.5040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 1.9000 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.8810 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 1.8740 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -0.0630 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -0.2360 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -4.5300 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -4.3650 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -6.0220 3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -3.2750 4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 -3.3620 5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8740 -5.3710 4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -7.3110 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -0.2290 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -1.9740 1.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -2.4110 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 -2.8460 3.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 -2.7780 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 5 35 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 17 18 3 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 21 34 1 0 0 0 0 35 36 1 0 0 0 0 37 38 1 0 0 0 0 M END