IBS-ZINC05452114 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5030 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6930 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -2.0090 -0.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.7150 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -4.0920 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -4.2550 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -3.0720 0.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -2.0880 0.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -0.7190 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -0.0670 0.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 0.7650 -0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3550 0.3390 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0920 0.3550 0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 -0.5640 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -0.1880 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -5.1740 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -6.2170 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -7.2220 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -7.1970 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -6.1660 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -5.1580 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.0740 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.8620 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8560 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -5.2000 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 1.8150 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 0.6210 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 1.0320 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -0.6680 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2520 -0.5210 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 -1.5740 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -0.9640 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 0.7630 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -6.2380 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -8.0300 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 -7.9860 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -6.1520 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -4.3550 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 0.2570 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -0.5070 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.0260 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 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 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M END