IFLAB-ZINC05153077 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.1670 1.2630 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 0.1840 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -0.4420 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 0.0040 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 1.1090 -0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 1.7210 -0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 1.6080 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 1.1410 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 -0.6630 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0630 -0.9810 -0.3800 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7230 -0.5120 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0450 -2.5070 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 -2.8640 -2.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0300 -2.4150 -2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 -1.5860 -2.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1210 -3.0080 -4.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 -3.7600 -4.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -2.6150 -5.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -3.0830 -6.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0510 -4.2580 -6.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -4.0720 -6.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -5.1890 -6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -6.4580 -6.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -6.6140 -6.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -5.5630 -6.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6230 -0.7130 0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5280 0.2080 1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 -0.0410 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8040 -1.0980 3.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1800 -1.5120 1.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 1.7490 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -0.1660 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -1.2800 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 2.5620 -1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 1.2540 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 2.7050 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 1.3430 -1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 1.6280 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 -0.3160 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -1.7500 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 -2.9720 -0.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 -3.0110 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6710 -3.5180 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 -1.9810 -4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -2.2510 -7.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 -3.3490 -6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -3.0810 -6.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -5.0870 -7.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -7.6430 -6.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 -5.7620 -6.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0470 0.9680 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2580 0.4830 3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5560 -1.6440 4.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -0.3470 -0.6140 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3300 -0.7760 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 54 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 9 54 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 10 54 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END