IFLAB-ZINC05240718 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.5890 -1.4900 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -2.3420 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -2.9160 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.2880 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -5.1050 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -4.5560 -2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -3.1680 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -2.5730 -3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -1.3640 -3.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -3.3700 -4.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -2.8110 -5.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -3.5270 -6.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 -2.6930 -7.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -1.3870 -7.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 -1.1390 -5.8410 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 -0.2780 -8.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 -0.8630 -9.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 -2.1180 -9.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 -3.2340 -8.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 -4.9920 -6.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -5.6100 -7.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 -5.6560 -6.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -2.2860 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 -4.7290 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -6.1790 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -5.1980 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 -4.3340 -4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 0.1380 -8.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 0.5030 -7.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8890 -0.1270 -10.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 -1.1240 -8.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 -1.8990 -10.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7120 -2.4370 -10.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9890 -3.5660 -8.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 -4.0700 -9.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -5.1630 -5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 -6.6250 -6.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 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 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END