IBS-ZINC05450789 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 1 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 3 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 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -1.1880 -2.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.6550 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -0.3650 2.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -1.1770 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 -1.2430 2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3640 -1.7650 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4870 -1.0290 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5820 -1.8490 2.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5040 -1.5470 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1810 -3.1660 2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 -3.1710 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0830 -4.3830 2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -5.5610 2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1650 -5.5610 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8670 -4.3760 2.6520 C 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 -1.8100 -0.7430 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -0.5100 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -2.1740 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 -1.9100 3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -0.2460 3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5210 0.0510 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -4.3910 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2410 -6.4980 2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 -6.4990 2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9470 -4.3860 2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -0.1470 -1.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -0.4830 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 34 35 1 0 0 0 0 M END