IBS-ZINC06759294 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -1.8380 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -2.5660 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -2.4160 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 -3.7330 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -4.0380 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 -5.3590 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4880 -6.3830 0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 -5.4080 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2220 -4.2830 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4340 -4.3710 0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6600 -3.0660 0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 -2.9080 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 -1.4910 0.0430 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 -1.8790 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1630 -6.7090 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 -7.1700 1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2880 -6.2760 2.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -4.7890 -0.0040 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 0.5120 -0.3560 -0.8950 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 -8.5640 -2.1870 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3070 -1.2890 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3230 -1.2790 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1260 -6.6190 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 -7.4380 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8050 -8.1760 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4320 -7.1750 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4750 -6.5080 3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -5.0500 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -5.6760 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -4.4070 -0.5240 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 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 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 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 M END