CHEMDIV-ZINC06806227 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 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 0.7420 -0.5110 1.2420 C 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 -1.6430 -1.7340 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -2.4170 -0.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -2.2450 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -1.4610 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 -1.9220 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 -3.2020 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -3.9840 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -3.5060 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2970 -5.5080 -1.5370 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.9000 -4.9920 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8480 -3.8100 -0.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0470 -5.7420 -1.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2140 -5.0190 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4860 -5.8160 -0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3820 -7.1960 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1330 -7.9090 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9010 -7.0510 -0.5190 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 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 0.0330 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -0.4810 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1250 -1.3060 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -4.1140 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1090 -4.8910 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2780 -4.0400 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3500 -5.2860 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5980 -5.9320 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3090 -7.0820 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2670 -7.7830 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0310 -8.8750 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2240 -8.0580 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0110 -7.5500 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8020 -6.9140 0.5580 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 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 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 M END