CHEMDIV-ZINC04955621 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 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 0.5210 -0.3700 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -0.5350 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -1.3500 1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -2.0640 3.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -2.7380 3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -2.6970 2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -1.9860 1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -1.3020 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -0.5310 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -0.3060 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 0.3800 -1.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -0.9050 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -0.5150 -1.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -1.2920 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 0.8040 -1.7530 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.5460 0.6140 -2.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7650 0.9950 -0.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 2.2040 -2.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 2.6670 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 3.7640 -3.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 4.3160 -4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 3.9320 -2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 2.9990 -1.5100 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 1.5320 -1.1660 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 0.2920 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -2.0950 3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -3.2960 4.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -3.2240 3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -1.9590 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 -1.9920 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -0.5430 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -2.0860 -3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6890 -0.6380 -3.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 -1.7300 -3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 2.2520 -4.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 4.7130 -1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 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 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 M END