NIH-ZINC00617703 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -3.1740 1.3880 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -0.1060 2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 -0.6590 2.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -0.8930 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -0.2570 0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -0.9980 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -2.3690 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -3.0110 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -2.2790 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -4.3980 0.5770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -4.9510 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -4.2400 0.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -6.4190 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 -6.9940 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -8.3630 0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 -9.1760 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -8.6060 0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -7.2380 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -10.5590 0.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -11.3480 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -11.3140 1.7140 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 -12.5900 1.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 -10.3890 2.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0490 -11.4770 1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 1.7950 3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 1.6160 2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2020 1.8350 1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 0.8140 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -0.5050 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -2.9430 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -2.7770 1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -4.9620 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 -6.3640 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4930 -8.8080 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -9.2390 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -6.7960 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -11.6360 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 -12.2440 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 -10.7520 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0200 -12.0710 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6860 -11.9700 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4490 -10.4880 0.8230 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 2 0 0 0 0 2 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 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 M END