CHEMBRIDGE-ZINC02464512 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 28 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1590 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -2.6880 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -4.5020 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 -4.9340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -6.4560 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8830 -6.8060 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2600 -8.1000 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -8.9750 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7230 -8.4580 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -0.2200 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -2.5100 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -2.5200 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -2.3370 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -2.3270 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 -4.5260 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -4.5170 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -6.8640 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -6.8740 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5540 -6.1050 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3210 -7.5470 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9620 -9.0390 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9450 -9.0490 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 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 17 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 M END