CHEMBRIDGE-ZINC02947605 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -2.0250 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.6700 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -1.9280 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -0.5360 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1040 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9630 -2.6200 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1620 -2.0180 0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9770 -5.0050 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1120 -2.9270 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 -4.1450 0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 -3.9220 0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8460 -2.6110 0.0750 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.8360 -0.8010 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2530 -0.2910 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1800 -1.0730 0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5140 1.1580 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8280 1.6350 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0640 2.9940 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0050 3.8840 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7010 3.4190 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4490 2.0640 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -2.5990 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -3.7490 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 0.0420 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 1.1830 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3110 -0.4460 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3290 -0.4360 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6560 0.9420 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0790 3.3640 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1960 4.9470 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 4.1200 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4310 1.7020 0.1050 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 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 12 2 0 0 0 0 11 13 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 M END