CHEMBRIDGE-ZINC04712012 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3800 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0030 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.6800 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0930 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -0.6880 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 -0.0450 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -1.2500 -0.0560 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9640 -2.5370 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 -2.0180 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 -4.2620 -0.0650 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 -4.2090 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6740 -5.6140 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9130 -6.5590 -0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0050 -5.8210 -0.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5100 -7.1170 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8830 -7.3170 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3710 -8.6080 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4650 -9.6600 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1140 -9.3890 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6780 -8.1460 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5550 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -1.7600 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 1.9850 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 3.1730 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0160 1.0260 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 -3.6790 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4860 -3.6900 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6120 -5.0690 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5600 -6.4750 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4320 -8.7940 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8130 -10.6800 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 -10.2040 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 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 31 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 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 M END