CHEMBRIDGE-ZINC01197644 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3900 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 1.1780 -0.6890 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0140 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 -0.6670 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 0.0360 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 1.4480 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 2.1420 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4330 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 2.1060 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 2.1880 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1130 1.5820 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0570 3.5350 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3490 4.1970 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1490 5.6900 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0270 6.1520 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3140 6.5900 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1320 7.9760 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2290 8.8120 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5070 8.2820 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6950 6.9100 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6090 6.0620 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6790 9.1860 -0.0610 N 0 3 0 0 0 0 0 0 0 0 0 0 11.5170 10.3930 -0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8050 8.7220 -0.0740 O 0 5 0 0 0 0 0 0 0 0 0 0 5.9760 -0.6290 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9090 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -0.5480 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 -1.7460 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 3.2220 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 3.1850 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9150 3.9010 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8980 3.9100 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1350 8.3910 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0900 9.8830 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6960 6.5040 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7570 4.9920 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 -0.8170 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 26 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 31 1 0 0 0 0 9 10 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 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 39 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END