CHEMBRIDGE-ZINC01178691 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3920 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 1.1860 -0.6760 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 0.0700 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -0.6870 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 -0.0400 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 1.3490 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 2.1460 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 1.4750 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 2.1360 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 3.6160 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 4.2910 0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 4.2120 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 5.6630 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4130 6.1470 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3240 5.3460 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7010 7.5900 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 8.0420 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2860 9.3960 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2440 10.3060 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 9.8660 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 8.5160 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 11.7570 0.0040 N 0 3 0 0 0 0 0 0 0 0 0 0 8.6880 12.1480 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6190 12.5610 0.0190 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1210 -2.1420 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -2.1340 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 1.9010 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 -0.6180 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7720 1.8230 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 3.2150 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 6.0400 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 6.0280 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8390 7.3330 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3080 9.7470 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 10.5830 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6290 8.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 -2.6350 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -2.6440 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -2.6320 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -2.6230 -0.9170 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 26 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 11 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 27 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END