CHEMBRIDGE-ZINC04311586 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2060 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4070 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 2.1580 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9740 3.1910 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2610 3.6160 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 2.8220 0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 1.9540 0.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9320 2.9080 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2230 2.0630 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4720 2.1500 2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2890 2.9810 2.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7890 1.2310 3.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0240 1.3060 4.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2700 0.4250 5.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2980 -0.4940 6.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1430 -0.5420 5.3690 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8590 0.2790 4.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 -0.7220 -0.0360 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6920 -1.9400 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -0.1060 -0.0420 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -1.7660 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 3.5950 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 4.4100 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6560 3.6450 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4990 1.3260 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7650 2.0340 4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2120 0.4540 6.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4880 -1.1830 6.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 0.2120 3.8860 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 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 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 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 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END