CHEMBRIDGE-ZINC04817013 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.0320 1.5010 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0060 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -0.7040 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -2.0860 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -2.7740 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.0770 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.6890 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.7510 -2.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -4.1780 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -4.7490 -3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.0060 -4.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -6.0840 -3.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -6.6150 -5.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -5.8860 -6.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -6.4130 -7.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -7.6660 -7.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -8.3940 -6.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -7.8700 -5.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -8.6490 -4.4000 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6710 -9.7090 -4.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -8.2290 -3.2570 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3950 -8.2380 -9.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 1.8730 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.8650 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.8540 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.1680 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.6290 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -3.8540 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.1440 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -4.5080 -1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -4.5250 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -6.6770 -3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -4.9070 -5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -5.8460 -8.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -9.3730 -6.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -7.9500 -9.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -9.3250 -9.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -7.8540 -9.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 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 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END