CHEMBRIDGE-ZINC01153157 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 0 0 0 0 0999 V2000 -0.0630 1.5200 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 0.1340 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -0.5760 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 0.1120 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 1.5250 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 2.2200 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 2.1920 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 3.5650 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 4.1580 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1400 3.3870 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0380 2.0210 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 1.4120 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 0.0780 -0.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 -0.5680 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 -1.6710 0.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3630 3.9780 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8160 4.4900 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0960 4.2880 2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5590 4.8090 3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7380 5.5310 3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4560 5.7340 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0010 5.2100 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7880 5.4270 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9340 6.1760 0.2130 F 0 0 0 0 0 0 0 0 0 0 0 0 10.1600 4.1890 -0.6070 F 0 0 0 0 0 0 0 0 0 0 0 0 8.9990 6.1170 -0.9990 F 0 0 0 0 0 0 0 0 0 0 0 0 9.2310 6.0890 4.8320 N 0 3 0 0 0 0 0 0 0 0 0 0 8.5990 5.9110 5.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2690 6.7250 4.8600 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9990 2.0580 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -0.3950 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -1.6540 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 3.2990 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 4.1640 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0880 5.2220 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9290 1.4300 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1760 3.7240 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9990 4.6520 4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3770 6.2990 2.4150 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END