IBS-ZINC02217306 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0270 1.1790 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.2100 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -0.8070 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -0.0080 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.3740 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 1.9750 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 2.1880 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 3.4120 0.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8130 1.4940 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9290 0.1100 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.4920 -0.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -0.5960 -0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -1.6020 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 2.2780 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4420 2.5230 1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 1.8800 2.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4010 3.5130 1.6460 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9740 3.8990 2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2690 3.1520 3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9870 3.6170 4.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4900 4.6090 5.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 1.6400 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -0.8280 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -1.8890 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 3.0560 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8620 1.7550 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 3.2420 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7370 4.0030 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1440 4.9800 2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2470 3.7070 3.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0700 2.0770 3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9540 3.2880 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0210 2.9460 4.7330 O 0 5 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 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 14 15 1 0 0 0 0 14 26 1 0 0 0 0 14 27 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 28 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 M CHG 1 33 -1 M END